Patent Publication Number: US-2016237169-A1

Title: Binding Moieties Based On Shark IgNAR Domains

Description:
FIELD OF THE INVENTION 
     The present invention relates to immunoglobulin new antigen receptors (IgNARs) from fish and uses thereof. In particular, the present invention relates to modified IgNAR variable domains and to domains from members of the immunoglobulin superfamily that have been modified to include structural features derived from IgNAR variable domains. 
     BACKGROUND OF THE INVENTION 
     The immunoglobulin superfamily (IgSF) includes immunoglobulins and numerous other cell surface and soluble molecules that mediate recognition, adhesion or binding functions in the immune system. They share partial amino acid sequence homology and tertiary structural features that were originally identified in immunoglobulin (Ig) heavy and light chains. 
     Molecules of the IgSF are identified by a characteristic IgSF fold structure, a β-sandwich structure formed by two β-sheets, packed face-to-face and linked by a disulphide bond between the B and F strands (Bork 1994; Chothia 1998). IgSF frameworks are further classified into 3-4 major categories, the Variable (V)-, Constant (C)-, I- and I2-sets, based on β-strand number, configuration and hydrogen bond patterns (Bork 1994; Cassasnovas 1998). 
     Conventional immunoglobulins have two heavy polypeptide chains linked by disulphide bonds at a hinge portion, and two light polypeptide chains, each of which is linked to a respective heavy chain by disulphide bonding. Each heavy chain comprises a variable (VH) domain at the N-terminal end and a number of constant (CH) domains. Each light chain has a variable (VL) domain at the N-terminal end and a constant (CL) domain at the C-terminal end, the VL and CL domains aligning with the VH domain and the first CH domain, respectively. Unlike immunoglobulins, T-cell receptors (TCRs) are heterodimers having α and β chains of equal size, each chain consisting of an N-terminal variable domain (Vα or Vβ) and a constant domain. 
     Typically, the variable domains on different polypeptide chains interact across hydrophobic interfaces to form binding sites designed to receive a particular target molecule. In the case of immunoglobulins, each pair of VH/VL domains form an antigen binding site, the CH and CL domains not being directly involved in binding the antibody to the antigen. Similarly, in the case of TCRs, the Vα and Vβ domains form the binding site for target molecules, namely peptides presented by a histocompatibility antigen. 
     The amino acid sequences of variable domains vary particularly from one molecule to another. This variation in sequence enables the molecules to recognise an extremely wide variety of target molecules. Variable domains are often viewed as comprising four framework regions, whose sequences are relatively conserved, connected by three hypervariable or complementarity determining loop regions (CDRs) (Kabat 1983 &amp; 1987; Bork 1994). The CDRs are held in close proximity by the framework regions and, with the CDRs from the other variable domain, contribute to the formation of the binding site. 
     With the development of new molecular biology and recombinant DNA techniques, research interest in the IgSF field has increased. Among the main reasons for this increased interest is the desire to develop novel therapeutics and diagnostics based on immunoglobulins or other IgSF molecules. 
     Using the hybridoma technique developed by Kohler and Milstein, the production of monoclonal antibodies (MAbs) of almost any specificity is now well known. However, the production of human antibodies remains difficult, with the vast majority of MAbs produced being of rodent, in particular mouse, origin. Such antibodies are often antigenic in humans. 
     Researchers have therefore investigated producing modified immunoglobulins which are as “human” as possible, but which still retain the appropriate specificity. For example, “chimeric” antibodies have been constructed in which an animal antigen-binding variable domain is coupled to a human constant domain. The isotype of the human constant domain may be selected to tailor the chimeric antibody for participation in antibody-dependent cellular cytotoxicity (ADCC) and complement, dependent cytotoxicity. However, chimeric antibodies typically may contain about one third rodent (or other non-human species) sequence and consequently are often still capable of eliciting a significant antigenic response in humans. 
     In a further effort to resolve the antigen binding functions of antibodies and to minimize the use of heterologous sequences in human antibodies, others have modified the specific domains by, for example, substituting rodent CDRs for CDR sequences from the corresponding segments of a human antibody. In some cases, substituting CDRs from rodent antibodies for the human CDRs in human frameworks is sufficient to transfer high antigen binding affinity as described in EP 239400. 
     An alternative approach has been to use fragments of immunoglobulins or other molecules of the IgSF. For example, specific binding reagents can be formed by association of only the VH and VL domains into a Fv module. Bacterial expression is then enhanced by joining the variable domains with a linker polypeptide into a single-chain scFv molecule. 
     Methods to improve the expression and folding characteristics of single-chain Fv molecules have been described by Nieba (1997). The properties of single V-domains, derived from natural mammalian antibodies, have been described in WO 90/05144, EP 368684 and WO 91/08482. Single camelid V-domains have been described by WO/96/34103 and in WO/94/25591. A method for reducing the hydrophobicity of the surface of a human VH domain by replacing human amino acid sequences with camelid amino acid sequences was described by Davies and Riechmann (1994). Methods to exchange other regions of human VH sequences with camel sequences to further enhance protein stability, including the insertion of cysteine residues in CDR loops, were described by Davies and Riechmann (1996). 
     Several attempts to engineer high-affinity single domain binding reagents using either the VH or VL domains alone, have been unsuccessful, due to lack of binding specificity and the inherent insolubility of single domains exposing unpaired hydrophobic VH/VL binding faces (Kortt 1995). 
     The TCR has two variable domains that combine into a structure similar to the Fv module of an antibody that results from combination of the VH and VL domains. Novotny (1991) described how the Vα and Vβ domains of the TCR can be fused and expressed as a single chain polypeptide and, further, how to alter surface residues to reduce the hydrophobicity directly analogous to an antibody scFv. Other publications describe the expression characteristics of single-chain TCRs comprising two Vα and Vβ domains (Wulfing 1994; Ward 1991). 
     The three-dimensional crystal structures have been published for intact immunoglobulins, a variety of immunoglobulin fragments, antibody-antigen complexes and for other IgSF molecules such as the TCR. It is known that the function of IgSF molecules is dependent on their three dimensional structure, and that amino acid substitutions can change the three-dimensional structure of, for example, an antibody (Snow and Amzel 1986). Based upon molecular modelling, it has been shown that the antigen binding affinity of a humanized antibody can be increased by mutagenesis (Riechmann 1988; Queen 1989). 
     The Immunoglobulin New Antigen Receptors (IgNARs) are an unconventional subset of antibodies recently identified in fish. In domain structure, IgNAR proteins are reportedly similar to other immune effector molecules, being disulphide-bonded homodimers of two polypeptide chains having five constant domains (C NAR s) and one variable domain (V NAR ) (Greenberg 1995). However, unlike conventional antibodies, there are no associated light chains and the individual variable domains are independent in solution and do not appear to associate across a hydrophobic interface (as seen for conventional VH/VL type antibodies) (Roux 1998). 
     IgNARs have been identified in all shark species studied to date. In particular, IgNARs have been identified in the serum of nurse sharks  Ginglymostoma cirratum  (Greenberg 1995) and wobbegong sharks  Orectolobus maculatus  (Nuttall 2001). The cell-surface expression of IgNARs has also been reported (Rumfelt 2002). Research has implicated IgNARs as true molecules of the immune armoury, and as the most probable agents of the shark antigen-driven affinity-maturation antibody response (Diaz 1999; Nuttall 2002; Dooley 2003). 
     IgNARs identified to date have been placed into three categories based on their time of appearance during the shark development and on their postulated disulphide bonding pattern within the variable domains (Diaz 2002; Nuttall 2003). Type 1 V NAR  topology is characterised by an extra framework disulphide linkage and, usually, cysteines in the extended loop region analogous to a conventional CDR3 loop, which it has been suggested may form intra-loop disulphide bonds. Type 2 V NAR  topology is characterised by cysteines in the loop regions analogous to conventional CDR1 and CDR3 loops in approximately two thirds of cases, which it has been postulated may form inter-loop disulphide bonds. Type 3 V NAR  topology is characterised by a relatively constant sized loop region analogous to a conventional CDR3 loop of limited diversity and a characteristic conserved tryptophan residue within the loop region analogous to a CDR1 loop. 
     Regardless of type, all IgNARs identified to date are reported as having minimally variable loop regions analogous to conventional CDR1 and CDR2 loops, with diversity being concentrated in an elongated loop region analogous to a conventional CDR3 loop (Greenberg 1995; Nuttall 2001; Diaz 2002). The elongated loop region can reportedly vary in length from 5 to 23 residues in length, though the modal classes are more in the order of 15 to 17 residues (Nuttall 2003). This is significantly larger than for conventional murine and human antibodies, but approximate to the extended CDR3 loops found in camelid single VH antibodies (Wu 1993; Muyldermans 1994). 
     Large bacteriophage libraries have been generated based upon the Type 2 V NAR  repertoire from wobbegong sharks and used to isolate a number of Type 2 V NAR s proteins encapsulating significant variability within the framework and the loop region analogous to a conventional CDR1 loop. However, the most significant diversity was within the extended loop region analogous to a conventional CDR3 loop, the extended loop region varying in both length and amino acid composition (Nuttall 2001; Nuttall 2003). 
     Various computer-modelled structures for Type 2 V NAR s have been reported in the literature (Roux 1998; Nuttall 2001; Diaz 2002; Nuttall 2004). Although such computer modelling can offer key insights into structure, the definitive structure remains to be determined from crystallographic analysis. In the case of V NAR s, the elucidation of the crystal structure is particularly important. 
     SUMMARY OF THE INVENTION 
     In a first aspect, the present invention provides a crystal of a variable domain of a Type 2 IgNAR that effectively diffracts X-rays for the determination of the atomic coordinates of the variable domain of the IgNAR to a resolution of better than 4.0 Å, wherein the variable domain of the Type 2 IgNAR consists of 105 to 125 amino acid residues and comprises an amino acid sequence according to Table 1 and/or  FIG. 1 . 
     In another aspect, the present invention provides a crystal of a variable domain of a Type 2 IgNAR comprising a structure defined by all or a portion of the coordinates of Appendix I(a), (b), (c) or (d)±a root mean square deviation from the Ca atoms of less than 0.5 Å. 
     In another aspect, the present invention provides a method of homology modelling comprising the steps of: (a) aligning a representation of an amino acid sequence of an IgSF domain with the amino acid sequence of 12Y-1, 12Y-2, 12A-9 or 1A-7 as shown in  FIG. 1  to match homologous regions of the amino acid sequences; (b) modelling the structure of the matched homologous regions of said IgSF domain on the corresponding regions of the 12Y-1, 12Y-2, 12A-9 or 1A-7 structure as defined by Appendix I(a), (b), (c) or (d); and (c) determining a conformation (e.g. so that favourable interactions are formed within the IgSF domain and/or so that a low energy conformation is formed) for said IgSF domain which substantially preserves the structure of said matched homologous regions. 
     In another aspect, the present invention provides a method for determining the structure of a protein, which method comprises; providing the co-ordinates of Appendix I(a), (b), (c) or (d), and either (a) positioning the co-ordinates in the crystal unit cell of said protein so as to provide a structure for said protein or (b) assigning NMR spectra Peaks of said protein by manipulating the coordinates of Appendix I(a), (b), (c) or (d). 
     In another aspect, the present invention provides systems, particularly a computer system, the systems containing at least one of the following: (a) atomic coordinate data according to Appendix I, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7 or at least selected coordinates thereof; (b) structure factor data (where a structure factor comprises the amplitude and phase of the diffracted wave) for 12Y-1, 12Y-2, 12A-9 or 1A-7, said structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of an IgSF domain generated by homology modelling of the IgSF domain based on the data of Appendix I; (d) atomic coordinate data of the IgSF domain generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d). 
     In another aspect, the present invention provides a computer-readable storage medium, comprising a data storage material encoded with computer readable data, wherein the data are defined by all or a portion (e.g. selected coordinates as defined herein) of the structure coordinates of 12Y-1, 12Y-2, 12A-9 or 1A-7, or a variant of 12Y-1, 12Y-2, 12A-9 or 1A-7, wherein said variant comprises backbone atoms that have a root mean square deviation from the Ca or backbone atoms (nitrogen-carbonα-carbon) of Appendix I of less than 2 Å, such as not more than 1.5 Å, preferably less than 1.5 Å, more preferably less than 1.0 Å, even more preferably less than 0.74 Å, even more preferably less than 0.72 Å and most preferably less than 0.5 Å. 
     In another aspect, the present invention provides a computer-readable data storage medium comprising a data storage material encoded with a first set of computer-readable data comprising a Fourier transform of at least a portion (e.g. selected coordinates as defined herein) of the structural coordinates for 12Y-1, 12Y-2, 12A-9 or 1A-7 according to Appendix I; which, when combined with a second set of machine readable data comprising an X-ray diffraction pattern of a molecule or molecular complex of unknown structure, using a machine programmed with the instructions for using said first set of data and said second set of data, can determine at least a portion of the structure coordinates corresponding to the second set of machine readable data. 
     In another aspect, the present invention provides computer readable media with at least one of: (a) atomic coordinate data according to Appendix I recorded thereon, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, or at least selected coordinates thereof; (b) structure factor data for 12Y-1, 12Y-2, 12A-9 or 1A-7 recorded thereon, the structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of a target IgSF domain generated by homology modelling of the IgSF domain based on the data of Appendix 1; (d) atomic coordinate data of a modified IgSF domain generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d). 
     In another aspect, the present invention provides a method of providing data for generating structures and/or performing rational drug design for IgSF domains, the method comprising: (i) establishing communication with a remote device containing computer-readable data comprising at least one of: (a) atomic coordinate data according to Appendix I, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, at least one sub-domain of the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, or the coordinates of a plurality of atoms of 12Y-1, 12Y-2, 12A-9 or 1A-7; (b) structure factor data for 12Y-1, 12Y-2, 12A-9 or 1A-7, said structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of a modified IgSF domain generated by homology modelling of the domain based on the data of Appendix I; (d) atomic coordinate data of a protein generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d); and (ii) receiving said computer-readable data from said remote device. 
     In another aspect, the present invention provides a method of altering a property of an IgNAR variable domain comprising eight β-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 , said method comprising modifying the IgNAR variable domain within at least one of the β-strand regions or loop regions. 
     In another aspect, the present invention provides a binding moiety comprising a modified IgNAR variable domain produced by a method according to any one of claims  1  to  5 . 
     In another aspect, the present invention provides a binding moiety comprising an IgNAR variable domain comprising eight β-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 , wherein the IgNAR variable domain has been modified within at least one of the β-strand regions or loop regions. 
     In a further aspect, the present invention provides a method of modifying an I-set domain, said method comprising inserting and/or substituting one or more structural features from an IgNAR variable domain into the I-set domain. 
     In another aspect, the present invention provides a binding moiety comprising a I-set domain, wherein the I-set domain has been modified by insertion and/or substitution of one or more structural features from an IgNAR variable domain into the I-set domain and/or by introducing a modification into a region equivalent to loop region 4 or loop region 8 of an IgNAR variable domain 
     In a further aspect, the present invention provides a method of modifying a V-set domain, said method comprising inserting and/or substituting one or more structural features from an IgNAR variable domain into the V-set domain. 
     In another aspect, the present invention provides a binding moiety comprising a V-set domain, wherein the V-set domain has been modified by insertion and/or substitution of one or more structural features from an IgNAR variable domain into the V-set domain and/or by introducing a modification into a region equivalent to loop region 4 or loop region 8 of an IgNAR variable domain. 
     In another aspect, the present invention provides a binding moiety comprising a multimer comprising:
     (i) at least two IgNAR domains, which may be the same or different, and at least one of which is a IgNAR variable domain;   (ii) at least two I-set domains, which may be the same or different, and at least one of which is a I-set domain according to the present invention; or   (iii) at least two V-set domains, which may be the same or different, and at least one of which is a V-set domain according to the present invention.   

     In another aspect, the present invention provides a binding moiety according to the invention linked to a diagnostic reagent. 
     In another aspect, the present invention provides a binding moiety according to the invention immobilised on a solid support or coupled to a biosensor surface. 
     In another aspect, the present invention provides a polynucleotide encoding a binding moiety according to the invention. 
     In another aspect, the present invention provides a vector comprising a polynucleotide according to the present invention. 
     In another aspect, the present invention contemplates a host cell comprising a vector according to the invention. 
     In another aspect, the present invention provides a method of producing a binding moiety according to the invention which comprises culturing a host cell of the present invention under conditions enabling expression of the binding moiety according to the invention and optionally recovering the a binding moiety. 
     In another aspect, the present invention provides a pharmaceutical composition comprising a binding moiety according to the invention and a pharmaceutically acceptable carrier or diluent. 
     In another aspect, the present invention provides a method of treating a pathological condition in a subject, which method comprises administering to the subject a binding moiety according to the invention. 
     In another aspect, the present invention provides a method of selecting a binding moiety according to the invention with an affinity for a target molecule which comprises screening a library of polynucleotides of the present invention for expression of a binding moiety according to the invention with an affinity for the target molecule. 
     In a further aspect, the present invention provides a polynucleotide library comprising a plurality of polynucleotides encoding binding moieties according to the invention, which polynucleotides comprise one or more modifications in the IgNAR variable domain, I-set domain or V-set domain. 
    
    
     
       BRIEF DESCRIPTION OF THE FIGURES 
         FIG. 1 . Amino acid sequence alignment of V NAR s 12Y-1, 12Y-2, 12A-9 and 1A-7 with 12 naturally occurring Type 2 IgNAR variable domain sequences. 
         FIG. 2 . 2D topology diagram of the 12Y-1, 12Y-2, 12A-9 and 1A-7 folds showing the loop regions and β-strand regions. The labelled 8 strands form a sandwich of 2 sheets: front and back sheets are shown with thick and thin arrows, respectively. The switch of N-terminal strand A to A′, adjacent to the bulge in the C-terminal strand G, is shown as a kink between the A and A′ strands. 
         FIG. 3 . Detailed 2D topology diagram of the 12Y-1, 12Y-2, 12A-9 and 1A-7 folds showing the loop regions and β-strand regions. The labelled 10 strands form a sandwich of 2 sheets: front and back sheets are shown with thick and thin arrows, respectively. The disulfide bond is indicated as a horizontal line connecting the B and F strands. The switch of N-terminal strand A to A′, adjacent to the bulge in the C-terminal strand G, is shown as a kink between the A and A′ strands. 
         FIG. 4 . H-bond pattern of the 12Y-2 β-sheets. β-sheets are presented as filled circles, and broken lines represent H-bonds between main-chain atoms. 
         FIG. 5 . Stereo images of superimposed IgSF domains in ribbon representation of the 12Y-2 A chain, the 12Y-2 B chain and the 12Y-1 chain. Figures were produced using VMD. The CDR1 analogous region (loop region 4) and CDR3 analogous region (loop region 8) are labelled. 
         FIG. 5 a   . Stereo images of superimposed 1A-7 A chain, 1A-7 C chain and 12Y-2 A chain. Figures were produced using VMD. The CDR1 analogous region (loop region 4) and CDR3 analogous region (loop region 8) are labeled. 
         FIG. 6 . Stereo images of superimposed IgSF domains in ribbon representation of the 12Y-2 A chain, Telokin (1FHG) and the NCAM domain 1 (1QZ1). Figures were produced using VMD. 
         FIG. 7 . Stereo images of superimposed IgSF domains in ribbon representation of the 12Y-2 A chain, human TCR V α  (1A07), human V H  and V L  (1IGM), and camel V H H (1MEL). Figures were produced using VMD. 
         FIG. 8 . CDR analogous regions in V NAR  12Y-2. The 12Y-2 chain A structure in ribbon representation is overlayed with transparent molecular surface. The positions of the CDR1, “CDR2” and CDR3 analogous regions are indicated. 
         FIG. 9 . CDR analogous regions in V NAR  12Y-2. Overlay of the CDR1 analogous region (loop region 4) of the 12Y-2 chain A and the CDR1 of human V L  (1HZH) (r.m.s.d. 1.22 Å 2 ) in liquorice representation. 
         FIG. 10 . CDR analogous regions in V NAR  12Y-2. Positioning of the CDR1 analogous region (loop region 4) and the CDR3 analogous region (loop region 8) in the 12Y-2 chain A in ribbon representation. Residues Phe29 and Lys32 (possible half-cystine positions) are oriented toward the CDR3 analogous region (loop region 8), ideally placed to make inter-loop contacts. 
         FIG. 11 . CDR analogous regions in V NAR  12Y-2. Backbone of CDR3 analogous region (loop region 8) in the 12Y-2 chain A (86-103). β-hairpin main-chain hydrogen bonds are shown by dashed lines. Residues at the mutation positions (Pro90Leu and Phe100Leu) and residues at the tip of the loop (Tyr94 and Tyr96) are shown with side-chains. 
         FIG. 12 . CDR analogous regions in V NAR  12Y-2. Overlay of the backbone “CDR2” region (loop region 5) of the 12Y-2 chain A in liquorice representation and CDR2 of human V H  (1hzh) in ribbon semitransparent representation. This figure was produced using VMD. 
         FIG. 13A&amp;13B . Structures of the V NAR  12Y-2 2-fold symmetry dimer.  13 A View from the top of the CDR3 analogous region (loop region 8) and  13 B side view. Each chain is shown in ribbon representation. The N and C termini, and the CDR1 analogous region (loop region 4) and CDR3 analogous region (loop region 8) of each chain are labelled. 
         FIG. 14 . MOLSCRIPT/RASTERED3D diagram of the 12A-9 chain. The chain is shown in ribbon representation. Cysteine residues are shown as ball-and-sticks. 
         FIG. 15A-15C . MOLSCRIPT/RASTERED3D diagrams of  15 A 1A-7 chain A,  15 B 1A-7 chain A and B dimer, and  15 C 1A-7 chains A, B, C and D in the asymmetric unit of crystal structure. Each chain is shown as a ribbon representation. The N- and C-termini and the CDR analogous regions are labeled. 
         FIG. 16 . ELISA analysis of 12 14M-15 variants (12Y-2 with Pro90Leu) for binding to AMA1 and a control negative antigen. Comparative expression levels are also shown. The CDR1 analogous region (loop region 4) has been shuffled in the variants. 
         FIG. 17 . Amino acid sequence alignment of 14M-15 variant IgNAR clones in which the CDR1 analogous region (loop region 4) has been shuffled. Five clones with affinity for the AMA-1 antigen (24A-82, 24A-72, 24A-58, 24A-75, 24A-46) and five with no affinity (24A-24, 24A-28, 24A-33, 24A-10, 24A-19) are shown. Sequence differences map predominantly to the CDR1 analogous region (loop region 4), with some contribution from framework residues. 
         FIG. 18 . Titres of total eluted phage from 12Y-2 loop library panned against different malarial strains: W2MEF (-♦-), W2MEF (-▪-), W2/HB/W2/3D7 (-▴-), HB3 (-x-), HB3 (-*-), HB/W2/HB/3D7 (--). The initial titre of phage added for reading 1 pan is taken as the zero reading. 
         FIG. 19 . Schematic diagram of loop region 8 (analogous to CDR3) variability for IgNAR libraries. Loop region 8 varies in length and in coding sequence and randomization strategy. Generations 1 to 3 are based on the existing shark libraries. Generation 4 libraries were designed with reference to the structures of 12Y-1 and 12Y-2. Oligonucleotides A0298, A0296, A0297, A0295, 8477, 8476, 7210, 7211, 6980 and 6981 correspond to SEQ ID Nos: 61-70, respectively. 
         FIG. 20 . Schematic diagram of loop region 8 (analogous to CDR3) variability for IgNAR libraries based on the 12Y-2 structure. The tip of the 12Y02 loop region 8 is modified by 6 different strategies, varying in amino acid randomisation, loop length and amino acid variation pattern. Oligonucleotides KH0001RC, KH0002RC, KH0003RC, KH0004RC, KH0005RC and KH0006RC correspond to SEQ ID Nos: 71-76, respectively. 
         FIG. 21A-21C .  21 A Modelled liquorice representation of CDR3 analogous loop (loop region 8) of the 12Y-2 structure showing the position of the Leu89 and Ser97 residues.  21 B Portion of the 12Y-2 nucleotide/amino acid sequences showing the CDR3 analogous region (light shade).  21 C Schematic diagram of loop region 8 (analogous to CDR3) libraries based on the 12Y-2 structure, where the tip of the 12Y-2 loop region 8 has been modified by 6 different strategies, varying in amino acid randomisation, loop length, and amino acid variation pattern. 
         FIG. 22A-22E :  22 A ELISA analysis of 40 12Y-2 variants binding to AMA-1 and a control negative antigen.  22 B Alignment of 12Y-2 variants 22A-2 (Thr39Ser; Pro90Leu) and 14M-15 (Pro90Leu).  22 C Three-dimensional structure of 12Y-2 illustrating affinity-enhancing CDR1 and CDR3 mutation and the framework affinity-enhancing mutation Thr39Ser.  22 D FPLC traces of 12Y-2 variants 14M-15 and 22A-2. Both show identical expression and folding characteristics.  22 E Biosensor traces of purified 12Y-2 variant proteins 14M-15 and 22A-2. 22A-2 shows 2-fold enhanced affinity over 14M-15 (20-fold better affinity than 12Y-2). 
         FIG. 23A-23C :  23 A Schematic figure of NCAM (CD56) ectodomain showing Ig superfamily and fibronectin domains.  23 B Amino acid sequences of NCAM domain 1 (21H-5) and domain 1+2 (21G-1) recombinant proteins. Dual C-terminal FLAG affinity tags are not shown.  23 C FPLC traces of NCAM domain 1 (21H-5) and domain 1+2 (21G-1) recombinant proteins. 
         FIG. 24A-24C :  24 A Schematic figure of Myosin Light Chain Kinase showing Ig, catalytic, and Telokin domains.  24 B Protein sequences of human wild type Telokin (21J-4). Dual C-terminal FLAG affinity tags are not shown.  24 C FPLC trace of Telokin (21J-4) recombinant protein. 
         FIG. 25A-25E :  25 A Alignment of NCAM domain 1 (21H-5) and loop-graft variant 23B-2. Dual C-terminal FLAG affinity tags are not shown.  25 B FPLC traces of NCAM domain 1 (21H-5) and loop-graft variant 23B-2 recombinant proteins. Protein 23B-2 shows a “cleaner” profile.  25 C SDS-PAGE profiles of NCAM domain 1 (21H-5) and domain 1 loop-graft variant 23B-2. NCAM domain 1+2 (21G-1) is shown for comparison.  25 D ELISA analysis showing binding of NCAM domain 1 loop-graft variant 23B-2 to the target antigen (monoclonal antibody 5G-8) but not to negative control antigens. The parental anti-5G-8 IgNAR (1A-7) similarly binds, but not the wild type NCAM domain 1 or domain 1+2.  25 E Biosensor traces of NCAM domain 1 (21H-5) and loop-graft variant 23B-2 recombinant proteins. The loop graft protein binds. The wild type does not. 
         FIG. 26A-26E :  26 A Alignment of Telokin (21J-4) and loop-graft variants 23C-7 and 23F-4. Dual C-terminal FLAG affinity tags are not shown.  26 B FPLC traces of recombinant proteins 21J-4, 23C-7, and 23F-4.  26 C SDS-PAGE profiles of recombinant proteins 21J-4, 23C-7, and 23F-4.  26 D ELISA analysis showing binding of Telokin loop-graft variants 23C-7 and 23F-4 to the target antigen (monoclonal antibody 5G-8) but not to negative control antigens. The parental anti-5G-8 IgNAR (1A-7) similarly binds, but not the wild type Telokin (21J-4).  26 E Biosensor traces of Telokin (21J-4) and loop-graft variant 23F-4 recombinant proteins. The loop graft protein binds. The wild type does not. 
         FIG. 27A-27E :  27 A Alignment of 12Y-2 variants 14M-15 and 21B-5.  27 B Affinity purified proteins 21B-5 and 14M-15 binding to the target antigen AMA1 and a negative control antigen.  27 C FPLC traces of 12Y-2 variants 14M-15 and 21B-5, the disulphide-bonded dimer runs as a dimer.  27 D Biosensor traces of purified 21B-5 monomeric and dimeric forms. The disulphide-bonded dimer does not bind the target antigen, demonstrating both the importance of the CDR3 and that the novel dimer form presents a different interface to antigen than the monomeric protein.  27 E SDS-PAGE and western blot analysis 12Y-2 variants 14M-15 and 21B-5. The disulphide-bonded dimer runs as a dimeric form in the absence of reducing agent (β-mercaptoethanol). Incorporation of Leu99Cys drives the dominant protein form to dimer. 
         FIG. 28 : Schematic diagram of CDR1 and CDR3 variability for NCAM domain 1 libraries. CDR1 and CDR3 both vary in length and in coding sequence and randomization strategy. The NCAM wild type sequence is given for comparison. Framework residues N- and C-terminal to the CDR loop regions are also shown. 
         FIG. 29 : Schematic diagram of CDR1 and CDR3 variability for Telokin libraries. CDR1 and CDR3 both vary in length and in coding sequence and randomization strategy. The Telokin wild type sequence is given for comparison. Framework residues N- and C-terminal to the CDR loop regions are also shown. 
         FIG. 30A-30D . Immunopanning of NCAM domain 1 library by bacteriophage display against amyloid αβ (1-42) peptide ( 30 A&amp; 30 B) and the Carcino Embryonic Antigen (CEA) ( 30 C&amp; 30 D). Binding to antigens ( 30 A&amp; 30 C) and comparative expression levels of individual clones ( 30 B&amp; 30 D) are shown. 
         FIG. 31 .  FIG. 30 a   : Titres of eluted phage/ml from NCAM library panned against monoclonal antibody 5G8 (-♦-), AMA1 (-▪-), Hepatitis B virus E antigen (-▴-), ab 1-42 peptide (-x-), Carcino Embryonic Antigen (*); and, the Telokin library panned against monoclonal antibody 5G8 (). 
         FIG. 32 : Fluorescent intensity graph following regeneration of V NAR  14M-15 (12Y-2 Pro90Leu variant) after denaturation in 8M urea. 
         FIG. 33 : The full wobbegong shark ( Orectolobus maculatus ) IgNAR coding sequence. 
         FIG. 34A-34D :  34 A Cartoon of 17T-6 protein, with 12Y-2 variable and constant domain.1.  34 B Comparative FPLC traces of IgNARs 12Y-2 and 17T-6.  34 C SDS PAGE of IgNARs 12Y-2 and 17T-6.  34 D Biosensor traces of equal masses of IgNARs 12Y-2 and 17T-6 binding to immobilized AMA1. 
         FIG. 35 . Modelling of Type 3 IgNAR AAM77191 based on the 12A-9 crystal structure. The results of four modelling runs are shown compared with the template 12A-9. Run 1=Loopref; run 2=Loopref_cis; run 3=Nolloopref; run 4=Noloopref_cis. Two solutions were selected from the top ten of each with buried Trp 31 residues and illustrating the variability of the Phe 96 in the modelling solutions. 
         FIG. 36 . Model of IgNAR Type 3 CDR1 and CDR3 analogous regions (and some framework residues) based on the 12A-9 structure. This isotype has limited diversity. Hypervariable residues (by sequence alignment) are shown in dark grey. 
     
    
    
     DETAILED DESCRIPTION OF THE INVENTION 
     All publications discussed above are incorporated herein in their entirety. 
     Any discussion of documents, acts, materials, devices, articles or the like which has been included in the present specification is solely for the purpose of providing a context for the present invention. It is not to be taken as an admission that any or all of these matters form part of the prior art base or were common general knowledge in the field relevant to the present invention as it existed before the priority date of each claim of this application. 
     Unless defined otherwise, all technical and scientific terms used herein have the same meaning as commonly understood by one of ordinary skill in the art (e.g., in molecular biology and biochemistry). Standard techniques are used for molecular and biochemical methods (see generally, Sambrook et al., Molecular Cloning: A Laboratory Manual, 3rd ed. (2001) Cold Spring Harbor Laboratory Press, Cold Spring Harbor, N.Y. and Ausubel et al., Short Protocols in Molecular Biology (1999) 4 th  Ed, John Wiley &amp; Sons, Inc.—and the full version entitled Current Protocols in Molecular Biology, which are incorporated herein by reference) and chemical methods. 
     Throughout the specification the word “comprise”, or variations such as “comprises” or “comprising”, will be understood to imply the inclusion of a stated element, integer or step, or group of elements, integers or steps, but not the exclusion of any other element, integer or step, or group of elements, integers or steps. 
     By “hydrophobic residues” or “nonpolar residues” as used herein is meant valine, leucine, isoleucine, methionine, phenylalanine, tyrosine, and tryptophan. 
     By “polar residues” herein is meant serine, threonine, histidine, aspartic acid, asparagine, glutamic acid, glutamine, arginine, and lysine. 
     We have previously identified two closely related IgNAR variable domains (V NAR s) targeting the apical membrane antigen-1 (AMA1) of  Plasmodium falciparum  malarial parasites (Nuttall 2004). These proteins, designated 12Y-1 (SEQ ID NOs: 1 &amp; 2) and 12Y-2 (SEQ ID NOs: 3 &amp; 4), were isolated from a library containing a broad mixture of Type 2 V NAR  framework scaffolds derived from the native wobbegong shark repertoire, combined with both naturally occurring and synthetic loop regions analogous to CDR3 sequences (Nuttall 2003). 
     We have now isolated two further IgNAR variable domains designated 12A-9 and 1A-7. 
     V NAR  12A-9 (SEQ ID NOs: 9 &amp; 10) was isolated from a library containing a broad mixture of naturally occurring Type 2 V NAR  framework scaffolds derived from the wobbegong shark by biopanning against the Gingipain K protease from  Porphyromonas gingivalis  (Nuttall et al. 2002). This IgNAR is completely natural, including the CDR3 analogous loop region (loop region 8). In common with many IgNAR variable domains, a disulphide bridge links and stabilises the CDR1 and CDR3 analogous loop regions, in this case connecting residues Cys29 and Cys89. 
     V NAR  1A-7 (SEQ ID NOs: 5 &amp; 6) is specific for the anti-AMA-1 mouse IgG 5G8 and was isolated using the same procedure as described for the isolation of 12Y-1 and 12Y-2, i.e. biopanning of the phage displayed IgNAR library. Binding is through an “SYP” motif found in the 1A-7 “synthetic” CDR3 analogous loop region (i.e. loop region 8). 
     While the 12Y-1, 12Y-2 and 1A-7 loop regions analogous to conventional CDR3 loops fit into the synthetic category, their lengths (16, 18 and 16 residues, respectively) and amino acid composition are typical of naturally occurring IgNAR antibodies. 12A-9 is a naturally occurring shark IgNAR and has a loop region of length 13 residues analogous to a conventional CDR3 loop. 
       FIG. 1  presents the sequence alignments of 12Y-1, 12Y-2, 12A-9, 1A-7 and twelve naturally occurring Type 2 V NAR s: 7E-22 (SEQ ID NO: 17), 7E-23 (SEQ ID NO: 18), 7E-51 (SEQ ID NO: 19), 7E-54 (SEQ ID NO: 20), 7E-56 (SEQ ID NO: 21), 7E-58 (SEQ ID NO: 22), 7E-68 (SEQ ID NO: 23), 7E-77 (SEQ ID NO: 24), 7E-80 (SEQ ID NO: 25), 7E-87 (SEQ ID NO: 26), 7E-91 (SEQ ID NO: 27), 7E-93 (SEQ ID NO: 28). Half cysteine residues occur in ˜⅔rds of cases in loop regions 4 and 8 (as defined herein), forming a disulphide bridge between the loops analogous to conventional CDR1 and CDR3 loops. 12A-9 has cysteine residues is both loop region 4 and loop region 8. 12Y-1, 12Y2 and 1A-7 contain no cysteine residues in loop regions 4 and 8. 
     Table 1 shows the amino acid variation across the sixteen Type 2 V NAR s sequences in  FIG. 1  and the Type 2 V NAR s sequences reported by Nuttall (2002 &amp; 2003). It is evident from  FIG. 1  and Table 1 that there is a large degree of conservation of sequence outside of the loop regions analogous to conventional CDR1 and CDR3 loops. 
     We have now successfully generated crystals of 12Y-1, 12Y-2, 12A-9 and 1A-7 and have determined the structures of these proteins. Furthermore, we have compared these structures with a range of known immune molecules, i.e. members of the immunoglobulin superfamily. 
     12Y-1 and 12Y-2 V NAR s were expressed in  Escherichia coli  and placed into crystallization trials in the presence or absence of AMA1 antigen. No crystal leads were observed in the presence of antigen, possibly due to the intrinsically flexible domain structure of the AMA1 protein (Hodder 1996). In contrast, good quality crystals were obtained for both 12Y-1 (space group I4 1 22) and 12Y-2 (space group I2 1 2 1 2 1 ) in the absence of antigen. 
     12A-9 and 1A-7 V NAR s were expressed in  Escherichia coli  and placed into crystallization trials. Successful conditions were scaled up and diffraction quality crystals obtained for both 12A-9 (space group P2 1 2 1 2) and 1A-7 (space group I2 1 2 1 2 1 ). 
     Data sets generated for 12Y-1 and 12Y-2 crystal forms resisted solution by standard molecular replacement techniques, using a broad range of immunoglobulin superfamily proteins as template. We believed this was indicative of the unique nature of these proteins, thus the 12Y-1 structure was solved ab initio by phasing with two isomorphous heavy atom derivatives (Lutetium (III) Acetate Hydrate: LAH, and Potassium Hexachloro Rhenium: PHR). However, this structure was incomplete, lacking residues Phe88 to Pro98, most likely due to inherent flexibility of the loop region analogous to a conventional CDR3 loop within this crystal form. The complete 12Y-2 structure was then solved by molecular replacement using the 2.8 Å 12Y-1 structure as a model. 
     Whereas the 12Y-1 asymmetric unit contains one molecule, the 12Y-2 crystal asymmetric units contain two molecules (Chains A; B); the relative disposition of these two 12Y-2 monomers requires rotation by 176.2° and screw translation by −1.1A to overlay the Ca atoms. The final 12Y-2 structure was refined to 2.18 Å resolution, with 93.4% of residues in the most favoured regions of the Ramachandran plot with no residues in the generously allowed or disallowed regions. Details of the diffraction data and refinement statistics are presented in Table 2. The coordinates for 12Y-1 and 12Y-2 are attached as Appendix I(a) and (b) respectively. 
     The structures of 12A-9 and 1A-7 were determined by molecular replacement. The search model for 12A-9 was the 12Y-1 structure (above) without the CDR3 loop. The search model for 1A-7 was the 12Y-1 two-fold dimer structure without the CDR3 loops. In the final 12A-9 structure, 88.4% of the residues are in the most favoured regions of the Ramachandran plot, with one residue in the generously allowed or disallowed regions. In the final 1A-7 structure, 90.9% of the residues are in the most favoured regions of the Ramachandran plot, with two residues for chain C in the generously allowed or disallowed regions. Details of the diffraction data and refinement statistics are presented in Table 2. The coordinates for 12A-9 and 1A-7 are attached as Appendix I(c) and (d), respectively. 
     Thus, is a first aspect, the present invention provides a crystal of a variable domain of a Type 2 IgNAR that effectively diffracts X-rays for the determination of the atomic coordinates of the variable domain of the IgNAR to a resolution of better than 4.0 Å, wherein the variable domain of the Type 2 IgNAR consists of 105 to 125 amino acid residues and comprises an amino acid sequence according to Table 1 and/or  FIG. 1 . 
     It will be understood that reference herein to comprising an amino acid sequence according to Table 1 includes amino acid sequences having a high degree of sequence homology with the consensus sequence given in Table 1. Preferably, amino acid sequences will have at least 80%, more preferably at least 85% and yet more preferably at least 90% sequence identity with the consensus sequence in Table 1. Preferably, amino acid sequences will have at least 90%, more preferably at least 95% sequence identity with those residues in the consensus sequence in Table 1 that are totally conserved. 
     It will be understood that reference herein to comprising an amino acid sequence according to  FIG. 1  includes amino acid sequences having at least at least 80%, more preferably at least 85% and yet more preferably at least 90% sequence identity with a sequence shown in  FIG. 1 . 
     For the avoidance of doubt, the sequence identity figures given above in respect of Table 1 and  FIG. 1  exclude the variable regions in Table 1 and corresponding variable regions in  FIG. 1 . 
     In one embodiment, the crystal has a space group I4 1 22 with unit cell dimensions of a=97.26 Å, b=97.26 Å and c=65.23 Å, and a unit cell variability of 5% in all dimensions. 
     In another embodiment, the crystal has a space group I2 1 2 1 2 1  with unit cell dimensions of a=65.28 Å, b=92.05 Å and c=98.22 Å, and a unit cell variability of 5% in all dimensions. 
     In another embodiment, the crystal has a space group P2 1 2 1 2 with unit cell dimensions of a=38.27 Å, b=68.32 Å and c=39.51 Å, and a unit cell variability of 5% in all dimensions. 
     In another embodiment, the crystal has a space group I2 1 2 1 2 1  with unit cell dimensions of a=80.50 Å, b=88.66 Å and c=101.75 Å, and a unit cell variability of 5% in all dimensions. 
     Preferably, the crystals effectively diffract X-rays to a resolution of better than 3.0 Å, more preferably better than 2.5 Å. 
     In a further aspect, the present invention provides a crystal of a variable domain of a Type 2 IgNAR comprising a structure defined by all or a portion of the coordinates of Appendix I(a), (b), (c) or (d)±a root mean square deviation from the Ca atoms of less than 0.5 Å. 
     The IgNAR domain structures set out in Appendices I(a), (b), (c) and (d) are monomer structures. This is the first time that a monomer has been observed crystallographically for an IgNAR variable domain. 
     In Appendices I(a), (b), (c) and (d), the third column denotes the atom type, the fourth column the residue type, the fifth column the chain identification, the sixth column the residue number (the atom numbering as described in Hong (2000)), the seventh, eighth and ninth columns the X, Y, Z coordinates, respectively, of the atom in question, the tenth column the occupancy of the atom, the eleventh column the temperature factor of the atom, and the last the atom type. 
     Each of the Appendices is presented in an internally consistent format. For example, the coordinates of the atoms of each amino acid residue are listed such that the backbone nitrogen atom is first, followed by the C-α backbone carbon atom, designated CA, followed by the carbon and oxygen of the protein backbone and finally side chain residues (designated according to one standard convention). Alternative file formats (e.g. such as a format consistent with that of the EBI Macromolecular Structure Database (Hinxton, UK)) which may include a different ordering of these atoms, or a different designation of the side-chain residues, may be used or preferred by others of skill in the art. However it will be apparent that the use of a different file format to present or manipulate the coordinates of the Appendices is within the scope of the present invention. 
     As discussed herein, we have identified structural features in 12Y-1, 12Y-2, 12A-9 and 1A-7 IgNAR variable domains that are important for antigen binding or solubility/stability of these domains. These features can be introduced into domains of other members of the IgSF (for example, I-set or V-set domains) in order to alter binding properties or to improve solubility and/or stability. The information presented in Appendix I can be used, for example, to compare structures of IgSF domains that have been modified so as to more closely resemble the structure of IgNAR variable domains. 
     Protein structure similarity is routinely expressed and measured by the root mean square deviation (r.m.s.d.), which measures the difference in positioning in space between two sets of atoms. By “root mean square deviation” we mean the square root of the arithmetic mean of the squares of the deviations from the mean. The r.m.s.d. measures distance between equivalent atoms after their optimal superposition. The r.m.s.d. can be calculated over all atoms, over residue backbone atoms (i.e. the nitrogen-carbon-carbon backbone atoms of the protein amino acid residues), main chain atoms only (i.e. the nitrogen-carbon-oxygen-carbon backbone atoms of the protein amino acid residues), side chain atoms only or more usually over C-α atoms only. For the purposes of this invention, the r.m.s.d. can be calculated over any of these, using any of the methods outlined below. 
     Methods of comparing protein structures are discussed in Methods of Enzymology, vol 115, pg 397-420. The necessary least-squares algebra to calculate r.m.s.d. has been given by Rossman (1975) although faster methods have been described by Kabsch (1976 &amp; 1978), Hendrickson (1979) and McLachan (1979). Some algorithms use an iterative procedure in which the one molecule is moved relative to the other, such as that described by Ferro (1977). Other methods e.g. Kabsch&#39;s algorithm locate the best fit directly. 
     It is usual to consider C-α atoms and the r.m.s.d. can then be calculated using programs such as LSQKAB (Collaborative Computational Project 4. (CCP4 1994)), MNYFIT (part of a collection of programs called COMPOSER) (Sutcliffe (1987)), MAPS (Lu 1998), QUANTA (Jones 1991 and commercially available from Accelerys, San Diego, Calif.), Insight (commercially available from Accelerys, San Diego, Calif.), Sybyl® (commercially available from Tripos, Inc., St Louis), O (Jones 1991) and other coordinate fitting programs. 
     In, for example, the programs LSQKAB and O, the user can define the residues in the two proteins that are to be paired for the purpose of the calculation. Alternatively, the pairing of residues can be determined by generating a sequence alignment of the two proteins. The atomic coordinates can then be superimposed according to this alignment and an r.m.s.d. value calculated. The program Sequoia (Bruns 1999) performs the alignment of homologous protein sequences, and the superposition of homologous protein atomic coordinates. Once aligned, the r.m.s.d. can be calculated using programs detailed above. For sequence identical, or highly identical, the structural alignment of proteins can be done manually or automatically as outlined above. Another approach would be to generate a superposition of protein atomic coordinates without considering the sequence. 
     It is more normal when comparing significantly different sets of coordinates to calculate the r.m.s.d. value over C-α atoms only. It is particularly useful when analysing side chain movement to calculate the r.m.s.d. over all atoms and this can be done using LSQKAB and other programs. 
     Varying the atomic positions of the atoms of the structure by up to about 0.5 Å in a concerted way, preferably up to about 0.3 Å in any direction will result in a structure which is substantially the same as the structure of Appendix I(a) or (b) in terms of both its structural characteristics and utility e.g. for molecular structure-based analysis. 
     Those of skill in the art will appreciate that in many applications of the invention, it is not necessary to utilise all the coordinates of Appendix I(a), (b), (c) or (d), but merely a portion of them. The term portion is intended to define a sub-set of the coordinates, which may or may not represent contiguous amino acid residues in the 12Y-1, 12Y-2, 12A-9 or 1A-7 structure. 
     The invention also provides a means for homology modelling of other IgSF domains. By “homology modelling”, it is meant the prediction of related IgSF domain structures based either on X-ray crystallographic data or computer-assisted de novo prediction of structure, based upon manipulation of the coordinate data of Appendix I. 
     The term “homologous regions” describes amino acid residues in two sequences that are identical or have similar (e.g. aliphatic, aromatic, polar, negatively charged, or positively charged) side-chain chemical groups. Identical and similar residues in homologous regions are sometimes described as being respectively “invariant” and “conserved” by those skilled in the art. 
     In general, the method involves comparing the amino acid sequences of the IgNAR domain of Appendix I(a), (b), (c) or (d) with a modified IgSF domain by aligning the amino acid sequences (Dunbrack (1997)). Amino acids in the sequences are then compared and groups of amino acids that are homologous (conveniently referred to as “corresponding regions”) are grouped together. This method detects conserved regions of the polypeptides and accounts for amino acid insertions or deletions. 
     Homology between amino acid sequences can be determined using commercially available algorithms. The programs BLAST, gapped BLAST, BLASTN, PSI-BLAST and BLAST 2 sequences (provided by the National Center for Biotechnology Information) are widely used in the art for this purpose, and can align homologous regions of two amino acid sequences. These may be used with default parameters to determine the degree of homology between the amino acid sequence of the 12Y-1, 12Y-2, 12A-9 or 1A-7 protein and other IgSF domains, which are to be modelled. 
     Homology modelling as such is a technique that is well known to those skilled in the art (see e.g. Greer 1985 and Blundell 1988). The techniques described in these references, as well as other homology modelling techniques, generally available in the art, may be used in performing the present invention 
     Thus the invention provides a method of homology modelling comprising the steps of: (a) aligning a representation of an amino acid sequence of an IgSF domain with the amino acid sequence of 12Y-1, 12Y-2, 12A-9 or 1A-9 as shown in  FIG. 1  to match homologous regions of the amino acid sequences; (b) modelling the structure of the matched homologous regions of said IgSF domain on the corresponding regions of the 12Y-1, 12Y-2, 12A-9 or 1A-7 structure as defined by Appendix I(a), (b), (c) or (d); and (c) determining a conformation (e.g. so that favourable interactions are formed within the IgSF domain and/or so that a low energy conformation is formed) for said IgSF domain which substantially preserves the structure of said matched homologous regions. 
     Preferably one or all of steps (a) to (c) are performed by computer modelling. 
     The aspects of the invention described herein which utilise the 12Y-1, 12Y-2, 12A-9 or 1A-7 structure in silico may be equally applied to models of modified IgSF domains obtained by methods of the present invention, and this application forms a further aspect of the present invention. Thus having determined the conformation of 12Y-1, 12Y-2, 12A-9 or 1A-7, such conformation may be used in a computer-based method of rational design of modified domains for diagnostic or therapeutic applications as described herein. 
     The structure of 12Y-1, 12Y-2, 12A-9 or 1A-7 can also be used to solve the crystal structure of other IgNAR domains, where X-ray diffraction data or NMR spectroscopic data of these other domains has been generated and requires interpretation in order to provide a structure. 
     One method that may be employed for these purposes is molecular replacement. In this method, the unknown IgNAR domain crystal structure, may be determined using the 12Y-1, 12Y-2, 12A-9 or 1A-7 structure coordinates as provided herein. This method will provide an accurate structural form for the unknown crystal more quickly and efficiently than attempting to determine such information ab initio. 
     Examples of computer programs known in the art for performing molecular replacement are CNX (Brunger 1998a (also commercially available from Accelerys San Diego, Calif.)) or AMORE (Navaza 1994). 
     Thus, in a further aspect, the invention provides a method for determining the structure of a protein, which method comprises; providing the co-ordinates of Appendix I(a), (b), (c) or (d), and either (a) positioning the co-ordinates in the crystal unit cell of said protein so as to provide a structure for said protein or (b) assigning NMR spectra Peaks of said protein by manipulating the coordinates of Appendix I(a), (b), (c) or (d). 
     In another aspect, the present invention provides systems, particularly a computer system, the systems containing at least one of the following: (a) atomic coordinate data according to Appendix I, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7 or at least selected coordinates thereof; (b) structure factor data (where a structure factor comprises the amplitude and phase of the diffracted wave) for 12Y-1, 12Y-2, 12A-9 or 1A-7, said structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of an IgSF domain generated by homology modelling of the IgSF domain based on the data of Appendix I; (d) atomic coordinate data of the IgSF domain generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d). 
     For example the computer system may comprise: (i) a computer-readable data storage medium comprising data storage material encoded with the computer-readable data; (ii) a working memory for storing instructions for processing said computer-readable data; and (iii) a central-processing unit coupled to said working memory and to said computer-readable data storage medium for processing said computer-readable data and thereby generating structures and/or performing rational drug design. The computer system may further comprise a display coupled to said central-processing unit for displaying said structures. 
     The invention also provides such systems containing atomic coordinate data of modified IgSF domains wherein such data has been generated according to the methods of the invention described herein based on the starting data provided by Appendix I. 
     Such data is useful for a number of purposes, including the generation of structures to analyze the mechanisms of action of IgSF domains and/or to perform rational design of IgSF domains for diagnostic or therapeutic purposes. 
     In another aspect, the invention provides a computer-readable storage medium, comprising a data storage material encoded with computer readable data, wherein the data are defined by all or a portion (e.g. selected coordinates as defined herein) of the structure coordinates of 12Y-1, 12Y-2, 12A-9 or 1A-7, or a variant of 12Y-1, 12Y-2, 12A-9 or 1A-7, wherein said variant comprises backbone atoms that have a root mean square deviation from the Ca or backbone atoms (nitrogen-carbonα-carbon) of Appendix I of less than 2 Å, such as not more than 1.5 Å, preferably less than 1.5 Å, more preferably less than 1.0 Å, even more preferably less than 0.74 Å, even more preferably less than 0.72 Å and most preferably less than 0.5 Å. 
     The invention also provides a computer-readable data storage medium comprising a data storage material encoded with a first set of computer-readable data comprising a Fourier transformation of at least a portion (e.g. selected coordinates as defined herein) of the structural coordinates for 12Y-1, 12Y-2, 12A-9 or 1A-7 according to Appendix I; which, when combined with a second set of machine readable data comprising an X-ray diffraction pattern of a molecule or molecular complex of unknown structure, using a machine programmed with the instructions for using said first set of data and said second set of data, can determine at least a portion of the structure coordinates corresponding to the second set of machine readable data. 
     In a further aspect, the present invention provides computer readable media with at least one of: (a) atomic coordinate data according to Appendix I recorded thereon, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, or at least selected coordinates thereof; (b) structure factor data for 12Y-1, 12Y-2, 12A-9 or 1A-7 recorded thereon, the structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of a target IgSF domain generated by homology modelling of the IgSF domain based on the data of Appendix 1; (d) atomic coordinate data of a modified IgSF domain generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d). 
     By providing such computer readable media, the atomic coordinate data can be routinely accessed to model IgSF domains or selected coordinates thereof. For example, RASMOL (Sayle 1995) is a publicly available computer software package which allows access and analysis of atomic coordinate data for structure determination and/or rational drug design. 
     On the other hand, structure factor data, which are derivable from atomic coordinate data (see e.g. Blundell 1976), are particularly useful for calculating e.g. difference Fourier electron density maps. 
     A further aspect of the invention provides a method of providing data for generating structures and/or performing rational drug design for IgSF domains, the method comprising: (i) establishing communication with a remote device containing computer-readable data comprising at least one of: (a) atomic coordinate data according to Appendix I, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, at least one sub-domain of the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, or the coordinates of a plurality of atoms of 12Y-1, 12Y-2, 12A-9 or 1A-7; (b) structure factor data for 12Y-1, 12Y-2, 12A-9 or 1A-7, said structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of a modified IgSF domain generated by homology modelling of the domain based on the data of Appendix I; (d) atomic coordinate data of a protein generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d); and (ii) receiving said computer-readable data from said remote device. 
     A further aspect of the invention provides a method of providing data for generating structures and/or performing rational drug design for IgSF domains, the method comprising: (i) establishing communication with a remote device containing computer-readable data comprising at least one of: (a) atomic coordinate data according to Appendix I, said data defining the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, at least one sub-domain of the three-dimensional structure of 12Y-1, 12Y-2, 12A-9 or 1A-7, or the coordinates of a plurality of atoms of 12Y-1, 12Y-2, 12A-9 or 1A-7; (b) structure factor data for 12Y-1, 12Y-2, 12A-9 or 1A-7, said structure factor data being derivable from the atomic coordinate data of Appendix I; (c) atomic coordinate data of a modified IgSF domain generated by homology modelling of the domain based on the data of Appendix I; (d) atomic coordinate data of a protein generated by interpreting X-ray crystallographic data or NMR data by reference to the data of Appendix I; and (e) structure factor data derivable from the atomic coordinate data of (c) or (d); and (ii) receiving said computer-readable data from said remote device. 
     Thus the remote device may comprise, for example, a computer system or computer readable media of one of the previous aspects of the invention. The device may be in a different country or jurisdiction from where the computer-readable data is received. The communication may be via the internet, intranet, email etc. Typically the communication will be electronic in nature, but some or all of the communication pathway may be optical, for example, over optical fibres. Additionally, the communication may be through radio signals or satellite transmissions. 
     The folding topologies of the 12Y-1, 12Y-2, 12A-9 and 1A-7 structures show the characteristic immunoglobulin superfamily (IgSF) fold, identified by a β-sandwich structure formed by two β-sheets, packed face-to-face and linked by a disulfide bond between strands B and F (Bork 1994, Chothia 1998). The inner-strand features are turns, coils and loops including two loop regions analogous to CDR1 and CDR3 loops. 
     The structures comprise eight β-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 . As used herein, a “loop region” is a portion of peptide sequence that extends either from or between a β-strand conformation or β-strand conformations. As used herein, a “β-strand region” contains an extended β-strand conformation, i.e. β-strands comprising at least 4, preferably at least 5 amino acids. Loop regions are typically free of extended β-strand conformations but may include shortened β-strand conformations, i.e. β-strands comprising less than 4 amino acids. Apart from N- and C-terminal loop regions, the loop regions connect β-strands running in opposite directions. 
     Preferably, loop region 5 contains shortened β-strand conformations. We have also found that loop region 8 may contain β-strand conformations, which may be either shortened or extended, and these are discussed in more detail below. Preferably, no other loop regions contain β-strand conformations. 
     Detailed analysis of the 12Y-1, 12Y-2, 12A-9 and 1A-7 frameworks indicates a novel folding topology which resembles the intermediate (I-set) fold in a number of important characteristics, but also with distinct structural features found in variable (V-set) domains. More particularly, the structures comprise 8 β-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 , in which loop region 5 comprises 2 shortened β-strand regions, designated D‘ and C’, and 3 loop regions, designated 5a, 5b and 5c, according to  FIG. 3 . 
     From the data assimilated, Table 3 presents a breakdown of the number of amino acid residues present in the various loop and β-strand regions of Type 2 V NAR s. Loop region 4 is analogous to a conventional CDR1 loop. Loop region 8 is analogous to a conventional CDR3 loop. As loop region 8 can contain a variable number of amino acids ranging from about 5 to 30, a default value of 18 is used on which to base the residue numbering for subsequent regions. Consequently, the residue numbering does not necessarily correlate with the total number of amino acid residues present in the sequence. It is based on loop region 8 having a default value of 18 amino acid residues. 
     Table 3A presents a breakdown of the number of amino acid residues present in the loop region 5 of Type 2 V NAR s. Loop region 5 comprises 2 shortened β-strand regions, designated D‘ and C’, and 3 loop regions, designated 5a, 5b and 5c. 
     Both V-set and I-set proteins have a typical kink in the first strand (A′), which allows the first part of the strand (A) to hydrogen bond to one part of the β-sandwich sheet and the second part (A′) to the extended G strand of the other β-sheet. This first-strand kink is found in the V NAR  proteins as depicted in  FIG. 4 . It starts with the highly conserved cis-proline (Pro7), the most typical residue in first-strand kinks of variable domains (Spada 1998). Like V-set proteins, 12Y-1, 12Y-2, 12A-9 and 1A-7 also have bulges in the C terminal G strand (conserved Gly-Ala-Gly motif) and in the C′ strand. Most significantly, 12Y-1, 12Y-2, 12A-9 and 1A-7 resemble I-set proteins in having a short C′ strand (three H-bonds) and a very short C″ strand (labelled as D′ in  FIG. 3 ) which atypically switches from one 3-sheet to the other, such that a single hydrogen bond links it to the D strand rather than the C′ strand as in V-set domains. 
     The 12Y-2 chain A and B (r.m.s.d. of 0.53 Å for C, of 113 residues), and the 12Y-1 framework (r.m.s.d. of 0.72 Å for Ca of 100 residues) are closely related (see  FIG. 5 ). Further structural comparison (see  FIGS. 6 and 7 ) of the 12Y-2 chain A to diverse variable and intermediate set proteins for which structural information is available, shows V NAR s to be most closely related to I-set molecules such as the Neural Cell Adhesion Molecules (NCAMs) (Harpaz 1994; Chothia 1997; Soroka 2003,) and Telokin (Chothia 1997; Holden 1992). This similarity is heavily biased by the absence of extended C′ and C″ strands, connected by a CDR2 loop, that in conventional antibodies extends up to the top of the molecule and participates in immune recognition. In contrast, comparison of the 12Y-2 chain A to conventional T cell receptor (TCR) Vα, and V H , V L , and single-domain V H H antibodies, shows little consistent structural identity beyond a core of residues based around the major strands, minus the C′, C″ and CDR regions. The single V H H domains found in the Camelidae may be expected to be similar to the V NAR  structure, however, these single domain antibodies clearly arose from a mammalian IgG-like progenitor, successively acquiring solubilizing, stabilizing, and extensive CDR3 mutations (Nguyen 2002). The low structural homology between V H H and V NAR s is consistent with their very low sequence homology, and reflects convergent evolutionary solutions to the problem of achieving solvent solubility and binding affinity. 
     In  FIG. 8 , the relative positions of the three classically defined antibody CDR or hypervariable loop regions are shown. Sequence alignments show IgNAR antibody variability confined to the loop regions 4 and 8 corresponding to conventional CDR1 and CDR-3 regions, and this is confirmed by our structural analysis where a loop region analogous to a typical “CDR2 loop” is missing and its bottom turn appears to be well separated from the antigen-binding face (or paratope). Sequence analysis also suggests that loop region 4 is the minor loop component, invariant in length and limited in diversity. This region is confined to residues 28-33 (12Y-1:  N SYGLES C ; 12Y-2:  N SFELKD C ), with a topology close to that of canonical structure 2 observed in antibody light chain variable domains (see  FIG. 9 ; C α  r.m.s.d. of 1.22A with 1hzh V L ) (Chothia 1989). Where a half cysteine is present in the V NAR  loop region 4, it is exclusively found at positions 29 or 32. The side chains of these two residues extend outward and upward towards the extended loop region 8, and are ideally positioned to make contact with the concomitant half cysteine in this region (see  FIG. 10 ). Given the enormous topological latitude inherent in the highly diverse loop regions 8, a wide variety of conformations can clearly be adopted by loop region 8, despite the restraints of these stabilizing disulphide linkages. Such extreme diversity has also been observed for the CDR3 loop of V H H single domain antibodies, with a single antigen eliciting a highly varied immune response with significantly different loop topologies (Desmyter 2002). 
     The 12Y-2 CDR3 loop is present in two crystal forms, corresponding to chains A and B, and extends from residues Phe86 to Glu103. Unusually, the chain A loop region 8 adopts a clear β-hairpin configuration with β-strands from Phe86-Leu89, and Leu98-Glu103, separated by a flexible loop (Pro90-Ser97). For chain B, the 1-hairpin extends even further into loop region 8 with residues Phe86-Asp93 and Tyr96-Glu103 involved in β-strand formation (see  FIG. 11 ). Structurally, the β-hairpins are formed by the main chain hydrogen bonds (&lt;3 Å): Tyr87 (O)-Phe100 (N); Tyr87 (N)-Phe100 (O); Leu89 (N)-Leu98 (O); Leu89 (O)-Leu98 (N), and, Asp93(O)-Tyr96(O) ( FIG. 11 ). Additional H-bonds for loop region 8 of chain B are: Asp93 (N)-Tyr96 (O); Asp93 (O)-Tyr96 (N); and, Leu91 (O)-Tyr96 (O). Thus, the 12Y-2 loop region 8 extends outward and upward from the immunoglobulin framework, at the furthest point extending ˜20 Å above the conserved β-sheet framework, and tipped by the bulky side-chains of tyrosine residues at positions 94 and 96 (see  FIGS. 8 and 11 ). Such extended antigen binding paratopes have been observed in but a limited number of antibodies, for example the camel anti-lysozyme V H H cAb-Lys3 (Desmyter 1996), and the H3 loop of human antibody b12, which penetrates deeply into the HIV gp120 binding cleft (Sapphire 2001). A comparison of the extended loop lengths of the 12Y-2 region 8 with these antibodies reveals that the 12Y-2 loop region 8 is of greater length and may bind antigen in a similar manner. Thus, it is apparent that structures based on the 12Y-2 loop region 8 with its extended β-hairpin structure may prove ideal for penetrating buried clefts and cavities in for example enzyme active sites, parasite coat proteins, or viral canyons. 
     We previously identified two mutations in the 12Y-2 loop region 8 which independently enhanced AMA1 antigen binding affinity ˜10-fold (Nuttall 2004). Without being limited by theory, it is believed that these mutations (Pro90Leu and Phe100Leu) probably act to increase the flexibility of the β-hairpin around hinge regions relative to the rest of the framework (see  FIG. 11 ). For example, the three aromatic residues: Phe29 of CDR1, and Tyr87 and Phe100 of loop region 8 have side chains involved in stabilizing C—H••π-interactions (d c-x &lt;4.8 Å, where X is the centre-of-mass of the π-system (Brandl 2001)). Additional stability comes from hydrogen bond Tyr87 (OH)-Glu103(Oε). Thus, binding of 12Y-2 to the AMA1 target is probably mediated by the rigid β-hairpin, with increased access to the antigen mediated by flexibility at the bottom of the loop structure. In contrast, the 12Y-1 loop region 8 is unresolved in the crystal structure and is probably highly flexible in solution around similar hinge-like residues. The aromatic loop region 8 residues of 12Y-2 are replaced with Arg87 and Pro98 in 12Y-1, reducing the stability of the loop region, i.e. the Phe29 of loop region 4 is now hydrogen bonded to Glu101 (Glu103 in 12Y-2) (Tyr29(OH)-Glu101 (Oε)) leaving the hinges of the loop region 8 unsupported. 
     We turn now to the impact of the unusual V NAR  C′C″D strand topology on antigen recognition. The V NAR  “CDR2” loop is non-existent, replaced by a short 3-turn at the bottom of the molecule. This is graphically illustrated in  FIG. 12 , where the V NAR  “CDR2” is aligned with that of a typical human antibody. The “bottom” position of this loop, combined with the low sequence variability, strongly suggests that this region has little impact on the interaction with antigen. However, the loss of the conventional C″ and D strands suggests a possible alternative model for antigen binding, where the extended 12Y-2 loop region 8 combines with the large concave pocket opened in the absence of the conventional CDR2 ( FIG. 8 ). Additional structural variability is also observed in the 12Y-1 and 12Y-2 structures for the C strand loop ranging from residues Lys40 to Glu46, just prior to the “CDR2” ( FIG. 12 ). Comparison of V NAR s from different shark species shows significant sequence heterogeneity in this region, which most likely reflects an area under less intensive selection pressure than the rest of the molecule, and susceptible to some degree of structural plasticity. 
     Lack of an extended CDR2 loop also has a significant impact on the interaction between isolated V NAR s. Both 12Y-1 and 12Y-2 form crystallographic 2-fold symmetry dimers, which form a continuous 8-stranded β-sheet underneath the loop regions 4 and 8, which correspond to conventional CDR1 and CDR3 loops respectively (see  FIG. 13 ). Contact areas are highly conserved between the 12Y-1 and 12Y-2 proteins, despite different crystal forms (12Y-1 tetragonal; 12Y-2 orthorhombic). A comparison of the 12Y-2 and 12Y-1 dimeric forms shows that the interaction surface between the 2-fold monomers is not continuous and can be subdivide into three areas: (i) the main-chain β-sheet interactions between D strands; (ii) the interaction between loop regions 4; and (iii) the interactions between loop regions 8 (see  FIG. 13  and Table 4). While the contact between loop regions 8 in 12Y-2 is extensive, the dimeric arrangement is preserved in 12Y-1 crystals notwithstanding the more flexible and significantly distorted loop region 8, indicating that the conformation of loop region 8 is not absolutely required. Thus, the most significant dimer contacts are probably mediated by the loop regions 4 and especially by the D strands, where the main-chain interactions are independent of side-chain variation. With a buried surface area of ˜1760 Å 2 , the 12Y-2 dimer appears to be a true protein-protein interaction site, as the statistical probability of finding a non-specific interface of such dimensions in a crystal is &lt;1% (Lo Conte 1999). We suggest that this configuration is a general phenomenon for independent IgNAR variable domains (i.e. not tethered to constant domains), as we have also observed such dimeric species in other recombinant V NAR s (Nuttall 2002). 
     In heterodimeric immune receptors such as V H /V L  antibodies and Vα/Vβ TCRs, the paired domains interact across a broad hydrophobic interface. This non-solvent exposed region is formed by a conserved patch of residues on the AGFCC′ β-strands, with additional CDR3 interactions. In contrast, many IgSF-based cell surface receptors are single domains in solution and this face of the β-sandwich takes on a more charged/polar character. We have compared this region on the 12Y-2 V NAR , a camel V H H, a TCR V α , an antibody V H , and NCAM and Telokin domains. The hydrophobic region of inter-domain contact is immediately apparent for the TCR and antibody domains, centred around aromatic residues at the centre of the interface. The surface character is altered for V H H domains, for example by mutations Leu45Arg and Gly44Glu, to give a more charged character. However, the relatively short evolutionary time since the development of these single domain antibodies in the Camelidae mean that other solutions have also been adopted, for example the illustrated antibody where part of the loop region 8 (analogous to a conventional CDR3 loop) descends to partly cover the former V L  interface, for example residues Asp121 and Tyr120. Although these camelid adaptations can be directly transplanted to murine and human antibody variable domains, the resulting proteins often achieve increased solubility by non-predictable conformational changes (Riechmann 1996). Isolation of soluble human single variable domains can also depend on conformational perturbations, for example the side chain of conserved residue Trp47 flipping into a cavity on the V L  interface (Jespers 2004). 
     In contrast, for the V NAR s this face is dominated by the charged and polar residues Tyr37, Glu46, Lys82, Gln84, Arg101, and Lys104. Residues Glu46, Lys82, and Lys104 especially are well conserved across type 2 V NAR s, and in this instance form a charged pocket with a pattern of hydrogen bonds between side-chains (i.e. Glu46Oε1-Lys104 Nζ) and to adjacent water molecules (i.e. Glu46Oε2-H 2 0-Lys82 Nζ). The central Tyr37 is well-conserved as an aromatic species across the immunoglobulin superfamily, and it and residues Gln84 and Arg101 also participate in forming a framework-CDR3 hydrogen bond network (Arg101(NH2)-Gln84(Nζ2); Tyr87(OH)-Arg101(NH 2 ). The combined effect of these residues is to form a conserved charged pocket, which displays a high degree of solvent solubility such that it is ringed by water molecules in the crystal forms. The conservation of the Glu46, Lys82, and Lys104 trio suggests a stable and well-established face. A similar situation is observed in NCAM, where this face is dominated by the charged residues Lys76 and Glu88, and for Telokin, where a charged and polar interface is maintained by a combination of hydrogen bonds. 
     Modifications to the IgNAR Variable Domain 
     Analysis of the crystal structures has revealed the potential of V NAR  proteins as, for example, therapeutic, diagnostic and bioarray reagents. For example, V NAR  proteins have potential to act as cleft-binding antibodies in which the β-hairpin structures are extended to form paratopes capable of penetrating otherwise cryptic antigenic sites. Furthermore, these proteins have a high degree of stability which offers significant advantages in terms of their manipulation and practical application. 
     Thus, the present invention provides a method of altering a property of an IgNAR variable domain comprising eight β-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 , said method comprising modifying the IgNAR variable domain within at least one of the β-strand regions or loop regions. 
     The IgNAR variable domain is modified such that a property of the IgNAR variable domains is altered. A property of an IgNAR variable domain, I-set domain or V-set domain is altered if any characteristic or attribute of the domain differs from the corresponding property of the unmodified domain. These properties include, but are not limited to, substrate specificity, substrate affinity, binding affinity, binding selectivity, catalytic activity, thermal stability, alkaline stability, pH activity profile, resistance to proteolytic degradation, kinetic association, kinetic dissociation, immunogenicity, ability to be secreted, ability to activate receptors, ability to treat disease, solubility, cytotoxic activity and oxidative stability. 
     Unless otherwise specified, a property of an IgNAR variable domain, I-set domain or V-set domain is considered to be altered when the property exhibits at least a 5%, preferably at least 10%, more preferably at least a 20%, yet more preferably at least a 50%, and most preferably at least a 2-fold increase or decrease relative to the corresponding property in the unmodified domain. 
     In a preferred embodiment, the solubility of the modified IgNAR variable domain, and concomitantly the binding moiety, is altered, preferably improved, relative to the corresponding unmodified IgNAR variable domain. 
     In another preferred embodiment, the stability of the IgNAR variable domain, and concomitantly the binding moiety, is altered, preferably improved, relative to the corresponding unmodified IgNAR variable domain. Examples of altering the stability include changing one of the following properties:—thermal stability, alkaline stability, pH activity profile and resistance to proteolytic degradation. 
     In a particularly preferred embodiment, the binding characteristics of the IgNAR variable domain are altered relative to the corresponding unmodified IgNAR variable domain. Examples of altering the binding characteristics include changing one of the following properties: substrate specificity, substrate affinity, catalytic activity, kinetic association, kinetic dissociation, binding affinity and binding selectivity. 
     In another preferred embodiment, the modification increases or decreases the propensity for IgNAR variable domain to form homodimers compared to the unmodified IgNAR variable domains. 
     The present invention also provides a binding moiety comprising a modified IgNAR variable domain produced by a method according to the invention. 
     The present invention also provides a binding moiety comprising an IgNAR variable domain comprising eight β-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 , wherein the IgNAR variable domain has been modified within at least one of the β-strand regions or loop regions. 
     Preferably, the unmodified β-strand regions and loop regions have the amino acid residue numbering according to Table 3. 
     Preferably, the unmodified loop region 5 comprises two β-strand regions designated C‘ and D’ and three loop regions designated 5a, 5b and 5c, all according to  FIG. 3 . Thus, in a preferred embodiment, an IgNAR variable comprises 10 β-strand regions, designated A, A′, B, C, C′, D′, D, E, F and G according to  FIG. 3 , and eleven loop regions, designated 1, 2, 3, 4, 5a, 5b, 5c, 6, 7, 8 and 9 according to  FIG. 3 . Preferably, the loop regions 5a, 5b and 5c, and β-strand regions C, C‘ and D’ have the amino acid residue numbering according to Table 3A. 
     In a preferred embodiment, where an IgNAR variable domain is to be modified, prior to the modification, the C α  trace of loop region 5b extends no more than 5 Å above the plane formed by the C a  trace of residues 22, 83 and 36 as defined in Table 1. 
     In a preferred embodiment, the amino acid sequence of the unmodified β-strand regions A, A′, B, C, D, E, F and G and loop regions 1, 2, 3, 6, 7 and 9 comprises an amino acid sequence according to  FIG. 1  and/or Table 1. 
     In a preferred embodiment, the IgNAR is a Type 2 or Type 3 IgNAR, preferably Type 2. Preferably, the IgNAR is derived from a shark, preferably a wobbegong shark. 
     In a further preferred embodiment, the unmodified IgNAR variable domain has a sequence as shown in  FIG. 1 . More preferably, the unmodified IgNAR is 12Y-1, 12Y-2, 12A-9 or 1A-7. 
     Suitable modifications include substitutions, insertions and deletions within at least one at least one of the β-strand regions or loop regions. A combination of deletion, insertion and substitution can be made to generate the IgNAR modified variable domain. 
     Modifications can be prepared by introducing appropriate nucleotide changes into a nucleic acid of the present invention, or by in vitro synthesis of the desired polypeptide. Such mutants include, for example, deletions, insertions or substitutions of residues within the amino acid sequence. 
     In designing amino acid sequence mutants, the location of the mutation site and the nature of the mutation will depend on characteristic(s) to be modified. The sites for mutation can be modified individually or in series, for example by (1) substituting first with conservative amino acid choices and then with more radical selections depending upon the results achieved, (2) deleting the target residue, or (3) inserting other residues adjacent to the located site. 
     Encompassed within the scope of the invention are modifications which are tantamount to conservative substitutions but which alter a property of the IgNAR variable domain. Examples of conservative substitutions are given in as follows: 
     
       
         
           
               
               
               
             
               
                   
                   
               
               
                   
                 Original Residue 
                 Exemplary Substitutions 
               
               
                   
                   
               
             
            
               
                   
                 Ala (A) 
                 val; leu; ile; gly 
               
               
                   
                 Arg (R) 
                 lys 
               
               
                   
                 Asn (N) 
                 gln; his; 
               
               
                   
                 Asp (D) 
                 glu 
               
               
                   
                 Cys (C) 
                 ser 
               
               
                   
                 Gln (Q) 
                 asn; his 
               
               
                   
                 Glu (E) 
                 asp 
               
               
                   
                 Gly (G) 
                 pro, ala 
               
               
                   
                 His (H) 
                 asn; gln 
               
               
                   
                 Ile (I) 
                 leu; val; ala 
               
               
                   
                 Leu (L) 
                 ile; val; met; ala; phe 
               
               
                   
                 Lys (K) 
                 arg 
               
               
                   
                 Met (M) 
                 leu; phe; 
               
               
                   
                 Phe (F) 
                 leu; val; ala 
               
               
                   
                 Pro (P) 
                 gly 
               
               
                   
                 Ser (S) 
                 thr 
               
               
                   
                 Thr (T) 
                 ser 
               
               
                   
                 Trp (W) 
                 tyr 
               
               
                   
                 Tyr (Y) 
                 trp; phe 
               
               
                   
                 Val (V) 
                 ile; leu; met; phe, ala 
               
               
                   
                   
               
            
           
         
       
     
     Furthermore, if desired, unnatural amino acids or chemical amino acid analogues can be introduced as a substitution or addition into the polypeptides of the present invention. Such amino acids include, but are not limited to, the D-isomers of the common amino acids, 2,4-diaminobutyric acid, α-amino isobutyric acid, 4-aminobutyric acid, 2-aminobutyric acid, 6-amino hexanoic acid, 2-amino isobutyric acid, 3-amino propionic acid, ornithine, norleucine, norvaline, hydroxyproline, sarcosine, citrulline, homocitrulline, cysteic acid, t-butylglycine, t-butylalanine, phenylglycine, cyclohexylalanine, β-alanine, fluoro-amino acids, designer amino acids such as β-methyl amino acids, Ca-methyl amino acids, Nα-methyl amino acids, and amino acid analogues in general. 
     Also included within the scope of the invention are chemically modified derivates of IgNAR variable domains which may provide advantages such as increasing stability and circulating time of the polypeptide, or decreasing immunogenicity (see U.S. Pat. No. 4,179,337). The chemical moieties for derivatization may be selected from water-soluble polymers such as polyethylene glycol, ethylene glycol/propylene glycol copolymers. carboxymethylcellulose, dextran, polyvinyl alcohol and the like. 
     Also included within the scope of the invention are variable domains of the present invention that are differentially modified during or after synthesis, for example, by biotinylation, benzylation, glycosylation, acetylation, phosphorylation, amidation, derivatization by known protecting/blocking groups, proteolytic cleavage, linkage to an antibody molecule or other cellular ligand, etc. The IgNAR variable domain may be modified at random positions within the molecule or at predetermined positions within the molecule and may include one, two, three or more attached chemical moieties. 
     These modifications may, for example, serve to increase the stability and/or bioactivity of the modified domains of the invention. 
     The IgNAR variable domains may also be modified by having C- or N-terminal truncations. However, the scope for such modifications is limited and it is preferred that no more than 8, preferably no more than 6 and more preferably no more than 4 residues be removed. Preferably there is no truncation at the N-terminal and more preferably there is no truncation at either the N- or C-terminals. 
     Modified domains of the present invention can be produced in a variety of ways, including production and recovery of natural proteins, production and recovery of recombinant proteins, and chemical synthesis of the proteins. In one embodiment, an isolated polypeptide of the present invention is produced by culturing a cell capable of expressing the polypeptide under conditions effective to produce the polypeptide, and recovering the polypeptide. 
     In a preferred embodiment the modification comprises insertion of 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20 or more amino acids. 
     In another preferred embodiment the modification comprises deletion of 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20 or more amino acids. 
     In a further preferred embodiment, the modification involves more than mere substitution of a cysteine residue in one loop region, the cysteine residue being involved in disulphide formation with another cysteine residue in another loop region. 
     In a further preferred embodiment, the modification is not substitution of residue 43 as shown in Table 1 or involves more than mere substitution of the residue 43. 
     In another preferred embodiment, the modification is made to one or more amino acid residues within the patch defined by residues 33, 37, 46, 48, 50, 51, 59, 61, 86, 94, 95, 96, 98, 99 and 101 as shown in Table 1. 
     In a preferred embodiment, when loop region 4 or loop region 8 of the IgNAR is modified, at least one of the β-strand regions or loop regions 1-3, 5-7 or 9 is also modified. 
     In a further preferred embodiment, at least one of β-strand regions C, D, E or F or loop regions 5, 6 or 7 has been modified. In a further preferred embodiment, at least one of β-strand regions C or D or loop region 5 has been modified. In a further preferred embodiment, loop region 5 has been modified. 
     In one preferred embodiment, the modification involves point mutations within loop region 8. For example, residues Pro90 and/or Phe100 may be replaced in order to enhance flexibility of loop region 8. 
     In another embodiment of the invention, the modification involves randomisation of loop region 8. 
     In yet another embodiment, the modification involves insertion of amino acids into loop region 8. 
     In yet another embodiment the modification involves grafting a CDR loop or portion thereof from a V-set or an I-set domain onto the IgNAR variable domain. For example, the CDR3 loop of an antibody may be grafted onto the IgNAR variable domain in the vicinity of loop region 8. The grafting may involve, for example, replacing amino acids from loop region 8 (for example amino acids 86 to 103 as defined in Table 1 or a portion thereof) with amino acids that constitute an antibody CDR 3 loop or portion thereof. The modification may further involve replacing amino acids from loop region 4 (for example amino acids 28 to 33 as defined in Table 1 or a portion thereof) with amino acids that constitute an antibody CDR 1 loop or portion thereof. 
     In a further preferred embodiment, when the amino acid residues at the N-terminal and C-terminal ends of loop region 8 are each capable of adopting a β-strand configuration, loop region 8 is modified by substitution, deletion or addition, preferably by addition, of at least one amino acid within that part of the loop not capable of adopting the β-strand configuration. 
     In a further preferred embodiment from 2 to 10, preferably from the 3 to 8, amino acid residues at the N-terminal and C-terminal ends of loop region 8 are capable of adopting β-strand configurations. 
     In a further preferred embodiment, loop region 8 is modified by substitution, deletion or addition, preferably by addition or substitution, of one or more amino acid residues at the C- and/or N-terminal ends of the loop region to facilitate the adoption of β-strand configurations at the C- and/or N-terminal ends. 
     In a further preferred embodiment, loop region 8 is modified so as to facilitate the adoption of β-strand configurations at the C- and/or N-terminal ends of 2 to 10, preferably from 3 to 8, amino acid residues in length. 
     It will be appreciated by those skilled in the art that it is possible to predict whether or not any given sequence is capable of forming a β-strand configuration by in silico modelling. Many computer programs are available and are know to the skilled person (see, for example, Wolfson et al. 2005 and Xu et al. 2000). Examples of suitable programs can also be found on the secondary structure prediction server at http://www.predictprotein.org. 
     In one embodiment, the modification increases or decreases the binding characteristics, e.g. the affinity, of the modified IgNAR variable domain for a predetermined target molecule compared to the unmodified IgNAR variable domain. 
     That part of the IgNAR variable domain which normally contacts a ligand (e.g. an antigen) or which appear, from the studies we have undertaken, to be available for interacting with a ligand (e.g. a receptor, enzyme etc.) are typically the solvent exposed regions of the IgNAR variable domain. In particular, they are generally made up of the surface exposed loops, and in particular loop regions 8 and 4 of the IgNAR variable domain. 
     Preferably, the unmodified IgNAR variable domain has had one or more loop regions modified. In particular, this can be achieved by replacing one or more solvent exposed loops of the IgNAR variable domain with one or more loops from the variable domains of other members of the IgSF. Preferably, loop regions 4 and/or 8, or part thereof, is modified, preferably replaced, by a corresponding loop structure (e.g. a CDR1 or CDR3 loop structure, respectively) from another molecule. 
     Modifications can also be made to regions of the IgNAR variable domain that are not solvent exposed and/or which do not form part of a binding loop, e.g. the (3 strand regions. 
     In another preferred embodiment, the modification increases or decreases the propensity for the IgNAR variable domain to form homodimers compared to the unmodified IgNAR variable domains. 
     In another preferred embodiment, the modification increases the solubility of the IgNAR variable domain compared to the unmodified IgNAR variable domain. 
     In a preferred embodiment, one or more solvent exposed loops is/are modified to improve solubility. Solubility may be improved by, for example, either removing disulphide bond-forming cysteines and/or replacing disulphide bond-forming cysteines from within the solvent exposed loops with amino acids such as alanine or serine. 
     Modifications to improve solubility may be desirable where the IgNAR variable domains are being designed to function in an intracellular context and/or their method of production favours expression in a soluble form. It will also be evident to the skilled person that it may be necessary to modify the solubility characteristics of the IgNAR variable domains at the same time or even prior to making other modifications, such as, changing the binding characteristics. 
     The physicochemical properties, such as stability and solubility, of the IgNAR variable domains may be qualitatively and/or quantitatively determined using a wide range of methods known in the art. Methods which may find use in the present invention for characterizing the biophysical/physicochemical properties of the binding moieties include gel electrophoresis, chromatography such as size exclusion chromatography, reversed-phase high performance liquid chromatography, mass spectrometry, ultraviolet absorbance spectroscopy, fluorescence spectroscopy, circular dichroism spectroscopy, isothermal titration calorimetry, differential scanning calorimetry, analytical ultra-centrifugation, dynamic light scattering, proteolysis, cross-linking, turbidity measurement, filter retardation assays, immunological assays, fluorescent dye binding assays, protein-staining assays, microscopy, and detection of aggregates via ELISA or other binding assay. Structural analysis employing X-ray crystallographic techniques and NMR spectroscopy may also find use. 
     Protein stability (e.g. structural integrity) may, for example, be determined by measuring the thermodynamic equilibrium between folded and unfolded states. 
     In one embodiment, stability and/or solubility may be measured by determining the amount of soluble protein after some defined period of time. In such an assay, the protein may or may not be exposed to some extreme condition, for example elevated temperature, low pH, or the presence of denaturant. Because unfolded and aggregated protein is not expected to maintain its function, e.g. be capable of binding to a predetermined target molecule, the amount of activity remaining provides a measure of the binding moieties stability and solubility. Thus, one method of assessing solubility and/or stability is to assay a solution comprising a binding moiety for its ability to bind a target molecule, then expose the solution to elevated temperature for one or more defined periods of time, then assay for antigen binding again. 
     Alternatively, the modified IgNAR binding domains could be expressed in prokaryotic expression systems and the protein isolated from the cell lysate by a series of biochemical purification steps including differential centrifugation, affinity isolation chromatography using attached tags such as poly histidine, ion-exchange chromatography and gel filtration chromatography. A measure of the improvement in the solubility of the modified polypeptide can be obtained by making a comparison of the amount of soluble protein obtained at the end of the purification procedure to that obtained using the unmodified polypeptide, when starting with a similar amount of expressed unfractionated product. Levels of expression of product in culture can be normalised by a comparison of product band densities after polyacrylamide gel electrophoresis of equivalent aliquots of SDS detergent-solubilised cell lysate. 
     In addition, IgNAR variable domains can be unfolded using chemical denaturant, heat, or pH, and this transition be monitored using methods including, but not limited to, circular dichroism spectroscopy, fluorescence spectroscopy, absorbance spectroscopy, NMR spectroscopy, calorimetry, and proteolysis. As will be appreciated by those skilled in the art, the kinetic parameters of the folding and unfolding transitions may also be monitored using these and other techniques. 
     The solubility of the IgNAR variable domains of the present invention preferably correlates with the production of correctly folded, monomeric polypeptide. The solubility of the modified IgNAR variable domains may therefore also be assessed by HPLC or FPLC. For example, soluble (non-aggregated) domains will give rise to a single peak on a HPLC or FPLC chromatograph, whereas insoluble (aggregated) domains will give rise to a plurality of peaks. Furthermore, the ability to be able to correctly fold and form ordered crystal leads and structures is also often indicative of good solubility. 
     As an example of an accelerated stability trial, aliquots of the IgNAR variable domain can be stored at different temperatures, such as −20° C., 4° C., 20° C. and 37° C. and an activity of the IgNAR variable domain assayed at different time intervals. For example, successful maintenance of activity during storage at 37° C. for 12 weeks is roughly equivalent to storage stability for 12 months at 4° C. The trial can also be conducted to compare the effect of different protecting additives in the storage buffer on the stability of the protein. Such additives can include compounds such as glycerol, sorbitol, non-specific protein such as bovine serum albumin, or other protectants that might be used to increase the shelf life of the protein. 
     Modifications of Members of the IgSF Based on the IgNAR Variable Domain 
     The results presented herein also identify structural features in IgNAR variable domains that are important for antigen binding or solubility/stability of these domains. These features can be introduced into domains of other members of the IgSF (for example, I-set or V-set domains) in order to alter binding properties or to improve solubility and/or stability. 
     Accordingly, in a further aspect the present invention provides a method of modifying an I- or V-set domain, said method comprising inserting and/or substituting one or more structural features from an IgNAR variable domain into the I- or V-set domain. 
     In a further aspect, the present invention provides a binding moiety comprising an I- or V-set domain, wherein the I- or V-set domain has been modified by substitution or insertion of one or more structural features from an IgNAR variable domain into the I- or V-set domain. 
     By “I-set domain” is meant a domain comprising nine β-strand regions, designated A, A′, B, C, C′, D, E, F and G, as set out and according to Chothia (1997). 
     Examples of representative I-set domain molecules include NCAM, VCAM, ICAM, Telokin, MADCAM-1, Twitchin and Titin. 
     By “V-set domain” is meant a domain comprising ten β-strand regions, designated A, A′, B, C, C′, C″, D, E, F and G, as, as set out and according to Chothia (1997). 
     Examples of representative V-set domain molecules include antibodies, T cell receptors (TCRs), CTLA-4, CD28, ICOS, CD2, CD4, Cd7, CD22, CD33, CD80, CD86, CD48 and CD58. 
     Preferably, the I-set or V-set domain is modified such that a property of the domain is altered. 
     In one embodiment, the structural feature is a loop region from an IgNAR variable domain. For example, loop region 8 and/or loop region 4 from an IgNAR variable domain may be grafted onto the I- or V-set domain. The grafting may involve, for example, replacing suitable (e.g. predeteremined) amino acids of the I- or V-set domain with amino acids 86 to 103 as defined in Table 1 or a portion thereof. 
     In another embodiment, the method comprises removing all or a portion of the CDR2 loop of the I- or V-set domain. 
     In another embodiment the structural feature is the solvent exposed face of an IgNAR variable domain at the C-terminus of loop region 4 and in the C and D β-strands (for example comprising residues 32, 33, 34, 35, 55, 57 and 58 as defined in Table 1). The method may involve modifying amino acids of the I- or V-set domain equivalent to amino acids 32, 33, 34, 35, 55, 57 and 58 as defined in Table 1 or a portion thereof. The method may involve grafting the solvent exposed face of an IgNAR variable domain (for example comprising residues 32, 33, 34, 35, 55, 57 and 58 as defined in Table 1) or a portion thereof onto the I- or V-set domain. Grafting may involve replacing amino acids of the I- or V-set domain with amino acids derived from the solvent exposed face of an IgNAR variable domain. Grafting of the solvent exposed face onto the I- or V-set domain preferably occurs after removal of all or a portion of the CDR2 loop. Preferably, the modification introduces charged or polar amino acids at these positions. Preferably, this modification improves the solubility of the I- or V-set domain. 
     In one preferred embodiment, the V-set domain is a TCRVα or Vβ domain and the equivalent amino acids to the solvent exposed surface of am IgNAR variable domain are Gly30, Ser31, Phe32, Phe33, Phe62, Thr63, Ala64 and Gln65. Preferably, the modification involves the introduction of polar or charged amino acids in these positions. 
     In another embodiment, the method involves modifying one or more residues of a TCR Vα or Vβ domain, wherein the one or more residues is located at the interface between the Vα and Vβ domains. In a preferred embodiment, the one or more amino acid residue is selected from the group consisting of Ser31, Pro43, Leu89 and Phe106 and combinations thereof. Preferably, the modification involves the introduction of one or more charged amino acids in these positions. 
     In another embodiment, the method involves modifying one or more residues of an antibody V H  or V L  domain, wherein the one or more residues is located at the interface between the V H  and V L  domains. In a preferred embodiment, the one or more amino acid residue is equivalent to an amino acid of the TCR Vα or Vβ domain selected from the group consisting of Ser31, Pro43, Leu89 and Phe106 and combinations thereof. Preferably, the modification involves the introduction of one or more charged amino acids in these positions. 
     In a preferred embodiment, the modification improves the solubility of the I- or V-set domain. 
     In a further aspect, the present invention provides a method of modifying an I- or V-set domain, said method comprising introducing a modification into a region of the I- or V-set domain equivalent to loop region 4 and/or loop region 8 of an IgNAR variable domain as defined by  FIG. 2 . 
     In another aspect, the present invention provides a modified V-set domain produced by a method of the present invention. 
     Multimers 
     The present invention also provides a binding moiety comprising a multimer comprising:
     (i) at least two IgNAR domains, which may be the same or different, and at least one of which is a IgNAR variable domain;   (ii) at least two I-set domains, which may be the same or different, and at least one of which is a I-set domain according to the present invention; or   (iii) at least two V-set domains, which may be the same or different, and at least one of which is a V-set domain according to the present invention.
 
The two domains may be derived from the same or different sources.
   

     The following description is directed to IgNAR domain multimers. It will, however, be apparent to the skilled person that many of the embodiments described with respect to IgNAR domain multimers can equally be applied to I-set and V-set domain multimers. Furthermore, it will be apparent to the skilled person that the various embodiments of the invention described herein in relation to IgNAR variable domains, I-set domains and V-set domains equally apply to IgNAR variable domains, I-set domains and V-set domains, respectively, present in the multimer embodiments of the invention. 
     Preferably, the multimer comprises two IgNAR variable domains. 
     In a preferred embodiment, the one or the at least two of the IgNAR domains is/are variable IgNAR domains(s) comprising eight 3-strand regions, designated A, A′, B, C, D, E, F and G according to  FIG. 2 , and nine loop regions, designated 1 to 9 according to  FIG. 2 . 
     In a preferred embodiment, at least one IgNAR variable domains is modified by substitution, deletion or addition of at least one amino acid within in at least one of the β-strand or loop regions as described hereinabove. 
     Where the multimer comprises at least two IgNAR variable domains, the two domains preferably form stable homodimers, preferably at least partially through salt bridges. Thus, a preferred modification is one in which at least one of the IgNAR variable domains has been modified such that the propensity to form a stable homodimer is increased. In a further preferred embodiment, the least one IgNAR variable domain has been modified so as to increase the dissociation constant of the homodimer formed compared to the homodimer formed by the unmodified IgNAR variable domain. 
     Preferably both IgNAR variable domains have been modified such that the propensity to form a stable homodimer is increased. Preferably, this is achieved by replacing the following residues of one or both of the unmodified monomers (as defined in Table 1) with cysteine residues: residues 57 and/or 61; residues 51 and either 61 or 62; residues 32 and/or 33; residue 99; or residue 59. 
     We have now cloned the full wobbegong shark ( Orectolobus maculatus ) IgNAR coding sequence (see  FIG. 33 ). The coding sequence encodes a single polypeptide chain encompassing one IgNAR I-set domain and 5 C-domains. In the mature IgNAR antibody, these chains form a dimer mediated by half-cystine residues at positions Cys430 and Cys660. The resulting two disulphide bridges are located (1) C-terminal to constant domain 3 and N-terminal to constant domain 4 and (2) C-terminal to constant domain 5. 
     Thus in a further embodiment, the multimer comprises at least one IgNAR variable domain and at least one IgNAR constant domain. Preferably the constant domain is the C1 constant domain of an IgNAR, i.e. the constant domain closest to the IgNAR variable domain in nature. We have found that connecting an IgNAR variable domain to an IgNAR constant domain has no effect on the level of binding affinity (see Example 16). This means it is possible to add mass to the binding moieties without facilitating multimerisation or loss of binding affinity. Therefore, such multimer constructs have potential as commercial biosensor reagents. 
     Multimers are one preferred design for therapeutic reagents since they have the potential to provide increased avidity and slower blood clearance rates which may provide favourable pharmacokinetic and biodistribution properties. The IgNAR domains may be connected either through covalent linkage or non-covalent linkage or a combination of linkages, including the use of chemical or genetically-encoded linkers. 
     Linkers used to link protein domains are well-known and well understood in the art, in particular in relation to proteins in the immunoglobulin superfamilies (e.g. Casey J L et al., 2002 Br J Cancer., 86(9):1401-10; Plückthun, A., and Pack, P 1997. Immunotechnology, 3, 83-105). Therefore, the skilled person will appreciate that any suitable hinge or means of connection may be used to connect the two at least IgNAR domains. Examples of suitable chemical linkage include linking the two domains using a suitable cross-linker such as dimaleimide. Alternatively, the two domains may be linked by providing cysteine residues at the respective C- and N-terminals and forming a disulphide bond. In addition, they could be linked using single chain GlySer linkers such as GlyGlyGlyGlySer. The domains may also be linked genetically using techniques well-know in the art. 
     The resulting multimers from any of these linker strategies described may possess the same, or different target specificities thus providing multivalent or multispecific reagents. In a preferred embodiment, two IgNAR variable domains may be joined to form a heterodimer through either covalent linkage or non-covalent linkage or a combination of linkages thereby providing two target binding affinities. If two or more IgNAR variable domains in the multimer have the same target specificity, the multimer will be multivalent and have increased avidity (functional affinity) for binding to two or more target molecules. 
     In the case of multimers, it will be appreciated by the skilled person that the IgNAR domains must be suitably orientated with respect to each other. The first IgNAR domain should be suitably hinged or connected to the second IgNAR domain. Where the multimer comprises an IgNAR variable domain and an IgNAR constant domain, the domains are preferably orientated with respect to each other as they would be in the respective native protein(s) from which they are derived. 
     Binding Moieties 
     With regards to binding moieties of the present invention comprising IgNAR variable domains, such binding moieties comprise an IgNAR variable domain which has been modified such that at least one property of the IgNAR variable domain is altered. It will be understood that such binding moieties do not encompass and do not relate to the full-length, wild-type proteins from which suitable IgNAR variable domains may be derived. Rather, they encompass and relate to portions of IgNARs comprising the variable domain, which have been removed or isolated from their natural environments. 
     In a preferred embodiment, the IgNAR variable domain of the binding moiety accounts for at least 25%, preferably at least 40%, more preferably at least 50%, yet more preferably at least 70%, even more preferably at least 80%, yet more preferably at least 90% and most preferably at least 95% by weight of the total molecular weight of and/or number of amino acid residues in the binding moiety. In a particularly preferred embodiment, the binding moiety consists essentially of the CBD. 
     Preferably, the only binding domains present in the binding moieties of the present invention are the modified IgNAR variable domain, the I-set domain or the V-set domain. 
     The binding moieties of the invention may be in a substantially isolated form. It will be understood that the protein may be mixed with carriers or diluents which will not interfere with the intended purpose of the protein and still be regarded as substantially isolated. Binding moieties of the invention may also be in a substantially purified form, in which case they will generally comprise the protein in a preparation in which more than 90%, e.g. 95%, 98% or 99% of the protein in the preparation is a binding moiety of the invention. 
     The binding moieties of the invention may also be linked to other molecules, for example by covalent or non-covalent means. In preferred embodiments, the binding moieties of the invention may be linked (without restriction) to molecules such as enzymes, drugs, lipids, sugars, nucleic acids and viruses. 
     In one aspect, the present invention provides a binding moiety of the present invention linked to a diagnostic reagent. 
     In a preferred embodiment of this aspect, the diagnostic reagent is selected from the group consisting of streptavidin, biotin, a radioisotope, dye marker, other imaging reagent and combinations thereof. 
     In another aspect, the present invention provides a binding moiety of the present invention immobilised on a solid support or coupled to a biosensor surface. 
     In one embodiment, the binding moiety may contain solvent exposed cysteine residues for the site-specific attachment of other entities. 
     Binding moieties of the invention can be linked to other molecules, typically by covalent or non-covalent means. For example, binding moieties may be produced as fusion proteins, linked to other polypeptide sequences. Fusion partners can include enzymes, detectable labels and/or affinity tags for numerous diagnostic applications or to aid in purification. Fusion partners, without restriction, may be GFP (green fluorescent protein), GST (glutathione S-transferase), thioredoxin or hexahistidine. Other fusion partners include targeting sequences that direct binding moieties to particular sub-cellular locations or direct binding moieties to extracellular locations e.g. secretion signals. In a preferred embodiment, binding moieties of the invention do not comprise other regions of the protein from which they are derived i.e. any fusion partners are heterologous to the IgNAR or protein from which I-set or V-set domains are derived. The heterologous sequence may be any sequence which allows the resulting fusion protein to retain the activity of the modified IgNAR variable domain, modified I-set domain or modified V-set domain. The heterologous sequences include for example, immunoglobulin fusions, such as Fc fusions, or fusions to other cellular ligands which may increase stability or aid in purification of the protein. 
     Diagnostic or therapeutic agents that can be linked to the binding moieties of the invention include pharmacologically active substances such as toxins or prodrugs, immunomodulatory agents, nucleic acids, such as inhibitory nucleic acids or nucleic acids encoding polypeptides, molecules that enhance the in vivo stability or lipophilic behaviour of the binding moieties such as PEG, and detectable labels such as radioactive compounds, dyes, chromophores, fluorophores or other imaging reagents. 
     Binding moieties may also be immobilised to a solid phase, such as a substantially planar surface (e.g. a chip or a microtitre plate) or beads. Techniques for immobilising polypeptides to a solid phase are known in the art. In addition, where libraries of binding moieties are used (e.g. in screening methods), arrays of binding moieties immobilised to a solid phase can be produced (Lee Y S and Mrksich, M, 2002 Trends Biotechnol. 20(12 Suppl):S14-8. and references contained therein). 
     In another embodiment of the invention, the binding moieties of the invention function as a protein scaffold with other polypeptide sequences being inserted into solvent-exposed regions of the binding moiety for display on the surface of the scaffold. Such scaffolds may, for example, serve as a convenient means to present peptides in a conformationally constrained manner. The scaffolds may be used to produce IgNAR variable domains, I-set domains or V-set domains with altered binding specificities and also to produce and/or screen for binding moieties having specificity for any target molecule of interest. 
     Heterologous polypeptide sequences may be inserted into one or more solvent exposed regions such as, for example, one or more loops of the IgNAR variable domains, I-set domains or V-set domains. The IgNAR variable domain, I-set domain or V-set domain of the binding moiety functions as a protein scaffold for the inserted heterologous sequences, displaying the heterologous sequences on the surface of the binding moiety. 
     The heterologous sequences may replace all or part of the loop of the IgNAR variable domain, I-set domain or V-set domain into which they are inserted, or may simply form additional sequence. Preferably, a plurality of heterologous sequences are inserted into a plurality of loops. 
     The heterologous sequences may be derived from solvent exposed regions such as, for example, loops of another IgNAR variable domain, I-set domains or V-set domains. They may also be derived from other molecules or be partially of fully randomised. 
     Polynucleotides, Vectors and Hosts 
     The present invention provides a polynucleotide encoding a IgNAR variable domain or multimeric reagent according to the present invention. 
     The present invention also provides a vector comprising a polynucleotide of the present invention. 
     The present invention further provides a host cell comprising the vector of the invention. 
     The present invention also provides a method of producing a binding moiety according to the present invention which comprises culturing a host cell of the present invention under conditions enabling expression of the binding moiety and optionally recovering the IgNAR variable domain. In a preferred embodiment of this aspect the IgNAR variable domain or multimeric reagent is unglycosylated. 
     Polynucleotides of the invention may comprise DNA or RNA. They may be single-stranded or double-stranded. They may also be polynucleotides which include within them synthetic or modified nucleotides. A number of different types of modifications to oligonucleotides are known in the art. These include methylphosphonate and phosphorothioate backbones, addition of acridine or polylysine chains at the 3′ and/or 5′ ends of the molecule. For the purposes of the present invention, it is to be understood that the polynucleotides described herein may be modified by any method available in the art. Such modifications may be carried out in order to enhance the in vivo activity or life span of polynucleotides of the invention. 
     Polynucleotides of the invention can be incorporated into a recombinant replicable vector. The vector may be used to replicate the nucleic acid in a compatible host cell. 
     Preferably, a polynucleotide of the invention in a vector is operably linked to a control sequence that is capable of providing for the expression of the coding sequence by a host cell or using an in vitro transcription/translation system, i.e. the vector is an expression vector. The term “operably linked” means that the components described are in a relationship permitting them to function in their intended manner. A regulatory sequence “operably linked” to a coding sequence is ligated in such a way that expression of the coding sequence is achieved under condition compatible with the control sequences. 
     The control sequences may be modified, for example by the addition of further transcriptional regulatory elements to make the level of transcription directed by the control sequences more responsive to transcriptional modulators. 
     Vectors of the invention may be transformed or transfected into a suitable host cell to provide for expression of a binding moiety according to the invention. This process may comprise culturing a host cell transformed with an expression vector under conditions to provide for expression by the vector of a coding sequence encoding the binding moiety, and optionally recovering the expressed binding moiety. 
     The vectors may be, for example, plasmid, phagemid or virus vectors provided with an origin of replication, optionally a promoter for the expression of the said polynucleotide and optionally a regulator of the promoter. The vectors may contain one or more selectable marker genes, for example an ampicillin resistance gene in the case of a bacterial plasmid or a neomycin resistance gene for a mammalian vector. Vectors may be used, for example, to transfect or transform a host cell. 
     Control sequences operably linked to sequences encoding the protein of the invention include promoters/enhancers and other expression regulation signals. These control sequences may be selected to be compatible with the host cell for which the expression vector is designed to be used in. The term “promoter” is well-known in the art and encompasses nucleic acid regions ranging in size and complexity from minimal promoters to promoters including upstream elements and enhancers. 
     The promoter is typically selected from promoters which are functional in prokaryotic or eukaryotic cells. With respect to eukaryotic promoters, they may be promoters that function in a ubiquitous manner or, alternatively, a tissue-specific manner. They may also be promoters that respond to specific stimuli. Viral promoters may also be used, for example the Moloney murine leukaemia virus long terminal repeat (MMLV LTR) promoter, the rous sarcoma virus (RSV) LTR promoter or the human cytomegalovirus (CMV) IE promoter. 
     It may also be advantageous for the promoters to be inducible so that the levels of expression of the binding moiety can be regulated during the life-time of the cell. Inducible means that the levels of expression obtained using the promoter can be regulated. 
     In a number of embodiments of the present invention, heterologous sequences are inserted into the various domains (including IgNAR variable domains, I-set domains and V-set domains) of the present invention. Such modifications are generally made by manipulating polynucleotides of the invention encoding the respective domain. This may conveniently be achieved by providing cloning vectors that comprise a sequence encoding a domain which sequence comprises one or more unique insertion sites to allow for easy insertion of nucleotide sequences encoding heterologous sequences into the appropriate region of the domain. 
     Each “unique” insertion site typically contains a nucleotide sequence that is recognised and cleaved by a type II restriction endonuclease, the nucleotide sequence not being present elsewhere in the cloning vector such that the cloning vector is cleaved by the restriction endonuclease only at the “unique” insertion site. This allows for easy insertion of nucleotide sequences having the appropriate ends by ligation with cut vector using standard techniques well know by persons skilled in the art. Preferably the insertion site is engineered—i.e. where the domain is derived from a naturally occurring sequence, the insertion site does not naturally occur in the natural sequence. 
     Vectors and polynucleotides of the invention may be introduced into host cells for the purpose of replicating the vectors/polynucleotides and/or expressing the binding moiety according to the invention encoded by the polynucleotides. Any suitable host cell may be used, including prokaryotic host cells (such as  Escherichia coli, Streptomyces  spp. and  Bacillus subtilis ) and eukaryotic host cells. Suitable eukaryotic host cells include insect cells (e.g. using the baculovirus expression system), mammalian cells, fungal (e.g. yeast) cells and plant cells. Preferred mammalian cells are animal cells such as CHO, COS, C 127, 3T3, HeLa, HEK 293, NIH 3T3, BHK and Bowes melanoma (particularly preferred being CHO-K1, COS7, Y1 adrenal and carcinoma cells). 
     Vectors/polynucleotides of the invention may introduced into suitable host cells using any of a large number of techniques known in the art such as, for example, transfection (for example calcium phosphate transfection or DEAE-Dextran mediated transfection), transformation and electroporation. Where vectors/polynucleotides of the invention are to be administered to animals, several techniques are known in the art, for example infection with recombinant viral vectors such as retroviruses, herpes simplex viruses and adenoviruses, direct injection of nucleic acids and biolistic transformation. 
     Host cells comprising polynucleotides of the invention may be used to express proteins of the invention. Host cells are cultured under suitable conditions which allow for expression of the binding moieties according to the invention. Expression of the binding moieties may be constitutive such that they are continually produced, or inducible, requiring a stimulus to initiate expression. In the case of inducible expression, protein production can be initiated when required by, for example, addition of an inducer substance to the culture medium, for example dexamethasone or IPTG, or inducible expression may achieved through heat-induction, thereby denaturing the repressor and initiating protein synthesis. 
     Binding moieties according to the invention can be extracted from host cells by a variety of techniques known in the art, including enzymatic, chemical and/or osmotic lysis and physical disruption. 
     Cell-free translation systems can also be used to produce the peptides of the invention. Appropriate cloning and expression vectors for use with prokaryotic and eukaryotic hosts are described in Sambrook (1989). 
     Libraries of Binding Moieties 
     Binding moieties according to the invention may be provided as libraries comprising a plurality of binding moieties which have different sequences in the IgNAR variable domains, I-set domains or V-set domains. Preferably, the variations reside in one or more loops. These libraries can typically be used in screening methods to identify a binding reagent with an activity of interest, such as affinity for a specific target molecule of interest. 
     Libraries of binding moieties are conveniently provided as libraries of polynucleotides encoding the binding moieties. The polynucleotides are generally mutagenised or randomised to produce a large number of different sequences which differ at one or more positions within at least one P strand or loop region. 
     Mutations can be introduced using a variety of techniques known in the art, such as site-directed mutagenesis. A number of methods for site-directed mutagenesis are known in the art, from methods employing single-stranded phage such as M13 to PCR-based techniques (see “PCR Protocols: A guide to methods and applications”, M. A. Innis, D. H. Gelfand, J. J. Sninsky, T. J. White (eds.). Academic Press, New York, 1990). Another technique is to use the commercially available “Altered Sites II in vitro Mutagenesis System” (Promega—U.S. Pat. No. 5,955,363). Techniques for site-directed mutagenesis are described above. Pluralities of randomly mutated sequences can be made by introducing mutations into a nucleotide sequence or pool of nucleotide sequences ‘randomly’ by a variety of techniques in vivo, including; using ‘mutator strains’, of bacteria such as  E. coli  mutD5 (Low et al., 1996, J Mol Biol 60: 9-68); and using the antibody hypermutation system of B-lymphocytes (Yelamos et al., 1995, Nature 376: 225-9). Random mutations can also be introduced both in vivo and in vitro by chemical mutagens, and ionising or UV irradiation (Friedberg et al., 1995, DNA repair and mutagenesis. SM Press, Washington D.C.), or incorporation of mutagenic base analogues (Zaccolo et al., 1996 J Mol Biol 255: 589-603). ‘Random’ mutations can also be introduced into genes in vitro during polymerisation for example by using error-prone polymerases (Leung et al., 1989, Technique 1: 11-15). 
     It is generally preferred to use mutagenesis techniques that vary the sequences present in the loop regions of the IgNAR variable domains, although framework changes (e.g. changes in the 13 stands) may also occur which may or may not be desirable. One method for targeting the loop regions is to provide a plurality of relatively short nucleotide sequences that are partially or fully mutagenised/randomised and clone these sequences into specific insertion sites in the IgNAR variable domains. 
     Another approach is to synthesise a plurality of random synthetic oligonucleotides and then insert the oligonucleotides into a sequence encoding the IgNAR variable domain, I-set domain or V-set domain and/or replace a sequence encoding the IgNAR variable domains, I-set domain or V-set domain with the random synthetic oligonucleotides. A suitable method is described in WO 97/27213 where degenerate oligonucleotides are produced by adding more than one nucleotide precursor to the reaction at each step. The advantage of this method is that there is complete control over the extent to which each nucleotide position is held constant or randomised. Furthermore, if only C, G or T are allowed at the third base of each codon, the likelihood of producing premature stop codons is significantly reduced since two of the three stop codons have an A at this position (TAA and TGA). 
     Oligonucleotide synthesis is performed using techniques that are well known in the art (see Eckstein, Oligonucleotides and Analogues: A Practical Approach, IRL Press at Oxford University Press 1991). Libraries can also be specified and purchased commercially. The synthetic process can be performed to allow the generation of all or most possible combinations over the length of the nucleic acid, thus generating a library of randomised nucleic acids. These randomised sequences are synthesised such that they allow in frame expression of the randomised peptide with any fusion partner. 
     In one embodiment, the library is fully randomised, with no sequence preferences or constants at any position. In another embodiment, the library is biased, i.e. partially randomised in which some positions within the sequence are either held constant, or are selected from a limited number of possible variations. Thus some nucleic acid or amino acid positions are kept constant with a view to maintaining certain structural or chemical characteristics. 
     The randomised oligonucleotides can then be inserted into a suitable site and/or replace a suitable sequence encoding a IgNAR variable domains, I-set domain or V-set domain. 
     Generally the library of sequences will be large enough such that a structurally diverse population of random sequences is presented. This ensures that a large subset of shapes and structures is represented and maximises the probability of a functional interaction. 
     It is preferred that the library comprises at least 1000 different nucleotide sequences, more preferably at least 10 4 , 10 5  or 10 6  different sequences. Preferably, the library comprises from 10 4  to 10 10  different sequences. Preferably at least 5, 10, 15 or amino acid residues of the peptides encoded by the nucleotide sequences are randomised. 
     Typically, the inserted peptides encoded by the randomised nucleotide sequences comprise at least 5, 8, 10 or 20 amino acids. Preferably, they also comprise fewer than 50, 30 or 25 amino acids. 
     In another aspect, the present invention provides a method of selecting a binding moiety of the present invention with an affinity for a target molecule which comprises screening a library of polynucleotides of the present invention for expression of a binding moiety with an affinity for the target molecule. 
     The libraries of polynucleotides encoding binding moieties can be screened using any suitable technique to identify a binding moiety having an activity of interest. For example, to identify a binding moiety that binds to a target molecule of interest, the library of polynucleotides is incubated under conditions that allow for expression of the binding moiety polypeptides encoded by the polynucleotides and binding of the polypeptides to the target molecule assessed. Binding is typically assessed in vitro or using whole cell assays. 
     Suitable techniques for screening the library for binding moieties having an activity of interest include phage display and ribosome display as well as the use of viral vectors, such as retroviral vectors and in vivo compartmentalisation screening by protein bioarray. 
     In a preferred embodiment this method involves displaying the IgNAR variable domain or multimeric reagent of the present invention as gene III protein fusions on the surface of bacteriophage particles. 
     In another preferred embodiment the method involves displaying the IgNAR variable domain or multimeric reagent of the present invention in a ribosomal display selection system. 
     The sequence of binding moieties identified in the screen can conveniently be determined using standard DNA sequencing techniques. 
     Diagnostic/Therapeutic Uses of Binding Moieties 
     Binding moieties of the invention, including those identified in the screening methods of the invention, may be used in methods of diagnosis/therapy by virtue of their specific binding to a target molecule of interest. Such uses will be analogous to the plethora of diagnostic/therapeutic applications already known in relation to antibodies and fragments thereof. For example, binding moieties of the invention may be used to detect the presence or absence of molecules of interest in a biological sample. 
     For diagnostic purposes, it may be convenient to immobilise the binding reagent to a solid phase, such as a dipstick, microtitre plate or chip. 
     As discussed above, binding moieties of the invention when used diagnostically will typically be linked to a diagnostic reagent such as a detectable label to allow easy detection of binding events in vitro or in vivo. Suitable labels include radioisotopes, dye markers or other imaging reagents for in vivo detection and/or localisation of target molecules. 
     Binding moieties may also be used therapeutically. For example, binding moieties may be used to target ligands that bind to extracellular receptors. 
     In addition, binding moieties of the invention may be used, in a similar manner to antibodies, to target pharmacologically active substances to a cell of interest, such as a tumour cell, by virtue of binding to a cell surface molecule present specifically on the tumour cell to which the binding moiety binds specifically. 
     Administration 
     In another aspect the present invention provides a pharmaceutical composition comprising an IgNAR variable domain or multimeric reagent according to the present invention and a pharmaceutically acceptable carrier or diluent. 
     In another aspect the present invention provides a method of treating a pathological condition in a subject, which method comprises administering to the subject a pharmaceutical composition according to the present invention. 
     Binding moieties of the invention including binding moieties identified by the screening methods of the invention may preferably be combined with various components to produce compositions of the invention. Preferably the compositions are combined with a pharmaceutically acceptable carrier, adjuvant or diluent to produce a pharmaceutical composition (which may be for human or animal use). Suitable carriers and diluents include isotonic saline solutions, for example phosphate-buffered saline. The composition of the invention may be administered by direct injection. The composition may be formulated for parenteral, intramuscular, intravenous, subcutaneous, intraocular, oral or transdermal administration. Typically, each protein may be administered at a dose of from 0.01 to 30 mg/kg body weight, preferably from 0.1 to 10 mg/kg, more preferably from 0.1 to 1 mg/kg body weight. 
     Polynucleotides/vectors encoding binding moieties may be administered directly as a naked nucleic acid construct. When the polynucleotides/vectors are administered as a naked nucleic acid, the amount of nucleic acid administered may typically be in the range of from 1 μg to 10 mg, preferably from 100 μg to 1 mg. 
     Uptake of naked nucleic acid constructs by mammalian cells is enhanced by several known transfection techniques for example those including the use of transfection agents. Example of these agents include cationic agents (for example calcium phosphate and DEAE-dextran) and lipofectants (for example Lipofectam™ and Transfectam™). Typically, nucleic acid constructs are mixed with the transfection agent to produce a composition. 
     Preferably the polynucleotide or vector of the invention is combined with a pharmaceutically acceptable carrier or diluent to produce a pharmaceutical composition. Suitable carriers and diluents include isotonic saline solutions, for example phosphate-buffered saline. The composition may be formulated for parenteral, intramuscular, intravenous, subcutaneous, oral, intraocular or transdermal administration. 
     The routes of administration and dosages described are intended only as a guide since a skilled practitioner will be able to determine readily the optimum route of administration and dosage for any particular patient and condition. 
     The various features and embodiments of the present invention, referred to in individual sections above apply, as appropriate, to other sections, mutatis mutandis. Consequently features specified in one section may be combined with features specified in other sections, as appropriate. 
     The present invention will now be further described in the following non-limiting Examples. 
     EXAMPLES 
     Example 1 
     Expression of V NAR  12Y-1 and 12Y-2 Proteins 
     Recombinant proteins 12Y-1 (SEQ ID NOs: 1 &amp; 2) and 12Y-2 (SEQ ID NOs: 3 &amp; 4) were expressed into the  E. coli  periplasm in frame with 21 residue C-terminal dual octapeptide FLAG epitopes and linker regions ( N− AAADYKDDDDKAADYKDDDDK −C ) as described (Nuttall 2004). Briefly,  E. coli  TG1 starter cultures were grown overnight in 2YT medium/ampicillin (100 μg/mL)/glucose (2.0% w/v.), diluted 1/100 into fresh 2YT/100 μg/mL ampicillin/glucose (0.1% w/v) and then grown at 37° C./200 rpm until OD 550nm =0.2-0.4. Cultures were then induced with IPTG (1 mM final), grown for a further 16 hours at 28° C. and harvested by centrifugation (Beckman JA-14/6K/10 min/4° C.). Periplasmic fractions were isolated by the method of Minsky (Minsky 1994) and recombinant protein purified by affinity chromatography through an anti-FLAG antibody-Sepharose column (10×1 cm). The affinity column was equilibrated in TBS, pH 7.4 and bound protein eluted with ImmunoPure™ gentle elution buffer (Pierce). Eluted proteins were dialysed against two changes of 0.02M Tris pH7.5, concentrated by ultrafiltration over a 3000 Da cutoff membrane (YM3, Diaflo), and analysed for purity and activity by size exclusion chromatography, SDS-polyacrylamide gel electrophoresis, and biosensor. 
     Example 1a 
     Expression of V NAR  1A-7 and 12A-9 Proteins 
     Recombinant proteins 1A-7 (SEQ ID NOs: 5 &amp; 6) and 12A-9 (SEQ ID NOs: 9 &amp; 10) were expressed into the  E. coli  periplasm, purified and analysed exactly as described in Example 1 above. 
     Example 2 
     Crystallization of V NAR  12Y-1 and 12Y-2 Proteins 
     Recombinant protein 12Y-2 (14 mg/ml) was set up in 2 μl hanging drops using the Hampton Research sparse matrix crystallization screening kit. Plates were incubated at 25° C. Final crystallization conditions were 0.1M Sodium citrate pH4.6/20% v/v iso-Propanol/20% PEG4000. Diffraction quality crystals were obtained after 48 h. 
     Recombinant protein 12Y-1 (6 mg/ml) was set up as 0.2 μl sitting drops using a Cartesian Honey Bee robot. Plates were incubated at 25° C. Successful conditions were scaled up to 21 hanging drops, using 12Y-1 protein at 13 mg/ml. Final crystallization conditions were 0.1M bis-tris Propane pH6.5/45% PPG P400. Diffraction quality crystals were obtained after 7 days. 
     Example 2a 
     Crystallization of V NAR  12A-9 and 1A-7 Proteins 
     Recombinant protein 12A-9 (7 mg/ml) was set up as 0.2 μl sitting drops using a Cartesian Honey Bee robot. Plates were incubated at 25° C. Successful conditions were scaled up to 2 μl hanging drops. Final crystallization conditions were 0.1M CHES pH 9.5/50% PEG200. Diffraction quality crystals (space group P2 1 2 1 2) were obtained after 40 days. 
     Recombinant protein 1A-7 (6 mg/ml) was set up as 0.2 μl sitting drops using a Cartesian Honey Bee robot. Plates were incubated at 25° C. Successful conditions were scaled up to 2 μl hanging drops. Final crystallization conditions were 0.1M acetate pH 4.6/20% PEP (17/8 PO/OH). Diffraction quality crystals (space group I2 1 2 1 2 1 ) were obtained after 10 days. 
     Example 3 
     Data Collection and Structure Determination for 12Y-1 and 12Y-2 
     X-ray diffraction data collections from all crystals were conducted in-house using Rigaku RAXIS IV (Rigaku-MSC) and Mar 180 (MarResearch) image plate detectors mounted on a Rigaku HR3 HB X-ray generator equipped with monocapillary focusing optics (AXCO). Data were collected at −160° C.; the crystals required no added cryoprotectant. All data processing was carried out using the DENZO/SCALEPACK suite (Otwinoski 1997). Diffraction data statistics are summarized in Table 2. 
     Initial heavy atom screening for 12Y-1 protein was performed by native polyacrylamide gel electrophoresis using the Heavy Atom Screen M2 kit (Hampton Research. Band shifts were observed for Lutetium (III) Acetate Hydrate (LAH; Lu(O 2 C 2 H 3 ) 2 ) and Potassium Hexachloro Rhenium (PHR; K 2 ReCl 6 ). Isomorphous heavy atom derivatives were obtained by soaking 12Y-1 crystals for ˜30 min in 0.8 l of 50 mM of LAH or PHR. Heavy atom sites were identified and refined with the statistical phasing program SHARP (La fortell 1997), and solvent-fattening procedures DM and SOLOMON used to resolve the phase ambiguity. The residual and anomalous difference Fourier maps produced by SHARP were examined in order to locate further heavy atom peaks, which were included in subsequent cycles of phase refinement and calculation using SHARP. Several iterations of this cycle located additional positions and improved phases to 2.82 Å. This result was achieved using the phasing power of both Lu and Re. 
     The model was manually built using XtalView (McRee 1999) into the electron-density map (centroid map) produced by SHARP. The model was then refined against the native 12Y-1 data using CNS (Brunger 1998) and CCP4 (CCP) packages. Difference electron density maps 2m|F o |-D|F c | and m|F o |-|F c | were used to improve the model in the XtalView program. During the model building and refinement, 5% of the data was flagged for cross-validation to monitor the progress of refinement. 
     The electron density map allowed unambiguous tracing of all residues except the CDR3 analogous loop residues (88-98), which disordered. Water molecules were located automatically with the program ARP (Lamzin 1997) for &gt;2σ peaks in the m|F o |-|F c | map and retained if they satisfied H-bond criteria and returned 2m|F o |-D|F c | density after refinement. Following the convergence in standard refinement, a further improvement of more than 2% in R factors was achieved by refining all protein atoms as one anisotropic domain with the TLS procedure in CCP4 REFMAC5 (Wins 2001). The libration tensor showed significant anisotropy. The final R and R free  values were 0.166 and 0.254, respectively for a 6-2.82 Å range of refined data. The final 12Y-1 model contains 100 amino acids (residues 1-87 and 99-111) and 97 water molecules. Of the residues in the 12Y-1 model, 84.5% fall in the most favourable regions of a Ramachandran plot generated by CCP4 PROCHECK (Laskowski 1993) with no residues in the generously allowed or disallowed regions. Further details are given in Table 2. 
     The structure of 12Y-2 was determined by molecular replacement using CCP4 MOLREP. The search model was the 12Y-1 structure (above) without the CDR3 analogous loop. Two 12Y-2 monomers (A and B) were identified in the asymmetric unit of the I2 1 2 1 2 1  space group. Iterative model building using XtalView and refinement using REFMAC5 allowed a complete trace of A and B monomers including extended CDR3 analogous loops. The electron density was well defined in the CDR3 analogous loop region. Progress of the refinement was monitored using the R free  statistic based on a set encompassing 5% of the observed diffraction amplitudes. Water molecules were added automatically with the program ARP as described for 12Y-1. The final refinement included the TLS parameters for each molecule individually as a TLS group in the asymmetric unit and converged to R and R free  values of 0.176 and 0.247, respectively, for the 18.12-2.18 Å range of experimental data. As for 12Y-1, only the libration tensor was significant, though less anisotropic. The final model comprises residues 1 to 113 of the 12Y-2 A and B chains, and 358 water molecules. In total, 93.4% of residues are in the most favoured regions of the Ramachandran plot, with no residues in the generously allowed or disallowed regions. This indicates that the 12Y-2 model is consistent with a highly refined protein structure. Further details are in Table 2. 
     Example 3a 
     Data Collection and Structure Determination for 12A-9 and 1A-7 
     X-ray diffraction data collection for 1A-7 crystal was conducted in-house using Mar 180 (MarResearch) image plate detectors mounted on a Rigaku HR3 HB X-ray generator equipped with monocapillary focusing optics (AXCO). X-ray diffraction data for 12A-9 crystal was collected at the Photon Factory synchrotron BL5 beamline in Japan. Data for both crystals were collected at −160° C.; the crystals required no added cryoprotectant. All data processing was carried out using the DENZO/SCALEPACK suite (Otwinoski 1997). Diffraction data statistics are summarized in Table 2. 
     The structures of 1A-7 and 12A-9 were determined by molecular replacement using CCP4 MOLREP. The search model for 1A-7 was the 12Y-1 two-fold dimer without the CDR3 analogous loops. Four 1A-7 monomers (A, B, C and D) were identified in the asymmetric unit of the I2 1 2 1 2 1  space group. Iterative model building using XtalView and refinement using REFMAC5 allowed a complete trace of A and C monomers including CDR3 analogous loops. The electron density was not well defined in the CDR3 analogous loop region (89-98) for monomers B and D. The A &amp; B and C &amp; D chains form two approximately 2-fold dimers (see  FIG. 15 ) similar to those observed in 12Y-1 and 12Y-2 structures. Water molecules were added and progress of the refinement was monitored as described for 12Y-1 and 12Y-2. The final refinement included the TLS parameters for each molecule individually as a TLS group in the asymmetric unit and converged to R and R free  values of 0.176 and 0.265, respectively, for the full 21.6-2.7 Å range of experimental data. The final model comprises residues 1 to 111 of the 1A-7 A and C chains, and residues 1-88 and 99-111 for B and D chains, and 489 water molecules. In total, 90.9% of residues are in the most favoured regions of the Ramachandran plot, with 2 residues for chain C in the generously allowed or disallowed regions. Overlay of 1A-7 full chains A and C, and 12Y-2 chain A is shown in  FIG. 5 a   . Further details are given in Table 2. 
     The search model for 12A-9 was the 12Y-1 structure (above) without the CDR3 analogous loop. One molecule of 12A-9 was identified in the asymmetric unit of the P2 1 212 space group. The electron density was traceable in the CDR3 analogous loop, however with somewhat diffuse 92-95 region. The final refinement included the TLS parameters for whole molecule and converged to R and R free  values of 0.217 and 0.280, respectively, for the full 39.5-2.1A range of experimental data. The final model comprises residues 1 to 108 of the 12A-9 (see  FIG. 14 ) and 140 water molecules. In total, 88.4% of residues are in the most favoured regions of the Ramachandran plot, with 1 residue in the generously allowed regions. Further details are in Table 2. 
     Example 4 
     Structure of the Crystallographic Dimer 
     The inter-dimer relative disposition of monomers can be described as rotation by 6.9° and screw translation by −0.43 Å. This was calculated as follows. The 12Y-1 dimer was overlaid onto that of the 12Y-2 dimer using a least-squares superposition of corresponding Ca atoms selected from a single monomer only, then the magnitude of the rotation (about the centre of mass) and translation then required to superimpose the remaining monomer from the first crystal form onto that from the second crystal form was calculated. 
     Example 5 
     Coordinates for 12Y-1 and 12Y-2 
     The coordinates for 12Y-1 and 12Y-2 are attached as Appendices I(a) and I(b) respectively. 
     Example 5a 
     Coordinates for 12A-9 and 1A-7 
     The coordinates for 12A-9 and 1A-7 are attached as Appendices I(c) and I(d) respectively. 
     Example 6 
     Modifications to Loop Regions of 12Y-2 
     Loop region 8 of 12Y-2 adopts a β-hairpin configuration with β-strands extending for a significant portion of its length, stabilized by main-chain hydrogen bonds. This β-hairpin configuration is conserved by main-chain hydrogen bonds, for example, between: Tyr87 (O)-Phe100 (N); Leu89 (N)-Leu98 (O); Leu89 (O)-Leu98 (N). The elongated loop extends outward and upward from the immunoglobulin framework and creates a structure ideal for penetrating buried clefts and cavities in, for example, enzyme active sites, parasite coat proteins, or viral canyons. The following table is a comparison of the length of loop region 8 of 12Y-2 with long CDR3 loops from cleft binding antibodies such as b12 Ig (targeting HIV gp120; Saphire 2001); camelid VHH IMEL (targeting lysozyme, Desmyter 1994); and T cell receptor 1QRN. 
     
       
         
           
               
               
               
               
               
             
               
                   
               
               
                   
                   
                 Loop 
                 Distance b/w 
                   
               
               
                 Domain 
                 Framework 
                 Tip 
                 residues 
                 Comments 
               
               
                   
               
             
            
               
                 12Y-2 V NAR   
                 Phe86 
                 Gly93 
                 20 Å 
                 β- hairpin 
               
               
                 b12 VH 1HZH 
                 Val99 
                 Trp104 
                 15 Å 
                 anti-HIV gp120 
               
               
                 VHH 1MEL 
                 Asp99 
                 Ala104 
                 14 Å 
                 Anti-lysozyme 
               
               
                 TCR Vα 1QRN 
                 Thr93 
                 Trp101 
                 09 Å 
                 Comparison 
               
               
                   
               
            
           
         
       
     
     These figures show that the 12Y-2 loop region 8 is relatively long, suggesting that the V NAR  scaffold is ideal for displaying such long CDR3-like loops. This analysis indicates that modifications to loop region 8 may lead to the generation of novel diagnostic or therapeutic binding moieties. Additionally, modifications to other regions of the V NAR  scaffold, and in particular the 12Y-2 scaffold, may also lead to the generation of novel diagnostic or therapeutic binding moieties. Examples of modifications include: 
     1. Grafting of Extended CDR3 Loops with Specifically Designed Amino Acid Sequences onto the V NAR  Scaffold in the Vicinity of Loop Region 8. 
     For example, the sequence RVGPYSWDDSPQDNYYM may be grafted onto the 12Y-2 scaffold in the vicinity of loop region 8 to form an extended loop corresponding to the anti-HIV antibody b12 (1HZH) and thereby provide novel binding moiety with an IgNAR scaffold capable of binding HIV gp120. The grafting may involve, for example, replacement of amino acid residues 86 to 103 of 12Y-2 (or a portion of these residues) with RVGPYSWDDSPQDNYYM. 
     In another example, the sequence CSKPSDSNC, representing a protruding loop of the major surface antigen (HBsAg) from hepatitis B virus (HBV) may be grafted onto the V NAR  scaffold 24G-3 (SEQ ID NO: 101), in place of the CDR3 loop. The resulting IgNAR could then be used to assess the interaction of the HBsAg loop with other HBV proteins. 
     2. Grafting of CDR1 Loops with Specifically Designed Amino Acid Sequences onto the V NAR  Scaffold in the Vicinity of Loop Region 4. 
     For example, the sequence GYRFSNFVI of the anti-HIV antibody b12 (1HZH) may be grafted onto the 12Y-2 scaffold in the vicinity of loop region 4 and, when combined with the CDR3 loop graft of the anti-HIV antibody b12 described in (1) above, will enhance the binding affinity to gp120. The grafting may involve, for example, replacement of amino acid residues 28 to 33 of 12Y-2 (or a portion of these residues) with the sequence GYRFSNFVI. 
     To determine if CDR1 loop grafting would change the affinity and expression qualities of the 12Y-2 V NAR , the N-terminal half of the 14M-15 clone (SEQ ID NOs: 11 &amp; 12) of 12Y-2 was replaced with a library of sequences. This effectively produced a library of CDR1/N-terminus framework variants combined with a fixed CDR3. 88 CDR1 shuffled V NAR  clones were analysed by ELISA for binding to AMA1 antigen. Nineteen clones had affinity for AM-1, whilst the remaining 69 showed no binding. No clones had detectable affinity for a negative control antigen (bovine serum albumin). This indicates that the CDR1 sequence and conformation is vital to IgNAR binding.  FIG. 16  presents the results of ELISA analysis of five clones with high affinity and 5 clones with no detectable affinity. Comparative expression levels are also given.  FIG. 17  presents the amino acid sequence alignment of the clones from  FIG. 16 . 
     Of the clones with highest affinity, three had similar CDR1 sequences (24A-58, 24A-75, 24A-46) but the remaining two were significantly different (24A-82 and 24A-72). The similar clones shared the common CDR1 sequence “RDTSCAFSSTG” and had 1-3 residues differing in the framework region near the N-terminus. The sequences for 5 clones with no detectable antigen affinity also had significant variability. Additionally, the amount of IgNAR protein present varied among the clones (only 4 of 88 produced no detectable protein). This indicates that the CDR1 sequence and conformation are also vital to IgNAR expression levels and protein production. Sequence differences map predominantly to the CDR1 loop region, with some contribution from framework residues, and have a marked affect on both affinity and protein expression levels. 
     3. Mutation or Insertion of Specific Residues in Loop Region 8. 
     For example, mutating residues Pro90 and/or Phe100 may enhance the flexibility of loop region 8 thereby resulting in improved antigen binding. 
     A randomly generated library of 12Y-2 variant containing on average one amino acid change per 100 residues was screened against AMA1 antigen. Two high affinity clones were isolated each separately showing 10-fold enhanced affinity over the wild type 12Y-2. These were designated 14M-15 (Pro90Leu) (SEQ ID NOs: 11 &amp; 12) and 14M-8 (Phe100Leu) (Nuttall et al. 2004). 
     4. Randomisation of the Entire Loop Region 8, Varying in Length and Amino Acid Composition. 
     This is in effect the creation of new shark libraries which are described in various Examples below. 
     5. Randomisation of the Entire Loop Region 8, Varying in Length and Amino Acid Composition Together with Improvement of the Loop Region-Framework Junctions by Incorporation of the Combinations of Paired Junction Residues: Gly84+Glu103, or Gln84+Gly102. 
     The V NAR  library was expanded by designing new degenerate oligonucleotide primers for CDR3 (loop region 8) with loop lengths of either 12 or 13 residues and framework residue combination of either: Gly84+Glu103, or Gln84+Gly102. These and other CDR3 combinations were used to construct a further V NAR  library of &gt;2×10 8  members. 
     The following new primer oligonucleotides were used: A0295 (SEQ ID NO: 64), A0296 (SEQ ID NO: 62), A0297 (SEQ ID NO: 63) and A0298 (SEQ ID NO: 61). The IgNAR domain was completed using combinations of the primers disclosed in SEQ ID Nos: 47-60.
 
6. Randomisation of the Residues at the Tip of Loop Region 8, for Example, from Residues Pro90-Ser97, or Other Such Variations, and Expansion or Contraction of this Loop by Incorporation or Removal of Residues, and Differing Number and Strategy of Randomised Residues.
 
Modification of loop region 8 residues Leu98, Leu99 may be made in a similar manner. For example:
 
Set 1 (Short loop 8 residues)
 
Leu89 to Ser97 replaced by 7 randomised residues; Leu98 constrained modification according to the nucleic acid encoding formula: (NNK)7+(SNK)1.
 
Set 2 (Randomised loop 10 residues)
 
Leu89 to Ser97 replaced by 9 randomised residues; Leu98 constrained modification according to the nucleic acid encoding formula: (NNK)9+(SNK)1.
 
     Set 3 (Long Loop Leu98-99) 
     Leu89 to Ser97 replaced by 8 randomised residues with a tyrosine/ring amino acid bias and Leu99 constrained modifications according to the nucleic acid encoding formula: (NNK) 1 (YMC) 1 (NNK) 1 (YMC) 1 (NNK)2 (YMC) 1 (NNK) 1 (SNK) 1 (SNK) 1.
 
Set 4 (Long Loop 11 residues)
 
Leu89 to Ser97 replaced by 10 randomised residues with a central tyrosine/ring amino acid bias and Leu98 constrained modification according to the nucleic acid encoding formula: (NNK)3 (YMC)4 (NNK)3 (SNK)1.
 
Set 5 (Long Loop 12 residues)
 
Leu89 to Ser97 replaced by 12 randomised residues with an aromatic bias and no Leu98 constraints according to the nucleic acid encoding formula: (NNK) 3  (WDB) 1  (NNB) 2  (WDB) 1  (NNK) 2  (WDS) 1  (NNB) 2  
 
Set 6 (Long Loop 12 residues)
 
Leu89 to Ser97 replaced by 12 randomised residues with an aromatic bias and no Leu98 constraints according to the nucleic acid encoding formula: (WDB) 1  (NNK) 2  (WDS) 1  (NNB) 2  (WDB) 1  (NNK) 2  (WDB) 1  (NNB) 2  
 
A library based on 12Y-2 of size ˜1×10 8  independent clones was constructed using equal representations of these 6 oligonucleotide primers. The library was screened against different strains of  Plasmodium falciparum : AMA1, i.e. W2MEF and HB3 (not recognised by the parent 12Y-2), and original antigen AMA-1 3D7 (positive control).
 
 FIG. 18  shows the KH (12Y-2 loop) library panned against different malarial strains.
 
     Example 7 
     Proposed Modifications to Expand the Binding Face of the V NAR    
     Results presented herein show that the V NAR  “CDR2” loop is non-existent, replaced by a short β-turn at the bottom of the molecule. This is graphically illustrated in  FIG. 12 , where the V NAR  “CDR2” is aligned with that of a typical human antibody. 
     The “bottom” position of this loop, combined with the low sequence variability, strongly suggests that this region has little impact on the interaction with antigen. However, the loss of the conventional C″ and D strands suggests a possible alternative model for antigen binding, where the extended 12Y-2 loop region 8 combines with the large concave pocket opened in the absence of the conventional CDR2. This concave pocket is a potential antigen binding face. The pocket comprises residues loop region 8, loop region 5 and C &amp; D β-strands. These residues (for 12Y-2) include: Asp33, Tyr37, Glu46, Ser48, Ser50, Ile51, Val59, Lys61, Phe86, Tyr94, Asn95, Tyr96, Leu98, Leu99 &amp; Arg101. This antigen binding surface is unlike any antibody paratope (the antigen-binding surface of an antibody), since the loop regions are distant from each other (are not in contact) and the antigen contact residues may include framework residues between the loop regions. 
     This analysis suggests that the randomisation of selected residues within the C, C′, D strands, and the loop regions 5 and 8, can be used to construct “pincerbody” molecular libraries, which will bind antigen by a combination of loop and framework residues. Suitable target residues (for the 12Y-2 structure) are, singly and in combination: 
     
       
         
           
               
               
               
               
             
               
                   
               
               
                 Residue 12Y-2 
                 Residue 12Y-1 
                 Designation 
                 Position 
               
               
                   
               
             
            
               
                 Tyr37 
                 Tyr37 
                 Bottom jaw 
                 C strand 
               
               
                 Glu46 
                 Glu46 
                 Bottom jaw 
                 C′ strand 
               
               
                 Ser48 
                 Thr48 
                 Bottom jaw 
                 C′ strand (Loop region 5) 
               
               
                 Ser50 
                 Ser50 
                 Bottom jaw 
                 Loop region 5 
               
               
                 Ile51 
                 Ile51 
                 Bottom jaw 
                 Loop region 5 
               
               
                 Asp33 
                 Ser33 
                 Top jaw 
                 Loop region 4 
               
               
                 Val59 
                 Val59 
                 Top jaw 
                 D strand 
               
               
                 Lys61 
                 Lys61 
                 Top jaw 
                 Loop region 6 
               
               
                 Phe86 
                 Phe86 
                 Top jaw 
                 Loop region 8 
               
               
                 Arg101 
                 N/A 
                 Top jaw 
                 Loop region 8 
               
               
                 Tyr94 
                 N/A 
                 Overbite 
                 Loop region 8 
               
               
                 Asn95 
                 N/A 
                 Overbite 
                 Loop region 8 
               
               
                 Tyr96 
                 N/A 
                 Overbite 
                 Loop region 8 
               
               
                 Leu98 
                 N/A 
                 Overbite 
                 Loop region 8 
               
               
                 Leu99 
                 N/A 
                 Overbite 
                 Loop region 8 
               
               
                   
               
            
           
         
       
     
     A randomly generated library of 12Y-2 variants containing on average one amino acid change per 100 residues was screened against AMA1 antigen. A high affinity clone was isolated incorporating the mutations Pro90Leu (identical to 14M-15) and the additional mutation Thr39Ser. This protein (22A-2: SEQ ID NO: 15) had two-fold better affinity than 14M-15, by ELISA (see  FIG. 22( a ) ), biosensor (see  FIG. 22( e ) ), and protein bioarray (K D  2.6 nM vs K D  6.5 nM). Protein expression characteristics were unchanged (see  FIG. 22( d ) ). This mutation is at position 39 in the framework just N-terminal to β-strand region C (see  FIGS. 22( b ) and ( c ) ). This indicates that framework region mutations can have a significant effect upon affinity, especially in the vicinity of “CDR2”. Without being limited by theory, it is believed that this may affect the torsions of the strands which alter the CDR conformations sufficiently to enhance binding. 
     Example 8 
     Generation of Therapeutics or Diagnostics by Loop Grafting from Shark to Human Domains 
     The structures of IgNARs and human Immunoglobulin superfamily I-set domains are homologous enough to allow prediction of framework/loop region junctions, take-off angles of strands; and loop orientations. Binding loops discovered for V NAR s can be grafted to human I-set frameworks such as but not limited to NCAM, ICAM, and Telokin. This will form a human binding domain Ig-like reagent with only the variable loop regions derived from non-human sources. These may be particularly useful as cleft-binding “human-Ig-like” reagents, since they possess antigen-binding surfaces different from any known naturally occurring antibody. 
     The following modifications may, for example, be made to I-set framework molecules such as NCAM, ICAM or Telokin:
     1. Grafting of anti-AMA1 loop region 8 from 12Y-2 onto I-set framework.   2. Grafting of anti-AMA1 loop region 4 and 8 from 12Y-2 onto I-set framework.   3. Grafting of anti-AMA1 loop region 8 from 12Y-1 onto I-set framework.   4. Grafting of anti-AMA1 loop region 4 and 8 from 12Y-1 onto I-set framework.   5. Grafting other V NAR  loop region 8 onto I-set framework.   6. Grafting other V NAR  loop region 4 onto I-set framework.   7. Grafting of loop regions 4 and 8 from V NAR s onto I-set framework, where these loops are linked by a disulphide bridge.   8. Incorporation of loop region 4-8 disulphide bridges into loops grafted onto I-set framework.   9. Generation of a library of I-set frameworks by randomising equivalent loops the loop regions 4 and 8.   10. Generation of a library of I-set frameworks by randomising equivalent loops to loop regions 4 and 8, and use as a set of variable “virus traps” for identifying viruses targeting the cell adhesion molecules.   

     Cloning of NCAM and Telokin. 
     The Neural Cell Adhesion Molecule 1 (NCAM; CD56) is a mammalian cell-surface glycoprotein which mediates neuronal cell adhesion. The extracellular domain consists of 5 Ig superfamily domains followed by 2 fibronectin Type 3 domains (see  FIG. 23( a ) ). Domain 1 of NCAM is classified within the I-set of the Ig superfamily and is unmodified by glycosylation or other post-translational modification. 
     Coding sequences for the wild-type human NCAM domain 1 (SEQ ID NO: 37) and wild-type human NCAM domains 1+2 (SEQ ID NO: 39) were amplified from a human cDNA library and cloned in-frame into the  E. coli  cloning/expression vector pGC. A0657 (SEQ ID No: 77) was used as the forward 5′ primer for domain 1. A0658 (SEQ ID No: 78) was used as the reverse 3′ primer for domain 1. A0659 (SEQ ID NO: 79) was used as the reverse primer for domain 2. A0979 (SEQ ID NO: 80) was used as the NCAM secondary extension primer. 
     Clones were verified by DNA sequencing. Both the wild-type domain 1 (clone 21H-5: SEQ ID NO: 36) and wild-type domains 1+2 (clone 21G-1: SEQ ID NO: 38) were successfully expressed as soluble protein into the  E. coli  periplasmic space as measured by Fast Protein Liquid Chromatography (FPLC) (see  FIG. 23( c ) ) and SDS-PAGE. Crystal leads were obtained for providing evidence for folding into an ordered conformation. 
     Myosin Light Chain Kinase (MLCK) consists of 3 N-terminal Ig-like domains, a calmodulin-binding catalytic domain, and one C-terminal Ig-like domain (see  FIG. 24( a ) ). Activation of MLCK following binding by calcium-calmodulin results in phosphorylation of a specific serine in the N-terminus of a myosin light chain, leading to the formation of calmodulin/MLCK signal transduction complexes which allow selective transduction of calcium signals, ultimately causing muscle contraction. The Ig-like domains flanking the catalytic domain enable binding of MLCK to myosin. Independent transcription of the C-terminal Ig-like domain of MLCK from an internal promoter gives rise to the production of the mature protein, Telokin. Telokin is an I-set Ig domain and has phosphorylation sites at Ser-12 and Ser-18. It appears to modulate MLCK activity by binding to unphosphorylated myosin thus preventing phosphorylation by MLCK. 
     The coding sequence for the human Telokin domain 1 was amplified from a human cDNA library and cloned in-frame into the  E. coli  cloning/expression vector pGC. A0678 (SEQ ID No: 88) was used as the forward 5′ primer. A0677 (SEQ ID NO: 89) was used as the reverse 3′primer. A0999 (SEQ ID NO: 96) was used as the Telokin N-terminus secondary extension primer. Clone 21J-4 was correct as verified by DNA sequencing (SEQ ID NO: 42). Telokin domain was successfully expressed as soluble protein (SEQ ID NO: 41) into the  E. coli  periplasmic space as measured by FPLC (see  FIG. 24( c ) ) and SDS-PAGE. 
     Modeling and Loop Grafts 
     In order to produce human binding domain Ig-like reagent with only the variable loop regions derived from non-human sources, i.e. shark IgNAR antibodies, the CDR3 loop from V NAR  1A-7 was modeled for loop-grafting to NCAM domain 1 and Telokin I-set domains. Shark V NAR s, NCAM domain 1 and Telokin were least squares aligned to determine where framework structural homology was greatest to assess grafting points for variable “V NAR  CDR3” loops. These loops varied in both length and sequence and were modelled as chimeras onto NCAM domain 1 and Telokin frameworks to produce human binding domain Ig-like reagents. 
     A variety of chimeras were then designed and constructed using Modeller6v2 with variation of the V NAR  CDR3 (i.e. loop region 8) length and sequence according to Table 5. Each model was then assessed for deviation from the human framework and V NAR  CDR3 structures by visual inspection and for potential stability (energy) according to the modeller objective scores. 
     The best scoring models were for NCAM model 5, and for Telokin model 3 and model 5. 
     NCAM—1A-7 Loop Grafts: 
     The best NCAM/shark 1A-7 CDR3 loop graft (model 5) was constructed by overlap PCR using oligonucleotide primer A0989 (SEQ ID NO: 81). The resulting clone designated 23B-2 was verified by DNA sequencing (SEQ ID NO: 40). 
     Protein expression and purification showed that the resulting recombinant protein appeared more stable than the wild type, for example there appeared little degradation by SDS-PAGE (see  FIG. 25( c ) ), and a single peak by FPLC (see  FIG. 25( b ) ). This protein when placed in crystallisation trials gave several strong crystal leads, indicating that it was folded into a stable and ordered structure. Recombinant protein 23B-2 specifically interacted with the target antigen (monoclonal antibody 5G-8) but not to a negative control antigen (lysozyme) in an ELISA (see  FIG. 25( d ) ). Specific binding of the 23B-2 but not wild type NCAM domain 1 was confirmed by Biosensor (see  FIG. 25( e ) ). 
     Telokin 1A-7 Loop Grafts 
     The best Telokin/shark 1A-7 CDR3 loop grafts (models 3 &amp; 5) were constructed by overlap PCR using oligonucleotide primers A1022 (primary extension primer) (SEQ ID NO: 90) and A1023 (secondary extension primer) (SEQ ID NO: 91) (Model 3), and primers A1024 (primary extension primer) (SEQ ID NO: 92) and A1025 (secondary extension primer) (SEQ ID NO: 93) (Model 5). The resulting clones were designated 24F-4 (SEQ ID NOs: 43 &amp; 44) (model 3) and 23C-7 (SEQ ID NOs: 45 &amp; 46) (model 5), and were verified by DNA sequencing. 
     Protein expression and purification showed that the resulting recombinant proteins were expressed into the  E. coli  periplasmic space. FPLC traces and SDS-PAGE profiles of the recombinant proteins are shown in  FIG. 26( b )  &amp; (c). Both loop graft model recombinant protein (23C-7, 24F-4) specifically interacted with the target antigen (monoclonal antibody 5G-8) but not a negative control antigen (lysozyme) (see  FIG. 26( d ) ). Specific binding of the 24F-4, but not wild type Telokin, was confirmed by Biosensor (see  FIG. 26( e ) ). 
     Example 9 
     Generation of Therapeutics or Diagnostics by Loop Grafting from Human Domains to Shark V NAR s 
     The structures of IgNARs human Immunoglobulin superfamily I-set domains are homologous enough to allow prediction of framework/loop region junctions, take-off angles of strands, and loop orientations. I-set domains such as ICAM-1 have been implicated as receptors for viruses such a rhinovirus. Binding loops on ICAM-1 specific for rhinovirus binding can be grafted to V NAR  frameworks, giving rise to novel binding moieties. This can be further expanded to other viral diagnostics based on I-set domains. 
     For example, the following modifications may be made to shark NARs:
     1. Grafting of rhinovirus-binding ICAM-1 VLR loops onto the 12Y-2 framework.   2. Grafting of rhinovirus-binding ICAM-1 VLR loops onto the 12Y-1 framework.   3. Grafting of rhinovirus-binding ICAM-1 VLR loops onto a V NAR  framework.   4. Grafting of rhinovirus-binding ICAM-1 VLR loops onto a dimeric or multimeric V NAR  framework.   5. Grafting of rabies virus-binding NCAM VLR loops onto the 12Y-2 framework.   6. Grafting of rabies virus-binding NCAM VLR loops onto the 12Y-1 framework.   7. Grafting of rabies virus-binding NCAM VLR loops onto a V NAR  framework.   8. Grafting of rabies virus-binding NCAM VLR loops onto a dimeric or multimeric V NAR  framework.   9. Grafting of virus-binding I-set VLR loops onto a V NAR  framework.   10. Grafting of virus-binding I-set VLR loops onto a dimeric or multimeric V NAR  framework.   

     VLRs are the variable loop regions of V-set and I-set domains, these being the loop regions which typically extend between β-strand conformations and which demonstrate natural amino acid variation without compromising the framework structure of the domain. VLRs include those regions typically referred to as CDRs. 
     Example 10 
     Generation of Soluble Human Variable Domains by “Sharkisation”: CDR2 Region 
     CDR2 loops generated by the C′ and C″ strands of the V-set immunoglobulin superfamily proteins are important in antigen binding and maintenance of the solvent solubility of the immunoglobulin. With the shark domain CDR2 loop equivalent in “bottom” position, there is now a solvent-exposed patch of residues at the C-terminus of loop region 4 and in the C and D β-strands, which in other immunoglobulin domains is shielded by the CDR2 loop. This solvent-exposed face consists mainly of the 12Y-2 residues Lys32, Asp33, Thr34, Gly35, Tyr55, Glu57, Thr58. The charged and polar patch formed by residues Asp33-Thr34-Glu57 appears to be particularly significant. 
     In one example, these residues may be “transferred” to I-set variable domains, for example neural cell adhesion molecules (NCAMs), to render these proteins more soluble when expressed in a single domain format. 
     In another example, these residues may be “transferred” to V-set domains such as TCRs and antibodies, where the CDR2 loop has been removed to avoid superantigen stimulation. See, for example, the following table: 
     
       
         
           
               
               
               
               
               
             
               
                   
               
               
                   
                   
                   
                   
                 TCR α 
               
               
                 Residue 12Y-2 
                 Residue 12Y-1 
                 Conservation 
                 TCR α§ 
                 conservation 
               
               
                   
               
             
            
               
                 Lys32 
                 Glu32 
                 minimal 
                 Gly30 
                 minimal 
               
               
                 Asp33 
                 Ser33 
                 Charged/polar 
                 Ser31 
                 S, F, P, T 
               
               
                 Thr34 
                 Thr34 
                 100% * 
                 Phe32 
                 F, L, I 
               
               
                 Gly35 
                 Gly35 
                 G, Y, D, S ¶ 
                 Phe33 
                 F, L, H, Q 
               
               
                 Tyr55 
                 Tyr55 
                 100% * 
                 Phe62 
                 F, M, L 
               
               
                 Glu57 
                 Glu57 
                 100% * 
                 Thr63/ 
                 varies 
               
               
                   
                   
                   
                 Ala64 
               
               
                 Thr58 
                 Thr58 
                 100% * 
                 Gln65 
                 Q, F, E, L 
               
               
                   
               
               
                 §For TCR α of 1ao7. 
               
               
                 ¶ In Nurse shark Type1, this position occupied by half-cysteine. 
               
               
                 * Across Wobbegong, Nurse, and Bamboo sharks, Types 1, 2, &amp; 3 IgNARs. 
               
            
           
         
       
     
     Example 11 
     Generation of Soluble Human TCRs by “Sharkisation”: VH/VL Interface 
     Attempts in the past to produce single human TCR domains have been problematic at best, due to low solubility and difficulty in expression. Comparison of the 12Y-1 and 12Y-2 V NAR s to the TCR α (and β) domains show a number of aspects where the human TCR could be modified by reference to the shark structure. “Sharkisation” gives us the opportunity to separately produce the TCR Vα or Vβ domain and enhance its solubility by directed mutation. 
     Table 6 presents a comparison of TCR interfaces with the 12Y-2 and camelid variable domains. This analysis suggests that the following modifications may be made to enhance solubility of TCR domains:
     1. Residue Ser31 in the TCR interface is almost always a serine or tyrosine: thus a polar residue. In V NAR s it can be a charged (Asp) residue, or a serine in ˜50% of cases. Mutation of residue 31 of a TCR domain to Asp may therefore enhance solubility.   2. Significant residues in the TCR domain interface are Pro43/Leu89/Phe106 (and equivalents). This is an extensive hydrophobic patch in TCR Vα and Vβ domains. Mutation of these residues to form a charged pocket, similar to that formed by residues Glu46, Lys82, Lys104 of 12Y-2 may therefore enhance solubility.   

     Example 12 
     Generation of Soluble Antibody Variable Domains by “Sharkisation”: VH/VL Interface 
     Attempts in the past to produce single antibody variable domains have encountered solubility and expression problems. Comparison of the 12Y-1 and 12Y-2 V NAR s to antibody VH and VL domains shows a number of aspects where these individual domains could be modified by reference to the shark structure, to improve solubility and expression levels. For example:
     1. Modification of the VH or VL interface to enhance solubility of the isolated single domain, using residues described in Example 11 above. Mutation of these residues to form a charged pocket, similar to that formed by residues Glu46, Lys82, Lys 104 of 12 Y-2 may therefore enhance solubility.   

     Example 13 
     Modification of V NAR  Dimers 
     The 12Y-1 &amp; 12Y-2 dimer forms are a continuous 8-stranded β-sheet underneath the loop regions (buried surface area at interface ˜1760 Å2). The interactions between the 2-fold monomers involve main-chain (3 sheet interactions between D strands and between loop region 8 as well as side-chain interactions and water mediated contacts. This suggests a significant propensity for dimer interactions with non-standard involvement of loop regions in complex formation. 
     The dimer form may act as a single binding entity with the loop region 8 residues and framework residues of the dimer available for mutation and library selection. This suggests that the following modifications may be made to generate binding moieties with potential diagnostic or therapeutic applications:
     1. Stabilisation of a recombinant dimer by introduction of cysteine residues at positions Lys61 and Glu57 in the D strand of a V NAR . Alternatively, stabilisation may be achieved by the introduction of cysteine residues at positions Ile51 and either Lys61 or Gly62 in the D strand.   2. Stabilisation of the recombinant dimer by introduction of cysteine residues at positions Lys32 and Asp33 in loop region 4 of the V NAR .   3. Stabilisation of the recombinant dimer by introduction of cysteine residues at position Val 59.   4. Stabilisation of a recombinant dimer by introduction of cysteine residues at positions Leu98 and/or Leu99 in loop region 8 of the V NAR  region.   5. Randomisation of loop region 8 of 12Y-2 and P sheet residues to form a binding surface. For eg 12Y-2 residues Asp26-Glu30 inclusive (27 should be hydrophobic); Tyr87-Glu103, though buried residues should be hydrophobic. In this case residues Asp93-Tyr96 are from the symmetry related molecules.   6. Randomisation of the loop regions 4 and 8 of the V NAR  and P3 sheet residues to form a binding surface. It will be appreciated that the loop region sequences will be different for each example.   7. Multimerisation by using the dimer to present two copies of the same binding specificity.   8. Multimerisation by using the dimer to present two different binding specificities.   

     Modification of the V NAR  Dimer 
     If the crystallographic dimer is a natural form, and the continuous 8-stranded β-sheet is formed under physiological conditions, then various residues are paired across the dimer interface. Thus, in the crystallographic structure the side chains of Leu99 residue are adjacent, in the correct orientation, and of appropriate distance (˜3 Å) to from a disulphide bridge. 
     To test this hypothesis, the double 12Y-2 mutant Pro90Leu and Leu99Cys was created. These mutations enhance the natural affinity for the target antigen (Pro90Leu), making binding easier to detect, and are in the correct position to moderate dimerisation (Leu99Cys). 
     Overlap PCR using oligonucleotide primers was used to construct DNA clone 21B-5 (SEQ ID NO: 13 &amp; 14). This was confirmed as correct by DNA sequencing. 
     The resultant clone 21B-5 was clearly visible as a dimer form by FPLC and by SDS-PAGE in the absence of reducing agent (see  FIG. 27( c )  &amp; (e)), compared to the wild type (14M-15, Pro90Leu only). Purified monomer bound immobilised AMA1 by ELISA and by biosensor (See  FIG. 27( b )  &amp; (d)). The purified disulphide-linked dimer did not bind the target antigen, demonstrating both the importance of the CDR3 and that the novel dimer form appears to present a different interface to antigen than the monomeric protein. The dimer species could be crystallised, is stable, and may form the basis of a binding interface different from that of monomeric IgNAR forms. 
     Example 14 
     Design, Construction, and Screening of Human I-Set Domains Based on Shark IgNAR Principles 
     Shark IgNAR antibodies are structurally close to I-set domain immunoglobulins such as Telokin and domain 1 of NCAM. Specifically, what would otherwise be a CDR2 loop is at the “bottom” of the molecule. The foregoing structural, protein engineering, and library selection experiments suggest that the principles learnt from shark IgNAR antibody structures can be successfully applied to the generation of binding repertoires of human I-set immunoglobulins. Such libraries are anticipated to primarily contain variability in the CDR1 and CDR3 analogous regions. The foregoing experiments also indicated that downstream affinity maturation strategies targeting framework regions (as well as the loop regions) of the NCAM and Telokin domains may result in altered and enhanced binding affinities and specificities. 
     Shark IgNAR antibodies and NCAM domain 1 and Telokin were modelled to determine the best CDR-framework junction residues for mutation and incorporation of library randomisation. This allowed incorporation of randomised “CDR” loops which varied in both length and sequence. Additionally, in at least one variant for each of NCAM and Telokin, the human CDR3 framework was extended by analogy with the successful human/shark model 5 loop grafts, to provide a CDR3 loop extending several residues above the NCAM or Telokin scaffold (NCAM/A0988 library; Telokin/A1017 library). 
     Following identification of framework junctions, oligonucleotide primers were designed to build human-scaffold-based libraries, based on both NCAM domain 1 and Telokin domain. 
     NCAM Library Oligonucleotide Primers: 
     A0980 NCAM CDR1 randomisation 6-loop (SEQ ID NO: 82); A0981 NCAM CDR1 randomisation 7-loop (SEQ ID NO: 83); A0982 NCAM CDR3 randomisation: rev comp1; 8 loop (SEQ ID NO: 84); A0987 NCAM CDR3 randomisation: rev comp1; 11 loop (SEQ ID NO: 85); A1018 NCAM CDR3 randomisation: rev comp1; 14 loop (SEQ ID NO: 86); A0988 NCAM CDR3 randomisation: rev comp1; 8 loop based on Model 5 (SEQ ID NO: 87). 
     Telokin Library Oligonucleotide Primers: 
     A1001 Telokin CDR1 randomisation; 7 loop (SEQ ID NO: 94); A1002 Telokin CDR1 randomisation; 9 loop (SEQ ID NO: 95); A1000 Telokin CDR3 randomisation: rev comp1; 6 loop (SEQ ID NO: 97); A1003 Telokin CDR3 randomisation: rev comp1; 9 loop (SEQ ID NO: 98); A1004 Telokin CDR3 randomisation: rev comp1; 12 loop (SEQ ID NO: 99); A1017 Telokin CDR3 randomisation: rev comp1; 9 loop based on Model 5 (SEQ ID NO: 100). 
     Three molecular libraries were constructed as follows: 
     
       
         
           
               
               
               
               
             
               
                   
               
               
                 No 
                 Library 
                 CDR coverage 
                 Final Size 
               
               
                   
               
             
            
               
                 1 
                 NCAM 1 + 3 
                 CDR1, CDR3 
                 6 × 10 7   
               
               
                 2 
                 NCAM 3 
                 CDR3 
                 7 × 10 4   
               
               
                 3 
                 Telokin 1 
                 CDR1 
                 5. × 10 6   
               
               
                   
               
            
           
         
       
     
     Library numbers 1 and 2 from the above table were pooled and immunopanned by bacteriophage display against amyloid αβ (1-42) peptide and the Carcino Embryonic Antigen (CEA).  FIG. 30  shows the results of the panning against amyloid αβ (1-42) peptide (panels and A and B) and CEA (panels and C and D). In particular, binding to antigens (panels A &amp; C) and comparative expression levels of individual clones (panels B &amp; D) are shown.  FIG. 31  shows the titres of eluted phage from the NCAM library panned against monoclonal antibody 5G8 (-♦-), AMA1 (-▪-), Hepatitis B virus E antigen (-▴-), ab 1-42 peptide (-x-), Carcino Embryonic Antigen (*); and, the Telokin library panned against monoclonal antibody 5G8 (). 
     Example 15 
     12Y-2 IgNAR Protein Stability 
     Shark blood is rich in urea. Thus IgNAR domains may be hypothesised to have evolved to be unusually resistant to treatment with such harsh chemical agents. Recombinant IgNAR 14M-15 (12Y-2 Pro90Leu variant) (SEQ ID NO: 11) was tested for its ability to refold after denaturation in 8M urea. Regeneration was measured by intrinsic fluorescent intensity (see  FIG. 32 ). The IgNAR domain re-folded to its native conformation following removal of the urea. 
     Example 16 
     Full IgNAR Coding Sequence and the Production of Variable and Constant Domain Reagents for Biosensor Analysis 
     The full wobbegong shark ( Orectolobus maculatus ) IgNAR coding sequence was cloned from shark cDNA (clone designated 18H-2 (SEQ ID NOs: 31 &amp; 32)). The full DNA and amino acid sequences are given in  FIG. 33 . The DNA sequence encodes a single polypeptide chain encompassing one IgNAR I-set domain and 5 C-domains (see  FIG. 34( a ) ). In the mature IgNAR antibody, these chains form a dimer mediated by half-cystine residues at positions Cys430 and Cys660. The resulting two disulphide bridges are located (1) C-terminal to constant domain 3 and N-terminal to constant domain 4 and (2) C-terminal to constant domain 5. The numbering adopted is for protein 18H-2; residues numbers will be different in each IgNAR due to the size differences in the variable domains. 
     Each constant domain is ˜12 kDa in molecular weight. Sequential addition of constant domains 1, 2, and 3 to an IgNAR variable domain produce a set of single chain monovalent proteins with identical affinity for antigen, but varying in their molecular weight (see table below). For example, addition of the 12Y-2 variable domain to varying numbers of constant domains produces a set of molecules with identical affinities for the target antigen AMA1, but with varying molecular weights. Of the variety of biosensors available, many rely on mass differences. These reagents provide an ideal test system of measuring the effect of mass differences for a single affinity. 
                                             Clone   SEQ ID       Product   No. of       Designation   NOs   Format   MW   Residues                                                    12Y-2   3 &amp; 4   V   12,469   113       17T-6   33   V + C1   24,260   219       18C-4   34   V + C1 + C2   35,092   319       18J-1   35   V + C1 + C2 + C3   46,821   425                    
12Y-2 and 17T-6 proteins were compared by protein chemistry and biosensor (see  FIG. 34( b )-( d ) ). Results indicate that 17T-6 (i.e. 12Y-2+constant domain 1) is produced as a soluble monomeric protein of the correct molecular weight. It has identical binding affinity for the target AMA1 as does the parent 12Y-2, when adjusted for mass.
 
     Example 17 
     Modelling of Type 3 IgNAR 
     One of the Type 2 IgNAR variable domains solved structures is 12A-9. This structure has a disulphide linkage between loops regions 4 and 8 (i.e. between the CDR1-CDR3 analogous regions). This particular IgNAR is similar in CDR3 length and disulphide-bond position to Type 3 IgNARs, which are found in embryonic sharks. See Genbank AAM77190 (SEQ ID NO: 29) and AAM77191 (SEQ ID NO: 30) (Nurse shark Type 3 IgNARs). 
     As a class, the Type 3 IgNAR variable domains are characterized by constant length loop regions analogous to CDR3s, disulphide bonds connecting the CDR1 and CDR3 analogous loops (which happens to be in the same position as in 12A-9), and a conserved tryptophan residue at position 31. 
     Alignment of 12A-9 with Two Type 3 IgNARs 
     CLUSTAL W (1.74) Multiple Sequence Alignment 
       
     
       
         
           
               
               
               
            
               
                 12A-9 
                 ARVDQTPRIATKETGESLTINCVLRDTACALDSTNWYRTKLGSTKEQTISIGGRYSETVD 
                   
               
               
                 AAM77190 
                 ARVDQTPKTITKETGESLTINCVLSDTSCAWDSTYWYRKKLDSTNEESTSKGGRYVETVN 
               
               
                 AAM77191 
                 ARVDQTPKTITKETGESLTINCVLSDTSCAWDSTYWYRKKLDSTNEESTSKGGRYVETVN 
               
               
                   
                 *******:  ************** **:** *** ***.**.**:*:: * **** ***: 
               
               
                   
               
               
                 12A-9 
                 EGSNSASLTIRDLRVEDSGTYKCKAYRRCAFNTGVGYKEGAGTVLTVK 
               
               
                 AAM77190 
                 SESTSFSLRINDLTVEDSGTYRCRAYLYCGSQLDSFDEYGGGTIVTVS 
               
               
                 AAM77191 
                 SESTSFSLRINDLTVEDSGTYRCRAYLYCGAELDSFDEYGGGTIVTVN 
               
               
                   
                 . *.* ** *.** *******:*:**  *. : .   : *.**::**. 
               
               
                   
               
               
                 12A-9 
                 ARVDQTPRIATKETGESLTINCVLRDTACALDSTNWYRTKLGSTKEQTISIGGRYSETVD 
               
               
                 AAM77191 
                 ARVDQTPKTITKETGESLTINCVLSDTSCAWDSTYWYRKKLDSTNEESTSKGGRYVETVN 
               
               
                   
                 *******:  ************** **:** *** ***.**.**:*:: * **** ***: 
               
               
                   
               
               
                 12A-9 
                 EGSNSASLTIRDLRVEDSGTYKCKAYRRCAFNTGVGYKEGAGTVLTVK 
               
               
                 AAM77191 
                 SESTSFSLRINDLTVEDSGTYRCRAYLYCGAELDSFDEYGGGTIVTVN 
               
               
                   
                 . *.* ** *.** *******:*:**  *. : .   : *.**::**: 
               
            
           
         
       
     
       FIG. 35  shows the modeling of Type 3 V NAR  AAM77191 based on the 12A-9 crystal structure. The results of four modelling runs are shown compared with the template 12A-9. 
       FIG. 36  shows a model of a V NAR  Type 3 CDR1 and CDR3 analogous regions based on the 12A-9 structure. The isotype has limited diversity with the hypervariable residues (by sequence alignment) depicted in dark grey. The modeling suggests that the conserved Phe96 can adopt a number of structural conformations, dramatically enhancing the antigen-binding range of this antibody, despite the low sequence variability 
     It will be appreciated by persons skilled in the art that numerous variations and/or modifications may be made to the invention as shown in the specific embodiments without departing from the spirit or scope of the invention as broadly described. The present embodiments are, therefore, to be considered in all respects as illustrative and not restrictive. 
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         Harpaz, Y. &amp; Chothia, C. Many of the immunoglobulin superfamily domains in cell adhesion molecules and surface receptors belong to a new structural set which is close to that containing variable domains.  J. Mol. Biol.  238, 528-539 (1994). 
         Hendrickson.  Acta Cryst., Section A , A35, 158 (1979) 
         Hodder, A. N. et al. The disulfide bond structure of  Plasmodium  apical membrane antigen-1 . J. Biol. Chem.  271, 29446-29452 (1996). 
         Holden, H. M., Ito, M., Hartshorne, D. J. &amp; Rayment, I. X-Ray Structure Determination of Telokin, the C-Terminal Domain of Myosin Light Chain Kinase, at 2.8 Angstroms Resolution.  J. Mol. Biol.  227, 840-851 (1992). 
       
    
     Hong, L., Koelsch, G., Lin, X., Wu, S., Terzyan, S., Ghosh, A. K., Zhang, X. C. and Tang, J.  Science,  290, 150-153.
     Jespers, L., Schon, O., James, L. C., Veprintsev, D. &amp; Winter, G. Crystal Structure of HEL4, a Soluble, Refoldable Human VH Single Domain with a Germ-line Scaffold.  J. Mol. Biol.,  337, 893-903 (2004).   Jones et al.,  Acta Cryst ., A47, 110-119 (1991)   Kabat, E. A., Wu, T. T., Bilofsky, H., Reid-Miller, M. &amp; Perry, H., in “Sequences of Proteins of Immunological Interest”, U.S. Dept. Health and Human Services, 1983 and 1987.   Kabsch.  Acta Cryst., Section A , A92, 922 (1976).   Kabsch.  Acta Cryst ., A34, 827-828 (1978).   Kortt, A. A., Guthrie, R. E., Hinds, M. G., Power, B. E., Ivancic, C., Caldwell, J. B., Gruen, L. C., Norton, R. S. and Hudson, P. J. Solution properties of  E. coli  expressed VH domain of anti-neuraminidase antibody NC41 . J. Protein Chem.  14, 167-178 (1995).   La Fortelle, E. de, &amp; Bricogne, G. “SHARP: A Maximum-Likelihood Heavy-Atom Parameter Refinement Program for the MIR and MAD Methods”. In Carter, C. W., and Sweet, R. M., eds,  Meth. Enzym.  276, 472-494. Academic Press, Orlando, Fla., 1997.   Lamzin, V. S. &amp; Wilson, K. S. Automated refinement for protein crystallography.  Methods Enzymol.  277, 269-305 (1997).   Laskowski, R. A., MacArthur, M. W., Moss, D. S. &amp; Thornton, J. M. PROCHECK: a program to check the stereochemical quality of protein structures.  J. Appl. Crystallog.  26, 283-291 (1993).   Lo Conte, L., Chothia, C. &amp; Janin, J. The atomic structure of protein-protein recognition sites.  J. Mol. Biol.  285, 2177-2198 (1999).   Lu, G. An Approach for Multiple Alignment of Protein Structures, in manuscript (1998).   McLachan.  J. Mol. Biol.,  128, 49 (1979).   McRee, D. E. XtalView/Xfit—a versatile program for manipulating atomic coordinates and electron density.  J. Struct. Biol.  125, 156-165 (1999).   Minsky, A., Summers, R. G. &amp; Knowles, J. R. 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J. Immunol.  56:130-148 (2002).   Saphire, E. O. et al. Structure of an intact human IgG with potent and broad activity against primary HIV-1 isolates: A template for HIV vaccine design.  Science  293, 1155-1159 (2001).   Sambrook et al. Molecular Cloning: A Laboratory Manual, Second Edition, Cold Spring Harbor, N.Y., (1989).   Sayle et al.  TIBS,  20, 374 (1995).   Snow &amp; Amzel. Calculating three-dimensional changes in protein structure due to amino acid substitutions: the variable region of immunoglobulins”  Protein: Structure, Function and Genetics , Alan R. Liss, Inc 1:267-279 (1986).   Soroka V. et al. Structure and Interactions of NCAM Ig1-2-3 Suggest a Novel Zipper Mechanism for Homophilic Adhesion.  Structure  10, 1291-301 (2003).   Spada, S., Honegger, A. &amp; Plückthun, A. Reproducing the natural evolution of protein structural features with the selectively infective phage (SIP) technology. The kink in the first strand of antibody kappa domains.  J. Mol. Biol.  283, 395-407 (1998).   Sutcliffe, M. J., Haneef, I., Carney, D. &amp; Blundell, T. L.  Protein Engineering,  1, 377-384 (1987).   Ward, E. S. Expression and secretion of T-cell receptor V alpha and V beta domains using  Escherichia coli  as a host. Scand. J. Immunol. 34(2), 215-220 (1991).   Winn, M. D., Isupov, M. N. &amp; Murshudov, G. N. Use of TLS parameters to model anisotropic displacements in macromolecular refinement.  Acta. Crystallog.  57, 122-133 (2001).   Wolfson, H. J., Shatsky, M., Schneidman-Duhovny, D., Dror, O., Shulman-Peleg, A., Ma, B. &amp; Nussinov, R. From structure to function: methods and applications.  Curr. Protein Pept. Sci.,  6(2):171-83 (2005).   Wu, T. T., Johnson, G. &amp; Kabat, E. A. Length distribution of CDRH3 in antibodies.  Proteins  16, 1-7 (1993).   Wulfing, C. &amp; Pluckthun, A. Correctly folded T-cell receptor fragments in the periplasm of  Escherichia coli —Influence of folding catalysts.  J. Mol. Biol.  245(5), 655-669 (1994).   The CCP4 Suite: Programs for Protein Crystallography,  Acta Cryst ., D50, 760-763 (1994).   Xu, D., Xu, Y. &amp; Uberbacher, E. C. Computational tools for protein modeling, Curr. Protein Pept. Sci., 1(1), 1-21 (2000).   

     
       
         
           
               
             
               
                 TABLE 1 
               
             
            
               
                   
               
               
                 Amino acid variation across the 14 
               
               
                 Type 2 V NAR s sequences in FIG. 1 
               
            
           
           
               
               
               
               
            
               
                   
                 12Y-1 
                   
                   
               
               
                   
                 12Y-2 
               
               
                   
                 12A-9 
               
               
                 No 
                 1A-7 
                 Var 
                 Con 
               
               
                   
               
            
           
           
               
               
               
               
            
               
                 1 
                 A 
                 VQGT 
                 AVOGT 
               
               
                 2 
                 WR 
                 L 
                 WRL 
               
               
                 3 
                 V 
                 AT 
                 VAT 
               
               
                 4 
                 D 
                 E 
                 DE 
               
               
                 5 
                 Q 
                 P 
                 QP 
               
               
                 6 
                 T 
                 KP 
                 TKP 
               
               
                 7 
                 P 
                 — 
                 P 
               
               
                 8 
                 R 
                 KTH 
                 RKTH 
               
               
                 9 
                 TIS 
                 P 
                 TISP 
               
               
                 10 
                 AV 
                 E 
                 AVE 
               
               
                 11 
                 T 
                 — 
                 T 
               
               
                 12 
                 K 
                 — 
                 K 
               
               
                 13 
                 E 
                 — 
                 E 
               
               
                 14 
                 T 
                 R 
                 TR 
               
               
                 15 
                 G 
                 — 
                 G 
               
               
                 16 
                 E 
                 G 
                 EG 
               
               
                 17 
                 S 
                 — 
                 S 
               
               
                 18 
                 L 
                 — 
                 L 
               
               
                 19 
                 T 
                 — 
                 T 
               
               
                 20 
                 I 
                 — 
                 I 
               
               
                 21 
                 N 
                 SYH 
                 NSYH 
               
               
                 22 
                 C 
                 — 
                 C 
               
               
                 23 
                 VA 
                 — 
                 VA 
               
               
                 24 
                 L 
                 VI 
                 LVI 
               
               
                 25 
                 RK 
                 — 
                 RK 
               
               
                 26 
                 DN 
                 ES 
                 DNES 
               
               
                 27 
                 AT 
                 S 
                 ATS 
               
            
           
           
               
            
               
                 Variable region 
               
            
           
           
               
               
               
               
            
               
                 34 
                 T 
                 — 
                 T 
               
               
                 35 
                 GND 
                 RYW 
                 GNDRYW 
               
               
                 36 
                 W 
                   
                 W 
               
               
                 37 
                 Y 
                   
                 Y 
               
               
                 38 
                 R 
                 — 
                 R 
               
               
                 39 
                 T 
                 absent 
                 T or absent 
               
               
                 40 
                 KT 
                 R 
                 KTR 
               
               
                 41 
                 L 
                 F 
                 LF 
               
               
                 42 
                 G 
                 DS 
                 GDS 
               
               
                 43 
                 S 
                 — 
                 S 
               
               
                 44 
                 T 
                 — 
                 T 
               
               
                 45 
                 NK 
                 — 
                 NK 
               
               
                 46 
                 E 
                 L 
                 EL 
               
               
                 47 
                 Q 
                 — 
                 Q 
               
               
                 48 
                 TSK 
                 FAH 
                 TSKFAH 
               
               
                 49 
                 I 
                 M 
                 IM 
               
               
                 50 
                 S 
                 TP 
                 STP 
               
               
                 51 
                 I 
                 L 
                 IL 
               
               
                 52 
                 G 
                 — 
                 G 
               
               
                 53 
                 G 
                 — 
                 G 
               
               
                 54 
                 R 
                 — 
                 R 
               
               
                 55 
                 Y 
                 H 
                 YH 
               
               
                 56 
                 VS 
                 L 
                 VSL 
               
               
                 57 
                 E 
                 — 
                 E 
               
               
                 58 
                 T 
                 — 
                 T 
               
               
                 59 
                 V 
                 E 
                 VE 
               
               
                 60 
                 ND 
                 S 
                 NDS 
               
               
                 61 
                 KE 
                 RL 
                 KERL 
               
               
                 62 
                 G 
                 TER 
                 GTER 
               
               
                 63 
                 S 
                 — 
                 S 
               
               
                 64 
                 KN 
                 E 
                 KNE 
               
               
                 65 
                 S 
                 — 
                 S 
               
               
                 66 
                 FA 
                 — 
                 FA 
               
               
                 67 
                 S 
                 — 
                 S 
               
               
                 68 
                 L 
                 — 
                 L 
               
               
                 69 
                 RT 
                 S 
                 RTS 
               
               
                 70 
                 I 
                 — 
                 I 
               
               
                 71 
                 RS 
                 — 
                 RS 
               
               
                 72 
                 D 
                 E 
                 DE 
               
               
                 73 
                 L 
                 — 
                 L 
               
               
                 74 
                 R 
                 S 
                 RS 
               
               
                 75 
                 V 
                 — 
                 V 
               
               
                 76 
                 E 
                 — 
                 E 
               
               
                 77 
                 D 
                 — 
                 D 
               
               
                 78 
                 S 
                 — 
                 S 
               
               
                 79 
                 G 
                 SA 
                 GSA 
               
               
                 80 
                 T 
                 — 
                 T 
               
               
                 81 
                 Y 
                 F 
                 YF 
               
               
                 82 
                 K 
                 QR 
                 KQR 
               
               
                 83 
                 C 
                 — 
                 C 
               
               
                 84 
                 GQK 
                 SH 
                 GQKSH 
               
               
                 85 
                 A 
                 GNV 
                 AGNV 
               
               
                 104 
                 KE 
                 PW 
                 KEPW 
               
               
                 105 
                 G 
                 — 
                 G 
               
               
                 106 
                 A 
                 GFV 
                 AGFV 
               
               
                 107 
                 G 
                 DL 
                 GDL 
               
               
                 108 
                 T 
                 — 
                 T 
               
               
                 109 
                 VA 
                 DLI 
                 VADLI 
               
               
                 110 
                 L 
                 — 
                 L 
               
               
                 111 
                 T 
                 — 
                 T 
               
               
                 112 
                 V 
                 — 
                 V 
               
               
                 113 
                 K 
                 RT 
                 KRT 
               
               
                   
               
               
                 Var: Variant amino acids: These columns show the variation in amino acid residues found in the corresponding positions in the twelve other Type 2 V NAR s sequences in FIG. 1 and in other Type 2 V NARs  reported in Nuttall 2002 and 2003. 
               
               
                 Con: Consensus sequence 
               
            
           
         
       
     
     
       
         
           
               
             
               
                 TABLE 2 
               
             
            
               
                   
               
               
                 Diffraction data and refinement statistics 
               
            
           
           
               
               
               
               
               
               
               
            
               
                   
                 Native 12Y-1 
                 LAH 12Y-1 
                 PHR 12Y-1 
                 Native 12Y-2 
                 Native 12A-9 
                 Native 1A-7 
               
               
                   
                   
               
            
           
           
               
               
               
               
               
               
               
            
               
                 Diffraction data 
                   
                   
                   
                   
                   
                   
               
            
           
           
               
               
               
               
               
               
               
            
               
                 Space Group 
                 I4 1 22 
                 I4 1 22 
                 I4 1 22 
                 I2 1 2 1 2 1   
                 P2 1 2 1 2 
                 I2 1 2 1 2 1   
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 Unit cell (Å) 
                 (a) 
                 97.26 
                 97.97 
                 97.60 
                 65.28 
                 38.27 
                 80.50 
               
               
                   
                 (b) 
                 97.26 
                 97.97 
                 97.60 
                 92.05 
                 68.32 
                 88.66 
               
               
                   
                 (c) 
                 65.23 
                 65.61 
                 65.27 
                 98.22 
                 39.51 
                 101.75 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 Resolution (Å) 
                  69-2.8 
                 20-3.0 
                  20-2.5 
                 67.4-2.18 
                 39.5-2.1 
                 21.6-2.7 
               
               
                 (outer shell) 
                 (2.9-2.8) 
                 (3.11-3.0)   
                 (2.6-2.5) 
                 (2.24-2.18) 
                 (2.15-2.1) 
                 (2.78-2.7) 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 Measured reflections 
                 60022 
                 42615 
                 48364 
                 99606 
                 43653 
                 52866 
               
               
                 Unique reflections 
                 3975 
                 3304 
                 5472 
                 15764 
                 6048 
                 18372 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 Multiplicity 
                 15.1 
                 (4.3) 
                 12.9 
                 (8.3) 
                 8.8 
                 (5.0) 
                 6.6 
                 (6.3) 
                 7.2 
                 (6.3) 
                 2.9 
                 (2.2) 
               
               
                 Completeness (%) 
                 99 
                 (94.3) 
                 97.2 
                 (82.5) 
                 96 
                 (77) 
                 100 
                 (99.4) 
                 98.6 
                 (100) 
                 95.1 
                 (87.9) 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 (outer shell) 
                   
                   
                   
                   
                   
                   
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 I/σ(I) (outer shell) 
                 18.1 
                 (1.8) 
                 18.4 
                 (1.8) 
                 8.6 
                 (1.5) 
                 32.5 
                 (4.0) 
                 15.2 
                 (2.0) 
                 7.6 
                 (1.2) 
               
               
                 χ 2  (outer shell) 
                 1.21 
                 (1.10) 
                 1.74 
                 (1.60) 
                 1.09 
                 (1.40) 
                 1.19 
                 (0.95) 
                 1.03 
                 (0.97) 
                 1.27 
                 (1.03) 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 R merge  (%) 
                 4.5 
                 10.2 
                 10.0 
                 5.4 
                 12.6 
                 14.8 
               
               
                 Refinement 
               
               
                 Resolution range (Å) 
                  6.0-2.82 
                   
                   
                 18.12-2.18 
                 34.2-2.10 
                 21.6-2.7 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
            
               
                 R % (outer shell) 
                 16.6 
                 (33.9) 
                   
                   
                 17.6 
                 (22.5) 
                 21.7 
                 (29.5) 
                 17.6 
                 (32.7) 
               
               
                 R free % (outer shell) 
                 25.4 
                 (54.3) 
                   
                   
                 24.7 
                 (31.1) 
                 28.0 
                 (39.9) 
                 26.5 
                 (32.8) 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 RMS deviations: 
                   
                   
                   
                   
                   
                   
               
               
                 Bond length (Å) 
                 0.0012 
                   
                   
                 0.012 
                 0.012 
                 0.012 
               
               
                 Bond angles (deg.) 
                 1.552 
                   
                   
                 1.484 
                 1.494 
                 1.453 
               
               
                 Average B values (Å 2 ) 
                 40.2 
                   
                   
                 21.3 
                 49.9 
                 43.3 
               
               
                   
               
            
           
         
       
     
     
       
         
           
               
             
               
                 TABLE 3 
               
             
            
               
                   
               
               
                 Number and numbering of amino acid residues in each region 
               
            
           
           
               
               
               
            
               
                 Region 
                 Number of residues 
                 Residue Numbering 
               
               
                   
               
               
                 Loop region 1 
                 1-2 
                 1 to 2 
               
               
                 β-strand region A 
                 5-6 
                     2 to 6-7 
               
               
                 Loop region 2 
                 2-3 
                 6-7 to 8-9 
               
               
                 β-strand region A 
                 5-6 
                  8-9 to 13-14 
               
               
                 Loop region 3 
                 4-5 
                 13-14 to 17-18 
               
               
                 β-strand region B 
                  8-10 
                 17-18 to 26-28 
               
               
                 Loop region 4 
                 5-9 
                 26-28 to 32-34 
               
               
                 β-strand region C 
                 7-9 
                 32-34 to 40-41 
               
               
                 Loop region 5 
                 14-17 
                 40-41 to 54-55 
               
               
                 β-strand region D 
                 6-7 
                 54-55 to 60-61 
               
               
                 Loop region 6 
                 4-5 
                 60-61 to 64-65 
               
               
                 β-strand region E 
                 6-7 
                 64-65 to 70-71 
               
               
                 Loop region 7 
                 8-9 
                 70-71 to 78-79 
               
               
                 β-strand region F 
                 6-8 
                 78-79 to 85-86 
               
               
                 Loop region 8 
                  5-25 
                 85-86 to #     
               
               
                 β-strand region G 
                 10-12 
                   97-98 to 105-120* 
               
               
                   
               
            
           
         
       
     
     
       
         
           
               
             
               
                 TABLE 3A 
               
             
            
               
                   
               
               
                 Number and numbering of amino acid residues in loop region 5 
               
            
           
           
               
               
               
               
            
               
                   
                 Region 
                 Number of residues 
                 Residue Numbering 
               
               
                   
                   
               
               
                   
                 Loop region 5 
                 14-17 
                 40-41 to 54-55 
               
               
                   
                 β-strand region C 
                 . . . 1      
                 . . . 40 
               
               
                   
                 Loop region 5a 
                 6 
                 41-46 
               
               
                   
                 β-strand region C′ 
                 2 
                 47, 48 
               
               
                   
                 Loop region 5b 
                 3 
                 49-51 
               
               
                   
                 β-strand region D′ 
                 1 
                       52 
               
               
                   
                 Loop region 5c 
                 2 
                 53, 54 
               
               
                   
                   
               
            
           
         
       
     
     
       
         
           
               
             
               
                 TABLE 4 
               
             
            
               
                   
               
               
                 Dimer interactions 
               
            
           
           
               
               
            
               
                   
                 Hydrogen bond 
               
               
                   
                 distance (Å) &lt;4 Å 
               
            
           
           
               
               
               
               
               
            
               
                   
                   
                 12Y-2 
                 12Y-2 
                   
               
               
                 Interface* 
                 Hydrogen bonds 
                 A 
                 B 
                 12Y-1 
               
               
                   
               
            
           
           
               
               
               
               
               
            
               
                 D-D s   
                 Main-chain H-bonds: 
                   
                   
                   
               
               
                 strands 
                 Val59(N) - Val59(O) s   
                 2.88 
                 2.93 
                 3.15 
               
               
                   
                 Val59(O) - Val59(N) s   
                 2.88 
                 2.93 
                 3.15 
               
               
                   
                 Side-chain H-bonds: 
               
               
                   
                 Lys61(NZ) - Glu57(OE1) s   
                 2.65 
                   
                 3.16 
               
               
                   
                 Water mediated H-bonds: 
               
               
                   
                 W(20)/W(37) - Lys61(N) 
                 3.37 
                 3.12 
               
               
                   
                 W(20)/W(37) - Gly62(N) 
                 3.09 
                 2.64 
               
               
                   
                 W(20)/W(37) - Glu57(O) s   
                 2.73 
                 2.88 
               
               
                   
                 W(20)/W(37) - Glu57(N) s   
                 2.75 
                 2.92 
               
               
                   
                 W(1)/W(11) - Glu57(OE1) s   
                 2.96 
                 2.66 
               
               
                   
                 W(1)/W(11) - Lys61(N) 
                 2.81 
                 3.00 
               
               
                   
                 W(1)/W(11) - Val59(O) 
                 2.81 
                 3.13 
               
               
                   
                 W(81) - Thr58(OG1) 
                   
                   
                 3.01 
               
               
                   
                 W(81) - Asn60(OD1)) s   
                   
                   
                 3.13 
               
               
                 CDR3- 
                 Main-chain H-bonds: 
               
               
                 CDR3 s   
                 Asn95(N) - Arg101(O) s   
                 3.25 
                 3.05 
               
               
                   
                 Arg101(N) - Asn95(O) s   
                 3.25 
                 3.05 
               
               
                   
                 Ser97(N) - Leu99(O) s   
                 2.9 
                 3.11 
               
               
                   
                 Ser97(O) - Leu99(N) s   
                 3.09 
                 2.74 
               
               
                   
                 Side-chain H-bonds: 
               
               
                   
                 Asn95(OD1) - Arg101(NE) s   
                 2.72 
               
               
                   
                 Tyr94(O) - Arg101(NE) s   
                   
                 2.69 
               
               
                   
                 Tyr94(OH) - Arg101(NH1) s   
                   
                 3.36 
               
               
                 CDR1- 
                 Side-chain H-bonds: 
               
               
                 CDR1 s   
                 Lys32(O) -Asp33(OD1) s   
                 2.42 
                 3.25 
               
               
                   
                 Lys32(O) -Lys61(NZ) s   
                   
                 2.84 
               
               
                   
               
               
                 *Subscript “s” is for a symmetry (2-fold) related molecule. 
               
            
           
         
       
     
     
       
         
           
               
             
               
                 TABLE 5 
               
               
                   
               
               
                 Amino acid sequences of NCAM/IgNAR 
               
               
                 and Telokin/IgNAR chimeras 
               
               
                   
               
             
            
               
                   
               
            
           
           
               
               
            
               
                   
                 NCAM FRAMEWORK 
               
               
                 NCAM 
                 LQVDIVPSQGEISVGESKFFLCQVAGDAKDKDISWFSPNGEKLTPNQQRISVVWNDDSSS 
               
               
                   
                 TLTIYNANIDDAGIYKCVVTGED---------------------GSESEA-TVNVKIFQ 
               
               
                   
               
               
                   
                       NCAM             IgNAR CDR3 grafted            NCAM 
               
               
                 N1A7_1 
                 TLTIYNANIDDAGIYKC------ GAYFSDAMSNYSYPIPGEK -------A-TVNVKIFQ 
               
               
                 N1A7_2 
                 TLTIYNANIDDAGIYKCV------ AYFSDAMSNYSYPIPGE -------SA-TVNVKIFQ 
               
               
                 N1A7_3 
                 TLTIYNANIDDAGIYKCVV------ YFSDAMSNYSYPIPG -------SEA-TVNVKIFQ 
               
               
                 N1A7_4 
                 TLTIYNANIDDAGIYKCVVT------ FSDAMSNYSYPIP -------ESEA-TVNVKIFQ 
               
               
                 N1A7_5 
                 TLTIYNANIDDAGIYKCVVTG------ SDAMSNYSYPI -------SESEA-TVNVKIFQ 
               
               
                   
               
               
                   
                 TELOKIN FRAMEWORK 
               
               
                 TELOKIN 
                 ---PYFSKTIRDLEVVEGSAARFDCKIEGYPDPEVVWFKDDQSIRESRHFQIDYDEDGN 
               
               
                   
                 CSLTISEVCGDDDAKYTCKAVNS---------------------LGEATC-TAELIVE 
               
               
                   
               
               
                   
                       TELOKIN          IgNAR CDR3 grafted          TELOKIN 
               
               
                 T1A7_1 
                 CSLIISDVCGDDDAKYTC----- GAYFSDAMSNYSYPIPGEK -------C-TAELIVE- 
               
               
                 T1A7_2 
                 CSLIISDVCGDDDAKYTCK----- AYFSDAMSNYSYPIPGE -------TC-TAELIVE- 
               
               
                 T1A7_3 
                 CSLIISDVCGDDDAKYTCKA----- YFSDAMSNYSYPIPG -------ATC-TAELIVE- 
               
               
                 T1A7_4 
                 CSLIISDVCGDDDAKYTCKAV----- FSDAMSNYSYPIP -------EATC-TAELIVE- 
               
               
                 T1A7_5 
                 CSLIISDVCGDDDAKYTCKAVN----- SDAMSNYSYPI -------GEATC-TAELIVE- 
               
               
                   
               
            
           
         
       
     
                     TABLE 6                  Comparison of TCR interfaces:                                         TCR Vα   TCR Vα   TCR Vα   TCR Vα                   1AO7   1J8H   1KGC   1KB5   12Y-2   Camelid   Comments               Ser31   Tyr31   Tyr31   Tyr31   Asp33               Phe33   Phe33   His33   Pro33   Gly35       Tyr35   Tyr35   Tyr35   Tyr35   Tyr37   V37F          Gln37   Gln37   Gln37   Gln37   Thr39       Ser42   Gly42   Gly42   Gly42   Asn45   G44E      Deviation¥       Pro43   Leu43   Pro43   Pro43   Glu46   L45R          Leu45   Leu45   Tyr45   Leu45   Ser48   W47G/S          Ser48   Lys48   His48   Ser48   —*       CDR2       Tyr50   Thr50   Leu50   Arg50   —*       CDR2       Ser51   Ser51   Thr51   Ser51   —*       CDR2       Asn52   Ala52   Ser52   Val52   —*       CDR2       Leu89   Phe89   Tyr89   Phe89   Lys82       Thr93   Ser93   Pro93   Arg93   Phe86       Deviation¥       Leu104   Leu104   Leu104   Leu104   Gly102       Deviation¥       Phe106   Phe106   Phe106   Phe106   Lys104               *Residues is TCR CDR2 loop, no equivalent position in IgNAR variable domains.       ¥Deviation between Cα traces of shark and TCR structures.           Camelisation of human domains, difficult to correlate.            
NB: This does not include interface residues incorporated within the highly variable VLR3 loop regions. For example 12Y-2 residue Arg101 would also contribute to covering the hydrophobic interface if modelled onto the TCR domain.
 
     
       
         
           
               
               
               
             
               
                 APPENDIX I(a) 
               
               
                   
               
             
            
               
                 HEADER 
                 IMMUNE SYSTEM 
                 05-APR-04 1VER 
               
            
           
           
               
               
               
            
               
                 TITLE 
                   
                 STRUCTURE OF NEW ANTIGEN RECEPTOR VARIABLE DOMAIN FROM SHARKS 
               
               
                 COMPND 
                   
                 MOL_ID: 1; 
               
               
                 COMPND 
                  2 
                  MOLECULE: NEW ANTIGEN RECEPTOR; 
               
               
                 COMPND 
                  3 
                  CHAIN: A; 
               
               
                 COMPND 
                  4 
                  FRAGMENT: VARIABLE DOMAIN; 
               
               
                 COMPND 
                  5 
                  SYNONYM: VNAR; 
               
               
                 COMPND 
                  6 
                  ENGINEERED: YES 
               
               
                 SOURCE 
                   
                 MOL_ID: 1; 
               
               
                 SOURCE 
                  2 
                  ORGANISM_SCIENTIFIC: ORECTOLOBUS MACULATUS; 
               
               
                 SOURCE 
                  3 
                  ORGANISM_COMMON: SPOTTED WOBBEGONG; 
               
               
                 SOURCE 
                  4 
                  EXPRESSION_SYSTEM: ESCHERICHIA COLI; 
               
               
                 SOURCE 
                  5 
                  EXPRESSION_SYSTEM_COMMON: BACTERIA 
               
               
                 KEYWDS 
                   
                 IG VNAR, NATIVE, 12Y-1 
               
               
                 EXPDTA 
                   
                 X-RAY DIFFRACTION 
               
               
                 AUTHOR 
                   
                 V.A.STRELTSOV 
               
            
           
           
               
               
               
               
            
               
                 JRNL 
                   
                 AUTH 
                 V.A.STRELTSOV,J.N.VARGHESE,P.J.HUDSON,R.A.IRVING, 
               
            
           
           
               
               
               
            
               
                 JRNL 
                   
                 AUTH 2 J.A.CARMICHAEL,S.D.NUTTALL 
               
            
           
           
               
               
               
               
            
               
                 JRNL 
                   
                 TITL 
                 CRYSTAL STRUCTURE OF A SHARK NEW ANTIGEN RECEPTOR 
               
            
           
           
               
               
               
            
               
                 JRNL 
                   
                 TITL 2 (IGNAR) VARIABLE DOMAIN 
               
            
           
           
               
               
               
               
            
               
                 JRNL 
                   
                 REF 
                 TO BE PUBLISHED 
               
            
           
           
               
               
               
            
               
                 JRNL 
                   
                 REFN 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  1 
                   
               
               
                 REMARK 
                  2 
                   
               
               
                 REMARK 
                  2 
                  RESOLUTION. 2.82 ANGSTROMS. 
               
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  PROGRAM 
                 : REFMAC 5.1.24 
               
               
                 REMARK 
                  3 
                  AUTHORS 
                 : MURSHUDOV,VAGIN,DODSON 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 REFINEMENT TARGET : MAXIMUM LIKELIHOOD 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  RESOLUTION RANGE HIGH 
                 (ANGSTROMS) 
                 : 2.82 
               
               
                 REMARK 
                  3 
                  RESOLUTION RANGE LOW 
                 (ANGSTROMS) 
                 : 6.00 
               
               
                 REMARK 
                  3 
                  DATA CUTOFF 
                 (SIGMA(F)) 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  COMPLETENESS FOR RANGE 
                 (%) 
                 : 99.3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  NUMBER OF REFLECTIONS 
                 : 3353 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 FIT TO DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  CROSS-VALIDATION METHOD 
                 : THROUGHOUT 
               
               
                 REMARK 
                  3 
                  FREE R VALUE TEST SET SELECTION 
                 : RANDOM 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  R VALUE 
                 (WORKING + TEST SET) 
                 : 0.170 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  R VALUE 
                 (WORKING SET) 
                 : 0.166 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  FREE R VALUE 
                 : 0.254 
               
               
                 REMARK 
                  3 
                  FREE R VALUE TEST SET SIZE (%) 
                 : 4.400 
               
               
                 REMARK 
                  3 
                  FREE R VALUE TEST SET COUNT 
                 : 153 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 FIT IN THE HIGHEST RESOLUTION BIN. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  TOTAL NUMBER OF BINS USED 
                 : 20 
               
               
                 REMARK 
                  3 
                  BIN RESOLUTION RANGE HIGH 
                 : 2.82 
               
               
                 REMARK 
                  3 
                  BIN RESOLUTION RANGE LOW 
                 : 2.88 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  REFLECTION IN BIN 
                 (WORKING SET) 
                 : 195 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  BIN COMPLETENESS (WORKING+TEST) (%) 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  BIN R VALUE 
                 (WORKING SET) 
                 : 0.3390 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  BIN FREE R VALUE SET COUNT 
                 : 11 
               
               
                 REMARK 
                  3 
                  BIN FREE R VALUE 
                 : 0.5430 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  ALL ATOMS 
                 : 867 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 B VALUES. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 FROM WILSON PLOT 
                 (A**2) 
                 : NULL 
               
               
                 REMARK 
                  3 
                 MEAN B VALUE 
                 (OVERALL, A**2) 
                 : 40.21 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 OVERALL ANISOTROPIC B VALUE. 
               
               
                 REMARK 
                  3 
                  B11 (A**2) : 3.53000 
               
               
                 REMARK 
                  3 
                  B22 (A**2) : 3.53000 
               
               
                 REMARK 
                  3 
                  B33 (A**2) : −7.06000 
               
               
                 REMARK 
                  3 
                  B12 (A**2) : 0.00000 
               
               
                 REMARK 
                  3 
                  B13 (A**2) : 0.00000 
               
               
                 REMARK 
                  3 
                  B23 (A**2) : 0.00000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  ESTIMATED OVERALL COORDINATE ERROR. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 ESU BASED ON R VALUE 
                   (A): 
                 NULL 
               
               
                 REMARK 
                  3 
                 ESU BASED ON FREE R VALUE 
                   (A): 
                 0.370 
               
               
                 REMARK 
                  3 
                 ESU BASED ON MAXIMUM LIKELIHOOD 
                   (A): 
                 0.288 
               
               
                 REMARK 
                  3 
                 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD 
                 (A**2): 
                 16.179 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                 CORRELATION COEFFICIENTS. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                 CORRELATION COEFFICIENT FO-FC 
                 : 0.965 
               
               
                 REMARK 
                  3 
                 CORRELATION COEFFICIENT FO-FC FREE 
                 : 0.911 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  RMS DEVIATIONS FROM IDEAL VALUES 
                 COUNT 
                 RMS 
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 BOND LENGTHS REFINED ATOMS 
                   (A): 
                  780 
                 ; 
                 0.012 
                 ; 
                 0.021 
               
               
                 REMARK 
                  3 
                 BOND LENGTHS OTHERS 
                   (A): 
                  710 
                 ; 
                 0.002 
                 ; 
                 0.020 
               
               
                 REMARK 
                  3 
                 BOND ANGLES REFINED ATOMS 
                 (DEGREES): 
                 1050 
                 ; 
                 1.552 
                 ; 
                 1.955 
               
               
                 REMARK 
                  3 
                 BOND ANGLES OTHERS 
                 (DEGREES): 
                 1648 
                 ; 
                 0.838 
                 ; 
                 3.000 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 1 
                 (DEGREES): 
                  98 
                 ; 
                 8.873 
                 ; 
                 5.000 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 2 
                 (DEGREES): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 3 
                 (DEGREES): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 4 
                 (DEGREES): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 CHIRAL-CENTER RESTRAINTS 
                 (A**3): 
                  121 
                 ; 
                 0.085 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 GENERAL PLANES REFINED ATOMS 
                   (A): 
                  857 
                 ; 
                 0.005 
                 ; 
                 0.020 
               
               
                 REMARK 
                  3 
                 GENERAL PLANES OTHERS 
                   (A): 
                  165 
                 ; 
                 0.001 
                 ; 
                 0.020 
               
               
                 REMARK 
                  3 
                 NON-BONDED CONTACTS REFINED ATOMS 
                   (A): 
                  147 
                 ; 
                 0.220 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 NON-BONDED CONTACTS OTHERS 
                   (A): 
                  841 
                 ; 
                 0.224 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 NON-BONDED TORSION REFINED ATOMS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 NON-BONDED TORSION OTHERS 
                   (A): 
                  558 
                 ; 
                 0.089 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 H-BOND (X...Y) REFINED ATOMS 
                   (A): 
                  32 
                 ; 
                 0.220 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 H-BOND (X...Y) OTHERS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 POTENTIAL METAL-ION REFINED ATOMS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 POTENTIAL METAL-ION OTHERS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 SYMMETRY VDW REFINED ATOMS 
                   (A): 
                  11 
                 ; 
                 0.370 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 SYMMETRY VDW OTHERS 
                   (A): 
                  26 
                 ; 
                 0.364 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 SYMMETRY H-BOND REFINED ATOMS 
                   (A): 
                  11 
                 ; 
                 0.160 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 SYMMETRY H-BOND OTHERS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  ISOTROPIC THERMAL FACTOR RESTRAINTS. 
                 COUNT 
                   
                 RMS 
                   
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 MAIN-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                  488 
                 ; 
                 0.363 
                 ; 
                 1.500 
               
               
                 REMARK 
                  3 
                 MAIN-CHAIN BOND OTHER ATOMS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 MAIN-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                  783 
                 ; 
                 0.690 
                 ; 
                 2.000 
               
               
                 REMARK 
                  3 
                 SIDE-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                  292 
                 ; 
                 1.038 
                 ; 
                 3.000 
               
               
                 REMARK 
                  3 
                 SIDE-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                  267 
                 ; 
                 1.864 
                 ; 
                 4.500 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 ANISOTROPIC THERMAL FACTOR RESTRAINTS. 
                   
                 COUNT 
                   
                 RMS 
                   
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 RIGID-BOND RESTRAINTS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 SPHERICITY; FREE ATOMS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 SPHERICITY; BONDED ATOMS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  NCS RESTRAINTS STATISTICS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 NUMBER OF DIFFERENT NCS GROUPS : 0 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  TLS DETAILS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 NUMBER OF TLS GROUPS : 1 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 TLS GROUP : 1 
               
               
                 REMARK 
                  3 
                  NUMBER OF COMPONENTS GROUP : 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                  3 
                  RESIDUE RANGE: 
                 A 
                  1 
                   
                 A 
                  111 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  ORIGIN FOR THE GROUP (A): 
                 45.6110 
                 36.4110 
                 14.2350 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  T11: 
                  0.0948 
                 T22: 
                  0.2124 
               
               
                 REMARK 
                  3 
                  T33: 
                  0.2758 
                 T12: 
                 −0.1415 
               
               
                 REMARK 
                  3 
                  T13: 
                 −0.1115 
                 T23: 
                  0.1801 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  L11: 
                  3.5582 
                 L22: 
                  7.2854 
               
               
                 REMARK 
                  3 
                  L33: 
                 17.6513 
                 L12: 
                  0.4045 
               
               
                 REMARK 
                  3 
                  L13: 
                 −0.8273 
                 L23: 
                 −0.9129 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  S11: 
                  0.1545 
                 S12: 
                 −0.6840 
                 S13: 
                 −0.0196 
               
               
                 REMARK 
                  3 
                  S21: 
                  0.7097 
                 S22: 
                 −0.6861 
                 S23: 
                 −0.3902 
               
               
                 REMARK 
                  3 
                  S31: 
                 −0.4080 
                 S32: 
                  0.6079 
                 S33: 
                  0.5316 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  BULK SOLVENT MODELLING. 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 METHOD USED : BABINET MODEL WITH MASK 
               
               
                 REMARK 
                  3 
                 PARAMETERS FOR MASK CALCULATION 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                 VDW PROBE RADIUS 
                 : 1.40 
               
               
                 REMARK 
                  3 
                 ION PROBE RADIUS 
                 : 0.80 
               
               
                 REMARK 
                  3 
                 SHRINKAGE RADIUS 
                 : 0.80 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  OTHER REFINEMENT REMARKS: NULL 
               
               
                 REMARK 
                  4 
                   
               
               
                 REMARK 
                  4 
                 1VER COMPLIES WITH FORMAT V. 2.3, 09-JULY-1998 
               
               
                 REMARK 
                 100 
                   
               
               
                 REMARK 
                 100 
                 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 07-APR-2004. 
               
               
                 REMARK 
                 100 
                 THE RCSB ID CODE IS RCSB006537. 
               
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 EXPERIMENTAL DETAILS 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  EXPERIMENT TYPE 
                 : X-RAY DIFFRACTION 
               
               
                 REMARK 
                 200 
                  DATE OF DATA COLLECTION 
                 : OCT-03 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  TEMPERATURE 
                 (KELVIN) 
                 : 113.0 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  PH 
                 : 6.50 
               
               
                 REMARK 
                 200 
                  NUMBER OF CRYSTALS USED 
                 : 1 
               
            
           
           
               
               
            
               
                 REMARK 
                 200 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  SYNCHROTRON 
                 (Y/N) 
                 : N 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  RADIATION SOURCE 
                 : ROTATING ANODE 
               
               
                 REMARK 
                 200 
                  BEAMLINE 
                 : NULL 
               
               
                 REMARK 
                 200 
                  X-RAY GENERATOR MODEL 
                 : RIGAKU HR3 HB 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  MONOCHROMATIC OR LAUE 
                 (M/L) 
                 : M 
               
               
                 REMARK 
                 200 
                  WAVELENGTH OR RANGE 
                 (A) 
                 : 1.5418 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  MONOCHROMATOR 
                 : NI FILTER 
               
               
                 REMARK 
                 200 
                  OPTICS 
                 : AXCO MICROCAPILLARY FOCUSING 
               
               
                 REMARK 
                 200 
                   
                 OPTICS 
               
            
           
           
               
               
            
               
                 REMARK 
                 200 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  DETECTOR TYPE 
                 : IMAGE PLATE 
               
               
                 REMARK 
                 200 
                  DETECTOR MANUFACTURER 
                 : MAR 180 
               
               
                 REMARK 
                 200 
                  INTENSITY-INTEGRATION SOFTWARE 
                 : DENZO 
               
               
                 REMARK 
                 200 
                  DATA SCALING SOFTWARE 
                 : SCALEPACK 
               
            
           
           
               
               
            
               
                 REMARK 
                 200 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  NUMBER OF UNIQUE REFLECTIONS 
                 : 3975 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  RESOLUTION RANGE HIGH 
                 (A) 
                 : 2.820 
               
               
                 REMARK 
                 200 
                  RESOLUTION RANGE LOW 
                 (A) 
                 : 69.010 
               
               
                 REMARK 
                 200 
                  REJECTION CRITERIA 
                 (SIGMA(I)) 
                 : 0.000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 OVERALL. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  COMPLETENESS FOR RANGE 
                 (%) 
                 : 99.0 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  DATA REDUNDANCY 
                 : 15.100 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  R MERGE 
                 (I) 
                 : 0.04500 
               
               
                 REMARK 
                 200 
                  R SYM 
                 (I) 
                 : 0.04500 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  &lt;I/SIGMA(I)&gt; FOR THE DATA SET 
                 : 18.1000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 IN THE HIGHEST RESOLUTION SHELL. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) 
                 : 2.82 
               
               
                 REMARK 
                 200 
                  HIGHEST RESOLUTION SHELL, RANGE LOW (A) 
                 : 2.90 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  COMPLETENESS FOR SHELL 
                 (%) 
                 : 94.3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  DATA REDUNDANCY IN SHELL 
                 : 4.30 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  R MERGE FOR SHELL 
                 (I) 
                 : NULL 
               
               
                 REMARK 
                 200 
                  R SYM FOR SHELL 
                 (I) 
                 : NULL 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  &lt;I/SIGMA(I)&gt; FOR SHELL 
                 : 1.800 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH 
               
               
                 REMARK 
                 200 
                 METHOD USED TO DETERMINE THE STRUCTURE: MIR 
               
               
                 REMARK 
                 200 
                 SOFTWARE USED: SHARP 
               
               
                 REMARK 
                 200 
                 STARTING MODEL: NULL 
               
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 REMARK: NULL 
               
               
                 REMARK 
                 280 
                   
               
               
                 REMARK 
                 280 
                 CRYSTAL 
               
               
                 REMARK 
                 280 
                 SOLVENT CONTENT, VS (%): NULL 
               
               
                 REMARK 
                 280 
                 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): NULL 
               
               
                 REMARK 
                 280 
                   
               
               
                 REMARK 
                 280 
                 CRYSTALLIZATION CONDITIONS: 0.1M BIS-TRIS PROPANE, 45% PPG 
               
               
                 REMARK 
                 280 
                  P400, PH 6.50, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K 
               
               
                 REMARK 
                 290 
                   
               
               
                 REMARK 
                 290 
                 CRYSTALLOGRAPHIC SYMMETRY 
               
               
                 REMARK 
                 290 
                 SYMMETRY OPERATORS FOR SPACE GROUP: I 41 2 2 
               
               
                 REMARK 
                 290 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                  SYMOP 
                 SYMMETRY 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                   NNNMMM 
                 OPERATOR 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                   1555 
                 X,Y,Z 
               
               
                 REMARK 
                 290 
                   2555 
                 1/2−X,1/2−Y,1/2+Z 
               
               
                 REMARK 
                 290 
                   3555 
                 −Y,1/2+X,1/4+Z 
               
               
                 REMARK 
                 290 
                   4555 
                 1/2+Y,−X,3/4+Z 
               
               
                 REMARK 
                 290 
                   5555 
                 1/2−X,Y,3/4−Z 
               
               
                 REMARK 
                 290 
                   6555 
                 X,1/2−Y,1/4−Z 
               
               
                 REMARK 
                 290 
                   7555 
                 1/2+Y,1/2+X,1/2−Z 
               
               
                 REMARK 
                 290 
                   8555 
                 −Y,−X,−Z 
               
               
                 REMARK 
                 290 
                   9555 
                 1/2+X,1/2+Y,1/2+Z 
               
               
                 REMARK 
                 290 
                  10555 
                 1/1−X,1/1−Y,1/1+Z 
               
               
                 REMARK 
                 290 
                  11555 
                 1/2−Y,1/1+X,3/4+Z 
               
               
                 REMARK 
                 290 
                  12555 
                 1/1+Y,1/2−X,5/4+Z 
               
               
                 REMARK 
                 290 
                  13555 
                 1/1−X,1/2+Y,5/4−Z 
               
               
                 REMARK 
                 290 
                  14555 
                 1/2+X,1/1−Y,3/4−Z 
               
               
                 REMARK 
                 290 
                  15555 
                 1/1+Y,1/1+X,1/1−Z 
               
               
                 REMARK 
                 290 
                  16555 
                 1/2−Y,1/2−X,1/2−Z 
               
            
           
           
               
               
            
               
                 REMARK 
                 290 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 290 
                   WHERE 
                 NNN 
                 −&gt; OPERATOR NUMBER 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                 MMM 
                 −&gt; TRANSLATION VECTOR 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 290 
                   
               
               
                 REMARK 
                 290 
                 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS 
               
               
                 REMARK 
                 290 
                 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM 
               
               
                 REMARK 
                 290 
                 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY 
               
               
                 REMARK 
                 290 
                 RELATED MOLECULES. 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 290 
                 SMTRY1 
                  1 
                  1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  1 
                  0.000000 
                  1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  1 
                  0.000000 
                  0.000000 
                  1.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  2 
                 −1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  2 
                  0.000000 
                 −1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  2 
                  0.000000 
                  0.000000 
                  1.000000 
                 32.61400 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  3 
                  0.000000 
                 −1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  3 
                  1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  3 
                  0.000000 
                  0.000000 
                  1.000000 
                 16.30700 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  4 
                  0.000000 
                  1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  4 
                 −1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  4 
                  0.000000 
                  0.000000 
                  1.000000 
                 48.92100 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  5 
                 −1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  5 
                  0.000000 
                  1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  5 
                  0.000000 
                  0.000000 
                 −1.000000 
                 48.92100 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  6 
                  1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  6 
                  0.000000 
                 −1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  6 
                  0.000000 
                  0.000000 
                 −1.000000 
                 16.30700 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  7 
                  0.000000 
                  1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  7 
                  1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  7 
                  0.000000 
                  0.000000 
                 −1.000000 
                 32.61400 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  8 
                  0.000000 
                 −1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  8 
                 −1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  8 
                  0.000000 
                  0.000000 
                 −1.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                  9 
                  1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                  9 
                  0.000000 
                  1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                  9 
                  0.000000 
                  0.000000 
                  1.000000 
                 32.61400 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 10 
                 −1.000000 
                  0.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 10 
                  0.000000 
                 −1.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 10 
                  0.000000 
                  0.000000 
                  1.000000 
                 65.22800 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 11 
                  0.000000 
                 −1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 11 
                  1.000000 
                  0.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 11 
                  0.000000 
                  0.000000 
                  1.000000 
                 48.92100 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 12 
                  0.000000 
                  1.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 12 
                 −1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 12 
                  0.000000 
                  0.000000 
                  1.000000 
                 81.53500 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 13 
                 −1.000000 
                  0.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 13 
                  0.000000 
                  1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 13 
                  0.000000 
                  0.000000 
                 −1.000000 
                 81.53500 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 14 
                  1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 14 
                  0.000000 
                 −1.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 14 
                  0.000000 
                  0.000000 
                 −1.000000 
                 48.92100 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 15 
                  0.000000 
                  1.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 15 
                  1.000000 
                  0.000000 
                  0.000000 
                 97.25900 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 15 
                  0.000000 
                  0.000000 
                 −1.000000 
                 65.22800 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 16 
                  0.000000 
                 −1.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 16 
                 −1.000000 
                  0.000000 
                  0.000000 
                 48.62950 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 16 
                  0.000000 
                  0.000000 
                 −1.000000 
                 32.61400 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 290 
                   
               
               
                 REMARK 
                 290 
                 REMARK: NULL 
               
               
                 REMARK 
                 300 
                   
               
               
                 REMARK 
                 300 
                 BIOMOLECULE: 1 
               
               
                 REMARK 
                 300 
                 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT 
               
               
                 REMARK 
                 300 
                 WHICH CONSISTS OF 1 CHAIN(S). SEE REMARK 350 FOR 
               
               
                 REMARK 
                 300 
                 INFORMATION ON GENERATING THE BIOLOGICAL MOLECULE(S). 
               
               
                 REMARK 
                 350 
                   
               
               
                 REMARK 
                 350 
                 GENERATING THE BIOMOLECULE 
               
               
                 REMARK 
                 350 
                 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN 
               
               
                 REMARK 
                 350 
                 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE 
               
               
                 REMARK 
                 350 
                 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS 
               
               
                 REMARK 
                 350 
                 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND 
               
               
                 REMARK 
                 350 
                 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. 
               
               
                 REMARK 
                 350 
                   
               
               
                 REMARK 
                 350 
                 BIOMOLECULE: 1 
               
               
                 REMARK 
                 350 
                 APPLY THE FOLLOWING TO CHAINS: A 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 350 
                 BIOMT1 
                  1 
                 1.000000 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 REMARK 
                 350 
                 BIOMT2 
                  1 
                 0.000000 
                 1.000000 
                 0.000000 
                 0.00000 
               
               
                 REMARK 
                 350 
                 BIOMT3 
                  1 
                 0.000000 
                 0.000000 
                 1.000000 
                 0.00000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 465 
                   
               
               
                 REMARK 
                 465 
                 MISSING RESIDUES 
               
               
                 REMARK 
                 465 
                 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE 
               
               
                 REMARK 
                 465 
                 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN 
               
               
                 REMARK 
                 465 
                 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) 
               
               
                 REMARK 
                 465 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 465 
                 M RES 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                 465 
                   PHE 
                 A 
                  88 
               
               
                 REMARK 
                 465 
                   TRP 
                 A 
                  89 
               
               
                 REMARK 
                 465 
                   LEU 
                 A 
                  90 
               
               
                 REMARK 
                 465 
                   PRO 
                 A 
                  91 
               
               
                 REMARK 
                 465 
                   TYR 
                 A 
                  92 
               
               
                 REMARK 
                 465 
                   GLY 
                 A 
                  93 
               
               
                 REMARK 
                 465 
                   TYR 
                 A 
                  94 
               
               
                 REMARK 
                 465 
                   GLY 
                 A 
                  95 
               
               
                 REMARK 
                 465 
                   SER 
                 A 
                  96 
               
               
                 REMARK 
                 465 
                   LEU 
                 A 
                  97 
               
               
                 REMARK 
                 465 
                   PRO 
                 A 
                  98 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. 
               
               
                 REMARK 
                 500 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                  ATM1 
                 RES 
                 C 
                 SSEQI 
                 ATM2 
                 RES 
                 C 
                 SSEQI 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                 N 
                 ALA 
                 A 
                 1 
                 O 
                 HOH 
                   
                 54 
                 1.94 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                 SUBTOPIC: CLOSE CONTACTS 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC 
               
               
                 REMARK 
                 500 
                 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 
               
               
                 REMARK 
                 500 
                 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A 
               
               
                 REMARK 
                 500 
                 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 
               
               
                 REMARK 
                 500 
                 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE 
               
               
                 REMARK 
                 500 
                 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 DISTANCE CUTOFF: 
               
               
                 REMARK 
                 500 
                 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS 
               
               
                 REMARK 
                 500 
                 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS 
               
               
                 REMARK 
                 500 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                  ATM1 
                 RES 
                 C 
                 SSEQI 
                 ATM2 
                 RES 
                 C 
                 SSEQI 
                 SSYMOP 
                 DISTANCE 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                 O 
                 ALA 
                 A 
                  1 
                  O 
                 ALA 
                 A 
                  1 
                  8665 
                  2.07 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                 SUBTOPIC: NON-CIS, NON-TRANS 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH 
               
               
                 REMARK 
                 500 
                 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED 
               
               
                 REMARK 
                 500 
                 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/− 30 AND 
               
               
                 REMARK 
                 500 
                 CIS IS DEFINED AS 0 +/− 30 DEGREES. 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                   
                   
                 MODEL 
                 OMEGA 
               
               
                 REMARK 
                 500 
                 SER A 100 
                 GLU A 101 
                   
                 144.45 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 525 
                   
               
               
                 REMARK 
                 525 
                 SOLVENT 
               
               
                 REMARK 
                 525 
                 THE FOLLOWING SOLVENT MOLECULES LIE FARTHER THAN EXPECTED 
               
               
                 REMARK 
                 525 
                 FROM THE PROTEIN OR NUCLEIC ACID MOLECULE AND MAY BE 
               
               
                 REMARK 
                 525 
                 ASSOCIATED WITH A SYMMETRY RELATED MOLECULE (M=MODEL 
               
               
                 REMARK 
                 525 
                 NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE 
               
               
                 REMARK 
                 525 
                 NUMBER; I=INSERTION CODE): 
               
               
                 REMARK 
                 525 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 525 
                  M RES 
                 CSSEQI 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 525 
                 HOH 
                  28 
                 DISTANCE = 
                  5.01 ANGSTROMS 
               
               
                 REMARK 
                 525 
                 HOH 
                  60 
                 DISTANCE = 
                  9.08 ANGSTROMS 
               
               
                 REMARK 
                 525 
                 HOH 
                  75 
                 DISTANCE = 
                  5.80 ANGSTROMS 
               
               
                 REMARK 
                 525 
                 HOH 
                  86 
                 DISTANCE = 
                  9.33 ANGSTROMS 
               
               
                 REMARK 
                 525 
                 HOH 
                  90 
                 DISTANCE = 
                  5.58 ANGSTROMS 
               
               
                 REMARK 
                 525 
                 HOH 
                  92 
                 DISTANCE = 
                  7.18 ANGSTROMS 
               
               
                 REMARK 
                 525 
                 HOH 
                  94 
                 DISTANCE = 
                 11.83 ANGSTROMS 
               
            
           
           
               
               
            
               
                 REMARK 
                 900 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 900 
                 RELATED ENTRIES 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 900 
                 RELATED ID: 1VES 
                 RELATED DB: PDB 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 900 
                 THE SAME PROTEIN (12Y-2) 
               
               
                 REMARK 
                 999 
                   
               
               
                 REMARK 
                 999 
                 SEQUENCE 
               
               
                 REMARK 
                 999 
                 A SEQUENCE DATABASE REFERENCE FOR THIS PROTEIN DOES 
               
               
                 REMARK 
                 999 
                  NOT CURRENTLY EXIST. 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 SEQRES 
                  1 
                 A 
                 111 
                 ALA 
                 TRP 
                 VAL 
                 ASP 
                 GLN 
                 THR 
                 PRO 
                 ARG 
                 THR 
                 ALA 
                 THR 
                 LYS 
                 GLU 
               
               
                 SEQRES 
                  2 
                 A 
                 111 
                 THR 
                 GLY 
                 GLU 
                 SER 
                 LEU 
                 THR 
                 ILE 
                 ASN 
                 CYS 
                 VAL 
                 LEU 
                 ARG 
                 ASP 
               
               
                 SEQRES 
                  3 
                 A 
                 111 
                 ALA 
                 SER 
                 TYR 
                 GLY 
                 LEU 
                 GLU 
                 SER 
                 THR 
                 GLY 
                 TRP 
                 TYR 
                 ARG 
                 THR 
               
               
                 SEQRES 
                  4 
                 A 
                 111 
                 LYS 
                 LEU 
                 GLY 
                 SER 
                 THR 
                 ASN 
                 GLU 
                 GLN 
                 THR 
                 ILE 
                 SER 
                 ILE 
                 GLY 
               
               
                 SEQRES 
                  5 
                 A 
                 111 
                 GLY 
                 ARG 
                 TYR 
                 VAL 
                 GLU 
                 THR 
                 VAL 
                 ASN 
                 LYS 
                 GLY 
                 SER 
                 LYS 
                 SER 
               
               
                 SEQRES 
                  6 
                 A 
                 111 
                 PHE 
                 SER 
                 LEU 
                 ARG 
                 ILE 
                 ARG 
                 ASP 
                 LEU 
                 ARG 
                 VAL 
                 GLU 
                 ASP 
                 SER 
               
               
                 SEQRES 
                  7 
                 A 
                 111 
                 GLY 
                 THR 
                 TYR 
                 LYS 
                 CYS 
                 GLY 
                 ALA 
                 PHE 
                 ARG 
                 PHE 
                 TRP 
                 LEU 
                 PRO 
               
               
                 SEQRES 
                  8 
                 A 
                 111 
                 TYR 
                 GLY 
                 TYR 
                 GLY 
                 SER 
                 LEU 
                 PRO 
                 LEU 
                 SER 
                 GLU 
                 LYS 
                 GLY 
                 ALA 
               
               
                 SEQRES 
                  9 
                 A 
                 111 
                 GLY 
                 THR 
                 VAL 
                 LEU 
                 THR 
                 VAL 
                 LYS 
               
            
           
           
               
               
               
               
            
               
                 FORMUL 
                  2 
                  HOH 
                 *97(H2 O1) 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 HELIX 
                  1 
                 1 
                 ARG A 
                   
                   
                 74 
                 SER A 
                   
                  78 
                  5 
                   
                   
                   
                   
                   
                   
                   
                   5 
               
               
                 SHEET 
                  1 
                 A 
                 4 
                 TRP 
                 A 
                  2 
                  THR 
                 A 
                  6 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 A 
                 4 
                 LEU 
                 A 
                  18 
                  ARG 
                 A 
                  25 
                 −1 
                 O 
                 ARG 
                 A 
                  25 
                 N 
                 TRP 
                 A 
                  2 
               
               
                 SHEET 
                  3 
                 A 
                 4 
                 SER 
                 A 
                  65 
                  ILE 
                 A 
                  70 
                 −1 
                 O 
                 ILE 
                 A 
                  70 
                 N 
                 LEU 
                 A 
                  18 
               
               
                 SHEET 
                  4 
                 A 
                 4 
                 TYR 
                 A 
                  55 
                  ASN 
                 A 
                  60 
                 −1 
                 N 
                 ASN 
                 A 
                  60 
                 O 
                 SER 
                 A 
                  65 
               
               
                 SHEET 
                  1 
                 B 
                 5 
                 THR 
                 A 
                  9 
                  ALA 
                 A 
                  10 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 B 
                 5 
                 THR 
                 A 
                 106 
                  LEU 
                 A 
                 108 
                  1 
                 O 
                 VAL 
                 A 
                 107 
                 N 
                 ALA 
                 A 
                  10 
               
               
                 SHEET 
                  3 
                 B 
                 5 
                 GLY 
                 A 
                  79 
                  ALA 
                 A 
                  85 
                 −1 
                 N 
                 GLY 
                 A 
                  79 
                 O 
                 LEU 
                 A 
                 108 
               
               
                 SHEET 
                  4 
                 B 
                 5 
                 THR 
                 A 
                  34 
                  ARG 
                 A 
                  38 
                 −1 
                 N 
                 TYR 
                 A 
                  37 
                 O 
                 LYS 
                 A 
                  82 
               
               
                 SHEET 
                  5 
                 B 
                 5 
                 GLN 
                 A 
                  47 
                  THR 
                 A 
                  48 
                 −1 
                 O 
                 GLN 
                 A 
                  47 
                 N 
                 ARG 
                 A 
                  38 
               
               
                 SHEET 
                  1 
                 C 
                 4 
                 THR 
                 A 
                  9 
                  ALA 
                 A 
                  10 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 C 
                 4 
                 THR 
                 A 
                 106 
                  LEU 
                 A 
                 108 
                  1 
                 O 
                 VAL 
                 A 
                 107 
                 N 
                 ALA 
                 A 
                  10 
               
               
                 SHEET 
                  3 
                 C 
                 4 
                 GLY 
                 A 
                  79 
                  ALA 
                 A 
                  85 
                 −1 
                 N 
                 GLY 
                 A 
                  79 
                 O 
                 LEU 
                 A 
                 108 
               
               
                 SHEET 
                  4 
                 C 
                 4 
                 GLU 
                 A 
                 101 
                  LYS 
                 A 
                 102 
                 −1 
                 O 
                 GLU 
                 A 
                 101 
                 N 
                 ALA 
                 A 
                  85 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
            
               
                 SSBOND 
                  1 
                 CYS 
                 A 
                 22 
                 CYS 
                 A 
                 83 
                   
                   
               
               
                 CISPEP 
                  1 
                 THR 
                 A 
                  6 
                 PRO 
                 A 
                  7 
                 0 
                 −3.12 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
            
               
                 CRYST1 
                  97.259 
                 97.259 
                 65.228 
                 90.00 
                 90.00 
                 90.00 
                 I 41 
                 2 2 
                 16 
               
            
           
           
               
               
               
               
               
            
               
                 ORIGX1 
                  1.000000 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 ORIGX2 
                  0.000000 
                 1.000000 
                 0.000000 
                 0.00000 
               
               
                 ORIGX3 
                  0.000000 
                 0.000000 
                 1.000000 
                 0.00000 
               
               
                 SCALE1 
                  0.010282 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 SCALE2 
                  0.000000 
                 0.010282 
                 0.000000 
                 0.00000 
               
               
                 SCALE3 
                  0.000000 
                 0.000000 
                 0.015331 
                 0.00000 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 ATOM 
                 1 
                 N 
                 ALA 
                 A 
                 1 
                 55.513 
                 40.915 
                 −1.352 
                 1.00 
                 39.81 
                 N 
               
               
                 ATOM 
                 2 
                 CA 
                 ALA 
                 A 
                 1 
                 54.244 
                 40.231 
                 −0.986 
                 1.00 
                 39.92 
                 C 
               
               
                 ATOM 
                 3 
                 C 
                 ALA 
                 A 
                 1 
                 53.526 
                 40.997 
                 0.141 
                 1.00 
                 40.10 
                 C 
               
               
                 ATOM 
                 4 
                 O 
                 ALA 
                 A 
                 1 
                 53.961 
                 42.071 
                 0.568 
                 1.00 
                 39.99 
                 O 
               
               
                 ATOM 
                 5 
                 CB 
                 ALA 
                 A 
                 1 
                 54.548 
                 38.792 
                 −0.565 
                 1.00 
                 39.81 
                 C 
               
               
                 ATOM 
                 6 
                 N 
                 TRP 
                 A 
                 2 
                 52.424 
                 40.457 
                 0.635 
                 1.00 
                 40.03 
                 N 
               
               
                 ATOM 
                 7 
                 CA 
                 TRP 
                 A 
                 2 
                 51.839 
                 41.010 
                 1.842 
                 1.00 
                 40.13 
                 C 
               
               
                 ATOM 
                 8 
                 C 
                 TRP 
                 A 
                 2 
                 50.807 
                 40.092 
                 2.398 
                 1.00 
                 40.02 
                 C 
               
               
                 ATOM 
                 9 
                 O 
                 TRP 
                 A 
                 2 
                 50.312 
                 39.214 
                 1.691 
                 1.00 
                 39.96 
                 O 
               
               
                 ATOM 
                 10 
                 CB 
                 TRP 
                 A 
                 2 
                 51.215 
                 42.378 
                 1.578 
                 1.00 
                 40.30 
                 C 
               
               
                 ATOM 
                 11 
                 CG 
                 TRP 
                 A 
                 2 
                 50.173 
                 42.417 
                 0.480 
                 1.00 
                 41.25 
                 C 
               
               
                 ATOM 
                 12 
                 CD1 
                 TRP 
                 A 
                 2 
                 50.368 
                 42.203 
                 −0.853 
                 1.00 
                 41.78 
                 C 
               
               
                 ATOM 
                 13 
                 CD2 
                 TRP 
                 A 
                 2 
                 48.787 
                 42.751 
                 0.629 
                 1.00 
                 41.72 
                 C 
               
               
                 ATOM 
                 14 
                 NE1 
                 TRP 
                 A 
                 2 
                 49.188 
                 42.376 
                 −1.533 
                 1.00 
                 41.43 
                 N 
               
               
                 ATOM 
                 15 
                 CE2 
                 TRP 
                 A 
                 2 
                 48.206 
                 42.712 
                 −0.641 
                 1.00 
                 41.13 
                 C 
               
               
                 ATOM 
                 16 
                 CE3 
                 TRP 
                 A 
                 2 
                 47.977 
                 43.089 
                 1.723 
                 1.00 
                 43.91 
                 C 
               
               
                 ATOM 
                 17 
                 CZ2 
                 TRP 
                 A 
                 2 
                 46.867 
                 42.980 
                 −0.851 
                 1.00 
                 42.60 
                 C 
               
               
                 ATOM 
                 18 
                 CZ3 
                 TRP 
                 A 
                 2 
                 46.637 
                 43.363 
                 1.506 
                 1.00 
                 43.85 
                 C 
               
               
                 ATOM 
                 19 
                 CH2 
                 TRP 
                 A 
                 2 
                 46.100 
                 43.300 
                 0.233 
                 1.00 
                 43.32 
                 C 
               
               
                 ATOM 
                 20 
                 N 
                 VAL 
                 A 
                 3 
                 50.489 
                 40.299 
                 3.675 
                 1.00 
                 39.97 
                 N 
               
               
                 ATOM 
                 21 
                 CA 
                 VAL 
                 A 
                 3 
                 49.447 
                 39.528 
                 4.356 
                 1.00 
                 39.89 
                 C 
               
               
                 ATOM 
                 22 
                 C 
                 VAL 
                 A 
                 3 
                 48.257 
                 40.456 
                 4.600 
                 1.00 
                 40.16 
                 C 
               
               
                 ATOM 
                 23 
                 O 
                 VAL 
                 A 
                 3 
                 48.404 
                 41.631 
                 4.929 
                 1.00 
                 40.00 
                 O 
               
               
                 ATOM 
                 24 
                 CB 
                 VAL 
                 A 
                 3 
                 49.958 
                 38.817 
                 5.658 
                 1.00 
                 39.49 
                 C 
               
               
                 ATOM 
                 25 
                 CG1 
                 VAL 
                 A 
                 3 
                 48.829 
                 38.221 
                 6.441 
                 1.00 
                 39.82 
                 C 
               
               
                 ATOM 
                 26 
                 CG2 
                 VAL 
                 A 
                 3 
                 50.923 
                 37.704 
                 5.310 
                 1.00 
                 38.65 
                 C 
               
               
                 ATOM 
                 27 
                 N 
                 ASP 
                 A 
                 4 
                 47.075 
                 39.886 
                 4.397 
                 1.00 
                 40.79 
                 N 
               
               
                 ATOM 
                 28 
                 CA 
                 ASP 
                 A 
                 4 
                 45.818 
                 40.616 
                 4.341 
                 1.00 
                 40.59 
                 C 
               
               
                 ATOM 
                 29 
                 C 
                 ASP 
                 A 
                 4 
                 45.024 
                 40.126 
                 5.538 
                 1.00 
                 40.13 
                 C 
               
               
                 ATOM 
                 30 
                 O 
                 ASP 
                 A 
                 4 
                 44.435 
                 39.061 
                 5.532 
                 1.00 
                 38.36 
                 O 
               
               
                 ATOM 
                 31 
                 CB 
                 ASP 
                 A 
                 4 
                 45.110 
                 40.349 
                 2.990 
                 1.00 
                 40.76 
                 C 
               
               
                 ATOM 
                 32 
                 CG 
                 ASP 
                 A 
                 4 
                 44.054 
                 41.400 
                 2.640 
                 1.00 
                 40.56 
                 C 
               
               
                 ATOM 
                 33 
                 OD1 
                 ASP 
                 A 
                 4 
                 43.544 
                 41.358 
                 1.487 
                 1.00 
                 37.98 
                 O 
               
               
                 ATOM 
                 34 
                 OD2 
                 ASP 
                 A 
                 4 
                 43.664 
                 42.283 
                 3.449 
                 1.00 
                 39.55 
                 O 
               
               
                 ATOM 
                 35 
                 N 
                 GLN 
                 A 
                 5 
                 45.083 
                 40.921 
                 6.591 
                 1.00 
                 40.81 
                 N 
               
               
                 ATOM 
                 36 
                 CA 
                 GLN 
                 A 
                 5 
                 44.451 
                 40.587 
                 7.845 
                 1.00 
                 41.30 
                 C 
               
               
                 ATOM 
                 37 
                 C 
                 GLN 
                 A 
                 5 
                 43.186 
                 41.395 
                 8.027 
                 1.00 
                 41.46 
                 C 
               
               
                 ATOM 
                 38 
                 O 
                 GLN 
                 A 
                 5 
                 43.123 
                 42.577 
                 7.702 
                 1.00 
                 41.23 
                 O 
               
               
                 ATOM 
                 39 
                 CB 
                 GLN 
                 A 
                 5 
                 45.400 
                 40.847 
                 9.003 
                 1.00 
                 41.37 
                 C 
               
               
                 ATOM 
                 40 
                 CG 
                 GLN 
                 A 
                 5 
                 44.887 
                 40.277 
                 10.299 
                 1.00 
                 42.10 
                 C 
               
               
                 ATOM 
                 41 
                 CD 
                 GLN 
                 A 
                 5 
                 45.861 
                 40.424 
                 11.402 
                 1.00 
                 42.51 
                 C 
               
               
                 ATOM 
                 42 
                 OE1 
                 GLN 
                 A 
                 5 
                 47.069 
                 40.451 
                 11.166 
                 1.00 
                 44.78 
                 O 
               
               
                 ATOM 
                 43 
                 NE2 
                 GLN 
                 A 
                 5 
                 45.352 
                 40.534 
                 12.624 
                 1.00 
                 41.68 
                 N 
               
               
                 ATOM 
                 44 
                 N 
                 THR 
                 A 
                 6 
                 42.214 
                 40.738 
                 8.641 
                 1.00 
                 42.08 
                 N 
               
               
                 ATOM 
                 45 
                 CA 
                 THR 
                 A 
                 6 
                 40.819 
                 41.137 
                 8.591 
                 1.00 
                 42.22 
                 C 
               
               
                 ATOM 
                 46 
                 C 
                 THR 
                 A 
                 6 
                 40.083 
                 40.525 
                 9.824 
                 1.00 
                 42.57 
                 C 
               
               
                 ATOM 
                 47 
                 O 
                 THR 
                 A 
                 6 
                 40.242 
                 39.345 
                 10.099 
                 1.00 
                 43.00 
                 O 
               
               
                 ATOM 
                 48 
                 CB 
                 THR 
                 A 
                 6 
                 40.290 
                 40.612 
                 7.239 
                 1.00 
                 41.88 
                 C 
               
               
                 ATOM 
                 49 
                 OG1 
                 THR 
                 A 
                 6 
                 39.946 
                 41.711 
                 6.391 
                 1.00 
                 41.95 
                 O 
               
               
                 ATOM 
                 50 
                 CG2 
                 THR 
                 A 
                 6 
                 39.025 
                 39.834 
                 7.380 
                 1.00 
                 42.09 
                 C 
               
               
                 ATOM 
                 51 
                 N 
                 PRO 
                 A 
                 7 
                 39.344 
                 41.292 
                 10.619 
                 1.00 
                 42.73 
                 N 
               
               
                 ATOM 
                 52 
                 CA 
                 PRO 
                 A 
                 7 
                 39.187 
                 42.740 
                 10.490 
                 1.00 
                 42.90 
                 C 
               
               
                 ATOM 
                 53 
                 C 
                 PRO 
                 A 
                 7 
                 40.330 
                 43.531 
                 11.124 
                 1.00 
                 42.96 
                 C 
               
               
                 ATOM 
                 54 
                 O 
                 PRO 
                 A 
                 7 
                 41.152 
                 42.995 
                 11.849 
                 1.00 
                 42.51 
                 O 
               
               
                 ATOM 
                 55 
                 CB 
                 PRO 
                 A 
                 7 
                 37.880 
                 43.001 
                 11.256 
                 1.00 
                 42.96 
                 C 
               
               
                 ATOM 
                 56 
                 CG 
                 PRO 
                 A 
                 7 
                 37.869 
                 41.963 
                 12.343 
                 1.00 
                 42.75 
                 C 
               
               
                 ATOM 
                 57 
                 CD 
                 PRO 
                 A 
                 7 
                 38.595 
                 40.759 
                 11.773 
                 1.00 
                 42.62 
                 C 
               
               
                 ATOM 
                 58 
                 N 
                 ARG 
                 A 
                 8 
                 40.342 
                 44.827 
                 10.863 
                 1.00 
                 43.73 
                 N 
               
               
                 ATOM 
                 59 
                 CA 
                 ARG 
                 A 
                 8 
                 41.356 
                 45.709 
                 11.405 
                 1.00 
                 44.66 
                 C 
               
               
                 ATOM 
                 60 
                 C 
                 ARG 
                 A 
                 8 
                 40.985 
                 46.138 
                 12.829 
                 1.00 
                 44.54 
                 C 
               
               
                 ATOM 
                 61 
                 O 
                 ARG 
                 A 
                 8 
                 41.804 
                 46.687 
                 13.565 
                 1.00 
                 44.09 
                 O 
               
               
                 ATOM 
                 62 
                 CB 
                 ARG 
                 A 
                 8 
                 41.542 
                 46.920 
                 10.471 
                 1.00 
                 45.24 
                 C 
               
               
                 ATOM 
                 63 
                 CG 
                 ARG 
                 A 
                 8 
                 42.962 
                 47.049 
                 9.838 
                 1.00 
                 47.41 
                 C 
               
               
                 ATOM 
                 64 
                 CD 
                 ARG 
                 A 
                 8 
                 43.159 
                 46.295 
                 8.519 
                 1.00 
                 49.70 
                 C 
               
               
                 ATOM 
                 65 
                 NE 
                 ARG 
                 A 
                 8 
                 43.473 
                 47.198 
                 7.407 
                 1.00 
                 52.43 
                 N 
               
               
                 ATOM 
                 66 
                 CZ 
                 ARG 
                 A 
                 8 
                 43.429 
                 46.856 
                 6.105 
                 1.00 
                 54.91 
                 C 
               
               
                 ATOM 
                 67 
                 NH1 
                 ARG 
                 A 
                 8 
                 43.082 
                 45.621 
                 5.715 
                 1.00 
                 54.18 
                 N 
               
               
                 ATOM 
                 68 
                 NH2 
                 ARG 
                 A 
                 8 
                 43.739 
                 47.765 
                 5.175 
                 1.00 
                 55.49 
                 N 
               
               
                 ATOM 
                 69 
                 N 
                 THR 
                 A 
                 9 
                 39.736 
                 45.876 
                 13.195 
                 1.00 
                 45.02 
                 N 
               
               
                 ATOM 
                 70 
                 CA 
                 THR 
                 A 
                 9 
                 39.191 
                 46.199 
                 14.512 
                 1.00 
                 45.42 
                 C 
               
               
                 ATOM 
                 71 
                 C 
                 THR 
                 A 
                 9 
                 38.029 
                 45.259 
                 14.826 
                 1.00 
                 45.80 
                 C 
               
               
                 ATOM 
                 72 
                 O 
                 THR 
                 A 
                 9 
                 37.109 
                 45.112 
                 14.013 
                 1.00 
                 46.14 
                 O 
               
               
                 ATOM 
                 73 
                 CB 
                 THR 
                 A 
                 9 
                 38.648 
                 47.646 
                 14.554 
                 1.00 
                 45.22 
                 C 
               
               
                 ATOM 
                 74 
                 OG1 
                 THR 
                 A 
                 9 
                 38.000 
                 47.954 
                 13.311 
                 1.00 
                 45.04 
                 O 
               
               
                 ATOM 
                 75 
                 CG2 
                 THR 
                 A 
                 9 
                 39.777 
                 48.670 
                 14.677 
                 1.00 
                 45.18 
                 C 
               
               
                 ATOM 
                 76 
                 N 
                 ALA 
                 A 
                 10 
                 38.057 
                 44.646 
                 16.007 
                 1.00 
                 45.93 
                 N 
               
               
                 ATOM 
                 77 
                 CA 
                 ALA 
                 A 
                 10 
                 36.911 
                 43.887 
                 16.487 
                 1.00 
                 45.99 
                 C 
               
               
                 ATOM 
                 78 
                 C 
                 ALA 
                 A 
                 10 
                 36.711 
                 44.153 
                 17.968 
                 1.00 
                 46.02 
                 C 
               
               
                 ATOM 
                 79 
                 O 
                 ALA 
                 A 
                 10 
                 37.496 
                 43.675 
                 18.785 
                 1.00 
                 46.26 
                 O 
               
               
                 ATOM 
                 80 
                 CB 
                 ALA 
                 A 
                 10 
                 37.100 
                 42.385 
                 16.221 
                 1.00 
                 45.95 
                 C 
               
               
                 ATOM 
                 81 
                 N 
                 THR 
                 A 
                 11 
                 35.679 
                 44.937 
                 18.302 
                 1.00 
                 45.89 
                 N 
               
               
                 ATOM 
                 82 
                 CA 
                 THR 
                 A 
                 11 
                 35.211 
                 45.069 
                 19.687 
                 1.00 
                 45.55 
                 C 
               
               
                 ATOM 
                 83 
                 C 
                 THR 
                 A 
                 11 
                 34.095 
                 44.051 
                 19.970 
                 1.00 
                 45.47 
                 C 
               
               
                 ATOM 
                 84 
                 O 
                 THR 
                 A 
                 11 
                 32.901 
                 44.352 
                 19.936 
                 1.00 
                 45.09 
                 O 
               
               
                 ATOM 
                 85 
                 CB 
                 THR 
                 A 
                 11 
                 34.806 
                 46.535 
                 20.052 
                 1.00 
                 45.51 
                 C 
               
               
                 ATOM 
                 86 
                 OG1 
                 THR 
                 A 
                 11 
                 34.375 
                 46.597 
                 21.420 
                 1.00 
                 44.83 
                 O 
               
               
                 ATOM 
                 87 
                 CG2 
                 THR 
                 A 
                 11 
                 33.601 
                 47.035 
                 19.257 
                 1.00 
                 45.59 
                 C 
               
               
                 ATOM 
                 88 
                 N 
                 LYS 
                 A 
                 12 
                 34.536 
                 42.821 
                 20.219 
                 1.00 
                 45.62 
                 N 
               
               
                 ATOM 
                 89 
                 CA 
                 LYS 
                 A 
                 12 
                 33.681 
                 41.730 
                 20.660 
                 1.00 
                 45.76 
                 C 
               
               
                 ATOM 
                 90 
                 C 
                 LYS 
                 A 
                 12 
                 33.400 
                 41.907 
                 22.149 
                 1.00 
                 45.70 
                 C 
               
               
                 ATOM 
                 91 
                 O 
                 LYS 
                 A 
                 12 
                 33.885 
                 42.864 
                 22.765 
                 1.00 
                 45.63 
                 O 
               
               
                 ATOM 
                 92 
                 CB 
                 LYS 
                 A 
                 12 
                 34.386 
                 40.390 
                 20.416 
                 1.00 
                 45.92 
                 C 
               
               
                 ATOM 
                 93 
                 CG 
                 LYS 
                 A 
                 12 
                 34.484 
                 39.985 
                 18.949 
                 1.00 
                 46.82 
                 C 
               
               
                 ATOM 
                 94 
                 CD 
                 LYS 
                 A 
                 12 
                 33.149 
                 39.399 
                 18.453 
                 1.00 
                 47.89 
                 C 
               
               
                 ATOM 
                 95 
                 CE 
                 LYS 
                 A 
                 12 
                 33.151 
                 39.145 
                 16.934 
                 1.00 
                 48.84 
                 C 
               
               
                 ATOM 
                 96 
                 NZ 
                 LYS 
                 A 
                 12 
                 31.796 
                 39.348 
                 16.320 
                 1.00 
                 48.93 
                 N 
               
               
                 ATOM 
                 97 
                 N 
                 GLU 
                 A 
                 13 
                 32.612 
                 41.002 
                 22.731 
                 1.00 
                 45.55 
                 N 
               
               
                 ATOM 
                 98 
                 CA 
                 GLU 
                 A 
                 13 
                 32.409 
                 41.008 
                 24.181 
                 1.00 
                 45.41 
                 C 
               
               
                 ATOM 
                 99 
                 C 
                 GLU 
                 A 
                 13 
                 32.642 
                 39.635 
                 24.805 
                 1.00 
                 45.16 
                 C 
               
               
                 ATOM 
                 100 
                 O 
                 GLU 
                 A 
                 13 
                 32.848 
                 38.657 
                 24.088 
                 1.00 
                 45.05 
                 O 
               
               
                 ATOM 
                 101 
                 CB 
                 GLU 
                 A 
                 13 
                 31.046 
                 41.606 
                 24.567 
                 1.00 
                 45.43 
                 C 
               
               
                 ATOM 
                 102 
                 CG 
                 GLU 
                 A 
                 13 
                 29.861 
                 41.148 
                 23.742 
                 1.00 
                 45.72 
                 C 
               
               
                 ATOM 
                 103 
                 CD 
                 GLU 
                 A 
                 13 
                 28.564 
                 41.822 
                 24.170 
                 1.00 
                 46.47 
                 C 
               
               
                 ATOM 
                 104 
                 OE1 
                 GLU 
                 A 
                 13 
                 28.600 
                 42.702 
                 25.066 
                 1.00 
                 46.24 
                 O 
               
               
                 ATOM 
                 105 
                 OE2 
                 GLU 
                 A 
                 13 
                 27.500 
                 41.468 
                 23.610 
                 1.00 
                 46.90 
                 O 
               
               
                 ATOM 
                 106 
                 N 
                 THR 
                 A 
                 14 
                 32.644 
                 39.593 
                 26.140 
                 1.00 
                 44.90 
                 N 
               
               
                 ATOM 
                 107 
                 CA 
                 THR 
                 A 
                 14 
                 33.083 
                 38.428 
                 26.911 
                 1.00 
                 44.71 
                 C 
               
               
                 ATOM 
                 108 
                 C 
                 THR 
                 A 
                 14 
                 32.125 
                 37.269 
                 26.709 
                 1.00 
                 44.50 
                 C 
               
               
                 ATOM 
                 109 
                 O 
                 THR 
                 A 
                 14 
                 30.911 
                 37.449 
                 26.735 
                 1.00 
                 44.21 
                 O 
               
               
                 ATOM 
                 110 
                 CB 
                 THR 
                 A 
                 14 
                 33.238 
                 38.792 
                 28.435 
                 1.00 
                 44.82 
                 C 
               
               
                 ATOM 
                 111 
                 OG1 
                 THR 
                 A 
                 14 
                 34.553 
                 39.314 
                 28.685 
                 1.00 
                 44.93 
                 O 
               
               
                 ATOM 
                 112 
                 CG2 
                 THR 
                 A 
                 14 
                 33.164 
                 37.561 
                 29.361 
                 1.00 
                 44.75 
                 C 
               
               
                 ATOM 
                 113 
                 N 
                 GLY 
                 A 
                 15 
                 32.694 
                 36.085 
                 26.496 
                 1.00 
                 44.50 
                 N 
               
               
                 ATOM 
                 114 
                 CA 
                 GLY 
                 A 
                 15 
                 31.931 
                 34.889 
                 26.197 
                 1.00 
                 44.65 
                 C 
               
               
                 ATOM 
                 115 
                 C 
                 GLY 
                 A 
                 15 
                 31.896 
                 34.603 
                 24.710 
                 1.00 
                 44.80 
                 C 
               
               
                 ATOM 
                 116 
                 O 
                 GLY 
                 A 
                 15 
                 31.830 
                 33.436 
                 24.318 
                 1.00 
                 44.91 
                 O 
               
               
                 ATOM 
                 117 
                 N 
                 GLU 
                 A 
                 16 
                 31.938 
                 35.667 
                 23.896 
                 1.00 
                 44.95 
                 N 
               
               
                 ATOM 
                 118 
                 CA 
                 GLU 
                 A 
                 16 
                 31.877 
                 35.577 
                 22.428 
                 1.00 
                 44.98 
                 C 
               
               
                 ATOM 
                 119 
                 C 
                 GLU 
                 A 
                 16 
                 33.187 
                 35.043 
                 21.885 
                 1.00 
                 44.72 
                 C 
               
               
                 ATOM 
                 120 
                 O 
                 GLU 
                 A 
                 16 
                 34.108 
                 34.803 
                 22.648 
                 1.00 
                 44.90 
                 O 
               
               
                 ATOM 
                 121 
                 CB 
                 GLU 
                 A 
                 16 
                 31.594 
                 36.948 
                 21.789 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 122 
                 CG 
                 GLU 
                 A 
                 16 
                 30.329 
                 37.640 
                 22.280 
                 1.00 
                 45.66 
                 C 
               
               
                 ATOM 
                 123 
                 CD 
                 GLU 
                 A 
                 16 
                 29.871 
                 38.772 
                 21.368 
                 1.00 
                 46.88 
                 C 
               
               
                 ATOM 
                 124 
                 OE1 
                 GLU 
                 A 
                 16 
                 28.712 
                 39.223 
                 21.498 
                 1.00 
                 47.16 
                 O 
               
               
                 ATOM 
                 125 
                 OE2 
                 GLU 
                 A 
                 16 
                 30.668 
                 39.221 
                 20.518 
                 1.00 
                 48.78 
                 O 
               
               
                 ATOM 
                 126 
                 N 
                 SER 
                 A 
                 17 
                 33.267 
                 34.847 
                 20.572 
                 1.00 
                 44.36 
                 N 
               
               
                 ATOM 
                 127 
                 CA 
                 SER 
                 A 
                 17 
                 34.525 
                 34.452 
                 19.945 
                 1.00 
                 44.22 
                 C 
               
               
                 ATOM 
                 128 
                 C 
                 SER 
                 A 
                 17 
                 34.950 
                 35.435 
                 18.848 
                 1.00 
                 43.95 
                 C 
               
               
                 ATOM 
                 129 
                 O 
                 SER 
                 A 
                 17 
                 34.197 
                 36.323 
                 18.477 
                 1.00 
                 43.90 
                 O 
               
               
                 ATOM 
                 130 
                 CB 
                 SER 
                 A 
                 17 
                 34.430 
                 33.018 
                 19.417 
                 1.00 
                 44.27 
                 C 
               
               
                 ATOM 
                 131 
                 OG 
                 SER 
                 A 
                 17 
                 33.581 
                 32.935 
                 18.296 
                 1.00 
                 44.57 
                 O 
               
               
                 ATOM 
                 132 
                 N 
                 LEU 
                 A 
                 18 
                 36.173 
                 35.281 
                 18.361 
                 1.00 
                 43.92 
                 N 
               
               
                 ATOM 
                 133 
                 CA 
                 LEU 
                 A 
                 18 
                 36.724 
                 36.130 
                 17.302 
                 1.00 
                 44.02 
                 C 
               
               
                 ATOM 
                 134 
                 C 
                 LEU 
                 A 
                 18 
                 37.370 
                 35.255 
                 16.226 
                 1.00 
                 43.55 
                 C 
               
               
                 ATOM 
                 135 
                 O 
                 LEU 
                 A 
                 18 
                 38.128 
                 34.358 
                 16.549 
                 1.00 
                 43.25 
                 O 
               
               
                 ATOM 
                 136 
                 CB 
                 LEU 
                 A 
                 18 
                 37.782 
                 37.064 
                 17.905 
                 1.00 
                 44.33 
                 C 
               
               
                 ATOM 
                 137 
                 CG 
                 LEU 
                 A 
                 18 
                 38.245 
                 38.374 
                 17.238 
                 1.00 
                 45.16 
                 C 
               
               
                 ATOM 
                 138 
                 CD1 
                 LEU 
                 A 
                 18 
                 39.734 
                 38.631 
                 17.509 
                 1.00 
                 45.46 
                 C 
               
               
                 ATOM 
                 139 
                 CD2 
                 LEU 
                 A 
                 18 
                 37.995 
                 38.410 
                 15.752 
                 1.00 
                 46.71 
                 C 
               
               
                 ATOM 
                 140 
                 N 
                 THR 
                 A 
                 19 
                 37.068 
                 35.503 
                 14.961 
                 1.00 
                 43.45 
                 N 
               
               
                 ATOM 
                 141 
                 CA 
                 THR 
                 A 
                 19 
                 37.811 
                 34.883 
                 13.873 
                 1.00 
                 43.78 
                 C 
               
               
                 ATOM 
                 142 
                 C 
                 THR 
                 A 
                 19 
                 38.532 
                 35.969 
                 13.100 
                 1.00 
                 44.14 
                 C 
               
               
                 ATOM 
                 143 
                 O 
                 THR 
                 A 
                 19 
                 37.898 
                 36.792 
                 12.447 
                 1.00 
                 43.91 
                 O 
               
               
                 ATOM 
                 144 
                 CB 
                 THR 
                 A 
                 19 
                 36.883 
                 34.098 
                 12.919 
                 1.00 
                 44.21 
                 C 
               
               
                 ATOM 
                 145 
                 OG1 
                 THR 
                 A 
                 19 
                 36.260 
                 32.974 
                 13.596 
                 1.00 
                 43.80 
                 O 
               
               
                 ATOM 
                 146 
                 CG2 
                 THR 
                 A 
                 19 
                 37.701 
                 33.482 
                 11.751 
                 1.00 
                 43.99 
                 C 
               
               
                 ATOM 
                 147 
                 N 
                 ILE 
                 A 
                 20 
                 39.855 
                 35.995 
                 13.228 
                 1.00 
                 44.85 
                 N 
               
               
                 ATOM 
                 148 
                 CA 
                 ILE 
                 A 
                 20 
                 40.724 
                 36.824 
                 12.400 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 149 
                 C 
                 ILE 
                 A 
                 20 
                 41.108 
                 36.004 
                 11.155 
                 1.00 
                 45.61 
                 C 
               
               
                 ATOM 
                 150 
                 O 
                 ILE 
                 A 
                 20 
                 41.388 
                 34.805 
                 11.253 
                 1.00 
                 45.68 
                 O 
               
               
                 ATOM 
                 151 
                 CB 
                 ILE 
                 A 
                 20 
                 42.012 
                 37.231 
                 13.181 
                 1.00 
                 45.75 
                 C 
               
               
                 ATOM 
                 152 
                 CG1 
                 ILE 
                 A 
                 20 
                 41.681 
                 37.954 
                 14.485 
                 1.00 
                 45.74 
                 C 
               
               
                 ATOM 
                 153 
                 CG2 
                 ILE 
                 A 
                 20 
                 42.932 
                 38.125 
                 12.340 
                 1.00 
                 46.03 
                 C 
               
               
                 ATOM 
                 154 
                 CD1 
                 ILE 
                 A 
                 20 
                 42.736 
                 37.725 
                 15.527 
                 1.00 
                 45.77 
                 C 
               
               
                 ATOM 
                 155 
                 N 
                 ASN 
                 A 
                 21 
                 41.139 
                 36.664 
                 9.997 
                 1.00 
                 45.69 
                 N 
               
               
                 ATOM 
                 156 
                 CA 
                 ASN 
                 A 
                 21 
                 41.425 
                 36.011 
                 8.731 
                 1.00 
                 45.87 
                 C 
               
               
                 ATOM 
                 157 
                 C 
                 ASN 
                 A 
                 21 
                 42.566 
                 36.673 
                 8.007 
                 1.00 
                 45.77 
                 C 
               
               
                 ATOM 
                 158 
                 O 
                 ASN 
                 A 
                 21 
                 42.517 
                 37.865 
                 7.702 
                 1.00 
                 45.99 
                 O 
               
               
                 ATOM 
                 159 
                 CB 
                 ASN 
                 A 
                 21 
                 40.197 
                 36.006 
                 7.832 
                 1.00 
                 45.95 
                 C 
               
               
                 ATOM 
                 160 
                 CG 
                 ASN 
                 A 
                 21 
                 39.197 
                 34.957 
                 8.240 
                 1.00 
                 46.88 
                 C 
               
               
                 ATOM 
                 161 
                 OD1 
                 ASN 
                 A 
                 21 
                 38.008 
                 35.241 
                 8.394 
                 1.00 
                 45.42 
                 O 
               
               
                 ATOM 
                 162 
                 ND2 
                 ASN 
                 A 
                 21 
                 39.678 
                 33.729 
                 8.444 
                 1.00 
                 49.22 
                 N 
               
               
                 ATOM 
                 163 
                 N 
                 CYS 
                 A 
                 22 
                 43.589 
                 35.867 
                 7.733 
                 1.00 
                 45.61 
                 N 
               
               
                 ATOM 
                 164 
                 CA 
                 CYS 
                 A 
                 22 
                 44.744 
                 36.274 
                 6.942 
                 1.00 
                 45.36 
                 C 
               
               
                 ATOM 
                 165 
                 C 
                 CYS 
                 A 
                 22 
                 44.808 
                 35.587 
                 5.576 
                 1.00 
                 44.39 
                 C 
               
               
                 ATOM 
                 166 
                 O 
                 CYS 
                 A 
                 22 
                 44.397 
                 34.437 
                 5.442 
                 1.00 
                 44.02 
                 O 
               
               
                 ATOM 
                 167 
                 CB 
                 CYS 
                 A 
                 22 
                 46.018 
                 36.007 
                 7.733 
                 1.00 
                 45.38 
                 C 
               
               
                 ATOM 
                 168 
                 SG 
                 CYS 
                 A 
                 22 
                 46.155 
                 37.120 
                 9.136 
                 1.00 
                 47.07 
                 S 
               
               
                 ATOM 
                 169 
                 N 
                 VAL 
                 A 
                 23 
                 45.299 
                 36.314 
                 4.564 
                 1.00 
                 43.69 
                 N 
               
               
                 ATOM 
                 170 
                 CA 
                 VAL 
                 A 
                 23 
                 45.610 
                 35.707 
                 3.272 
                 1.00 
                 42.87 
                 C 
               
               
                 ATOM 
                 171 
                 C 
                 VAL 
                 A 
                 23 
                 46.930 
                 36.260 
                 2.699 
                 1.00 
                 42.09 
                 C 
               
               
                 ATOM 
                 172 
                 O 
                 VAL 
                 A 
                 23 
                 47.175 
                 37.458 
                 2.743 
                 1.00 
                 41.16 
                 O 
               
               
                 ATOM 
                 173 
                 CB 
                 VAL 
                 A 
                 23 
                 44.411 
                 35.789 
                 2.289 
                 1.00 
                 42.69 
                 C 
               
               
                 ATOM 
                 174 
                 CG1 
                 VAL 
                 A 
                 23 
                 44.004 
                 37.187 
                 2.072 
                 1.00 
                 42.87 
                 C 
               
               
                 ATOM 
                 175 
                 CG2 
                 VAL 
                 A 
                 23 
                 44.734 
                 35.101 
                 0.943 
                 1.00 
                 43.10 
                 C 
               
               
                 ATOM 
                 176 
                 N 
                 LEU 
                 A 
                 24 
                 47.789 
                 35.346 
                 2.229 
                 1.00 
                 41.64 
                 N 
               
               
                 ATOM 
                 177 
                 CA 
                 LEU 
                 A 
                 24 
                 49.057 
                 35.682 
                 1.605 
                 1.00 
                 41.41 
                 C 
               
               
                 ATOM 
                 178 
                 C 
                 LEU 
                 A 
                 24 
                 48.809 
                 36.129 
                 0.181 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 179 
                 O 
                 LEU 
                 A 
                 24 
                 48.420 
                 35.330 
                 −0.689 
                 1.00 
                 41.43 
                 O 
               
               
                 ATOM 
                 180 
                 CB 
                 LEU 
                 A 
                 24 
                 50.032 
                 34.502 
                 1.614 
                 1.00 
                 41.29 
                 C 
               
               
                 ATOM 
                 181 
                 CG 
                 LEU 
                 A 
                 24 
                 51.469 
                 34.832 
                 1.175 
                 1.00 
                 41.13 
                 C 
               
               
                 ATOM 
                 182 
                 CD1 
                 LEU 
                 A 
                 24 
                 52.229 
                 35.654 
                 2.232 
                 1.00 
                 41.67 
                 C 
               
               
                 ATOM 
                 183 
                 CD2 
                 LEU 
                 A 
                 24 
                 52.248 
                 33.586 
                 0.829 
                 1.00 
                 40.60 
                 C 
               
               
                 ATOM 
                 184 
                 N 
                 ARG 
                 A 
                 25 
                 49.090 
                 37.411 
                 −0.055 
                 1.00 
                 41.98 
                 N 
               
               
                 ATOM 
                 185 
                 CA 
                 ARG 
                 A 
                 25 
                 48.726 
                 38.075 
                 −1.287 
                 1.00 
                 42.00 
                 C 
               
               
                 ATOM 
                 186 
                 C 
                 ARG 
                 A 
                 25 
                 49.889 
                 38.325 
                 −2.241 
                 1.00 
                 42.03 
                 C 
               
               
                 ATOM 
                 187 
                 O 
                 ARG 
                 A 
                 25 
                 51.012 
                 38.537 
                 −1.824 
                 1.00 
                 41.90 
                 O 
               
               
                 ATOM 
                 188 
                 CB 
                 ARG 
                 A 
                 25 
                 48.032 
                 39.373 
                 −0.938 
                 1.00 
                 42.03 
                 C 
               
               
                 ATOM 
                 189 
                 CG 
                 ARG 
                 A 
                 25 
                 46.623 
                 39.140 
                 −0.474 
                 1.00 
                 42.99 
                 C 
               
               
                 ATOM 
                 190 
                 CD 
                 ARG 
                 A 
                 25 
                 45.621 
                 39.047 
                 −1.599 
                 1.00 
                 44.97 
                 C 
               
               
                 ATOM 
                 191 
                 NE 
                 ARG 
                 A 
                 25 
                 44.560 
                 40.014 
                 −1.353 
                 1.00 
                 47.71 
                 N 
               
               
                 ATOM 
                 192 
                 CZ 
                 ARG 
                 A 
                 25 
                 44.099 
                 40.915 
                 −2.219 
                 1.00 
                 47.44 
                 C 
               
               
                 ATOM 
                 193 
                 NH1 
                 ARG 
                 A 
                 25 
                 43.147 
                 41.739 
                 −1.836 
                 1.00 
                 46.78 
                 N 
               
               
                 ATOM 
                 194 
                 NH2 
                 ARG 
                 A 
                 25 
                 44.563 
                 41.001 
                 −3.456 
                 1.00 
                 48.53 
                 N 
               
               
                 ATOM 
                 195 
                 N 
                 ASP 
                 A 
                 26 
                 49.588 
                 38.295 
                 −3.536 
                 1.00 
                 42.42 
                 N 
               
               
                 ATOM 
                 196 
                 CA 
                 ASP 
                 A 
                 26 
                 50.527 
                 38.682 
                 −4.575 
                 1.00 
                 42.66 
                 C 
               
               
                 ATOM 
                 197 
                 C 
                 ASP 
                 A 
                 26 
                 51.931 
                 38.119 
                 −4.330 
                 1.00 
                 43.02 
                 C 
               
               
                 ATOM 
                 198 
                 O 
                 ASP 
                 A 
                 26 
                 52.910 
                 38.831 
                 −4.519 
                 1.00 
                 43.38 
                 O 
               
               
                 ATOM 
                 199 
                 CB 
                 ASP 
                 A 
                 26 
                 50.554 
                 40.217 
                 −4.690 
                 1.00 
                 42.63 
                 C 
               
               
                 ATOM 
                 200 
                 CG 
                 ASP 
                 A 
                 26 
                 49.267 
                 40.784 
                 −5.308 
                 1.00 
                 42.95 
                 C 
               
               
                 ATOM 
                 201 
                 OD1 
                 ASP 
                 A 
                 26 
                 48.444 
                 41.361 
                 −4.570 
                 1.00 
                 41.75 
                 O 
               
               
                 ATOM 
                 202 
                 OD2 
                 ASP 
                 A 
                 26 
                 48.985 
                 40.699 
                 −6.526 
                 1.00 
                 43.93 
                 O 
               
               
                 ATOM 
                 203 
                 N 
                 ALA 
                 A 
                 27 
                 52.019 
                 36.849 
                 −3.918 
                 1.00 
                 43.15 
                 N 
               
               
                 ATOM 
                 204 
                 CA 
                 ALA 
                 A 
                 27 
                 53.298 
                 36.200 
                 −3.589 
                 1.00 
                 43.42 
                 C 
               
               
                 ATOM 
                 205 
                 C 
                 ALA 
                 A 
                 27 
                 53.539 
                 34.998 
                 −4.486 
                 1.00 
                 43.84 
                 C 
               
               
                 ATOM 
                 206 
                 O 
                 ALA 
                 A 
                 27 
                 52.683 
                 34.130 
                 −4.576 
                 1.00 
                 44.30 
                 O 
               
               
                 ATOM 
                 207 
                 CB 
                 ALA 
                 A 
                 27 
                 53.320 
                 35.760 
                 −2.119 
                 1.00 
                 43.12 
                 C 
               
               
                 ATOM 
                 208 
                 N 
                 SER 
                 A 
                 28 
                 54.707 
                 34.934 
                 −5.118 
                 1.00 
                 44.23 
                 N 
               
               
                 ATOM 
                 209 
                 CA 
                 SER 
                 A 
                 28 
                 55.060 
                 33.830 
                 −6.031 
                 1.00 
                 45.06 
                 C 
               
               
                 ATOM 
                 210 
                 C 
                 SER 
                 A 
                 28 
                 55.236 
                 32.425 
                 −5.371 
                 1.00 
                 45.41 
                 C 
               
               
                 ATOM 
                 211 
                 O 
                 SER 
                 A 
                 28 
                 55.084 
                 31.382 
                 −6.024 
                 1.00 
                 45.34 
                 O 
               
               
                 ATOM 
                 212 
                 CB 
                 SER 
                 A 
                 28 
                 56.347 
                 34.192 
                 −6.792 
                 1.00 
                 45.26 
                 C 
               
               
                 ATOM 
                 213 
                 OG 
                 SER 
                 A 
                 28 
                 57.380 
                 34.588 
                 −5.892 
                 1.00 
                 45.67 
                 O 
               
               
                 ATOM 
                 214 
                 N 
                 TYR 
                 A 
                 29 
                 55.569 
                 32.417 
                 −4.087 
                 1.00 
                 45.63 
                 N 
               
               
                 ATOM 
                 215 
                 CA 
                 TYR 
                 A 
                 29 
                 55.743 
                 31.191 
                 −3.322 
                 1.00 
                 46.00 
                 C 
               
               
                 ATOM 
                 216 
                 C 
                 TYR 
                 A 
                 29 
                 54.418 
                 30.837 
                 −2.637 
                 1.00 
                 46.01 
                 C 
               
               
                 ATOM 
                 217 
                 O 
                 TYR 
                 A 
                 29 
                 53.559 
                 31.681 
                 −2.501 
                 1.00 
                 45.94 
                 O 
               
               
                 ATOM 
                 218 
                 CB 
                 TYR 
                 A 
                 29 
                 56.864 
                 31.377 
                 −2.283 
                 1.00 
                 46.23 
                 C 
               
               
                 ATOM 
                 219 
                 CG 
                 TYR 
                 A 
                 29 
                 56.797 
                 32.700 
                 −1.550 
                 1.00 
                 46.49 
                 C 
               
               
                 ATOM 
                 220 
                 CD1 
                 TYR 
                 A 
                 29 
                 57.416 
                 33.832 
                 −2.066 
                 1.00 
                 46.98 
                 C 
               
               
                 ATOM 
                 221 
                 CD2 
                 TYR 
                 A 
                 29 
                 56.085 
                 32.824 
                 −0.361 
                 1.00 
                 48.01 
                 C 
               
               
                 ATOM 
                 222 
                 CE1 
                 TYR 
                 A 
                 29 
                 57.343 
                 35.050 
                 −1.415 
                 1.00 
                 47.91 
                 C 
               
               
                 ATOM 
                 223 
                 CE2 
                 TYR 
                 A 
                 29 
                 55.998 
                 34.044 
                 0.307 
                 1.00 
                 49.09 
                 C 
               
               
                 ATOM 
                 224 
                 CZ 
                 TYR 
                 A 
                 29 
                 56.635 
                 35.156 
                 −0.229 
                 1.00 
                 49.16 
                 C 
               
               
                 ATOM 
                 225 
                 OH 
                 TYR 
                 A 
                 29 
                 56.559 
                 36.376 
                 0.412 
                 1.00 
                 49.69 
                 O 
               
               
                 ATOM 
                 226 
                 N 
                 GLY 
                 A 
                 30 
                 54.259 
                 29.594 
                 −2.202 
                 1.00 
                 46.34 
                 N 
               
               
                 ATOM 
                 227 
                 CA 
                 GLY 
                 A 
                 30 
                 53.046 
                 29.169 
                 −1.518 
                 1.00 
                 46.80 
                 C 
               
               
                 ATOM 
                 228 
                 C 
                 GLY 
                 A 
                 30 
                 53.063 
                 29.488 
                 −0.029 
                 1.00 
                 47.05 
                 C 
               
               
                 ATOM 
                 229 
                 O 
                 GLY 
                 A 
                 30 
                 53.892 
                 30.277 
                 0.419 
                 1.00 
                 47.34 
                 O 
               
               
                 ATOM 
                 230 
                 N 
                 LEU 
                 A 
                 31 
                 52.168 
                 28.870 
                 0.741 
                 1.00 
                 47.02 
                 N 
               
               
                 ATOM 
                 231 
                 CA 
                 LEU 
                 A 
                 31 
                 52.073 
                 29.121 
                 2.180 
                 1.00 
                 47.04 
                 C 
               
               
                 ATOM 
                 232 
                 C 
                 LEU 
                 A 
                 31 
                 52.846 
                 28.046 
                 2.918 
                 1.00 
                 47.34 
                 C 
               
               
                 ATOM 
                 233 
                 O 
                 LEU 
                 A 
                 31 
                 52.657 
                 26.854 
                 2.672 
                 1.00 
                 47.29 
                 O 
               
               
                 ATOM 
                 234 
                 CB 
                 LEU 
                 A 
                 31 
                 50.620 
                 29.072 
                 2.653 
                 1.00 
                 46.88 
                 C 
               
               
                 ATOM 
                 235 
                 CG 
                 LEU 
                 A 
                 31 
                 50.129 
                 30.133 
                 3.642 
                 1.00 
                 46.91 
                 C 
               
               
                 ATOM 
                 236 
                 CD1 
                 LEU 
                 A 
                 31 
                 48.959 
                 29.592 
                 4.454 
                 1.00 
                 47.38 
                 C 
               
               
                 ATOM 
                 237 
                 CD2 
                 LEU 
                 A 
                 31 
                 51.222 
                 30.614 
                 4.558 
                 1.00 
                 47.01 
                 C 
               
               
                 ATOM 
                 238 
                 N 
                 GLU 
                 A 
                 32 
                 53.712 
                 28.452 
                 3.832 
                 1.00 
                 47.44 
                 N 
               
               
                 ATOM 
                 239 
                 CA 
                 GLU 
                 A 
                 32 
                 54.431 
                 27.474 
                 4.604 
                 1.00 
                 47.70 
                 C 
               
               
                 ATOM 
                 240 
                 C 
                 GLU 
                 A 
                 32 
                 54.182 
                 27.729 
                 6.092 
                 1.00 
                 47.35 
                 C 
               
               
                 ATOM 
                 241 
                 O 
                 GLU 
                 A 
                 32 
                 53.023 
                 27.704 
                 6.485 
                 1.00 
                 47.96 
                 O 
               
               
                 ATOM 
                 242 
                 CB 
                 GLU 
                 A 
                 32 
                 55.882 
                 27.401 
                 4.135 
                 1.00 
                 48.20 
                 C 
               
               
                 ATOM 
                 243 
                 CG 
                 GLU 
                 A 
                 32 
                 56.334 
                 25.976 
                 3.750 
                 1.00 
                 50.58 
                 C 
               
               
                 ATOM 
                 244 
                 CD 
                 GLU 
                 A 
                 32 
                 55.433 
                 25.258 
                 2.727 
                 1.00 
                 52.14 
                 C 
               
               
                 ATOM 
                 245 
                 OE1 
                 GLU 
                 A 
                 32 
                 54.939 
                 25.923 
                 1.779 
                 1.00 
                 52.31 
                 O 
               
               
                 ATOM 
                 246 
                 OE2 
                 GLU 
                 A 
                 32 
                 55.240 
                 24.015 
                 2.871 
                 1.00 
                 52.34 
                 O 
               
               
                 ATOM 
                 247 
                 N 
                 SER 
                 A 
                 33 
                 55.178 
                 27.958 
                 6.940 
                 1.00 
                 46.79 
                 N 
               
               
                 ATOM 
                 248 
                 CA 
                 SER 
                 A 
                 33 
                 54.873 
                 28.132 
                 8.367 
                 1.00 
                 46.45 
                 C 
               
               
                 ATOM 
                 249 
                 C 
                 SER 
                 A 
                 33 
                 53.863 
                 29.273 
                 8.593 
                 1.00 
                 46.08 
                 C 
               
               
                 ATOM 
                 250 
                 O 
                 SER 
                 A 
                 33 
                 53.672 
                 30.135 
                 7.739 
                 1.00 
                 46.14 
                 O 
               
               
                 ATOM 
                 251 
                 CB 
                 SER 
                 A 
                 33 
                 56.152 
                 28.351 
                 9.188 
                 1.00 
                 46.57 
                 C 
               
               
                 ATOM 
                 252 
                 OG 
                 SER 
                 A 
                 33 
                 55.888 
                 28.890 
                 10.475 
                 1.00 
                 46.71 
                 O 
               
               
                 ATOM 
                 253 
                 N 
                 THR 
                 A 
                 34 
                 53.188 
                 29.239 
                 9.730 
                 1.00 
                 45.62 
                 N 
               
               
                 ATOM 
                 254 
                 CA 
                 THR 
                 A 
                 34 
                 52.243 
                 30.289 
                 10.107 
                 1.00 
                 45.56 
                 C 
               
               
                 ATOM 
                 255 
                 C 
                 THR 
                 A 
                 34 
                 52.425 
                 30.607 
                 11.569 
                 1.00 
                 44.81 
                 C 
               
               
                 ATOM 
                 256 
                 O 
                 THR 
                 A 
                 34 
                 52.995 
                 29.815 
                 12.293 
                 1.00 
                 45.14 
                 O 
               
               
                 ATOM 
                 257 
                 CB 
                 THR 
                 A 
                 34 
                 50.802 
                 29.825 
                 9.885 
                 1.00 
                 45.92 
                 C 
               
               
                 ATOM 
                 258 
                 OG1 
                 THR 
                 A 
                 34 
                 50.659 
                 28.479 
                 10.376 
                 1.00 
                 47.83 
                 O 
               
               
                 ATOM 
                 259 
                 CG2 
                 THR 
                 A 
                 34 
                 50.459 
                 29.745 
                 8.384 
                 1.00 
                 45.65 
                 C 
               
               
                 ATOM 
                 260 
                 N 
                 GLY 
                 A 
                 35 
                 51.910 
                 31.742 
                 12.016 
                 1.00 
                 44.17 
                 N 
               
               
                 ATOM 
                 261 
                 CA 
                 GLY 
                 A 
                 35 
                 52.193 
                 32.203 
                 13.362 
                 1.00 
                 43.84 
                 C 
               
               
                 ATOM 
                 262 
                 C 
                 GLY 
                 A 
                 35 
                 51.335 
                 33.355 
                 13.829 
                 1.00 
                 43.55 
                 C 
               
               
                 ATOM 
                 263 
                 O 
                 GLY 
                 A 
                 35 
                 51.044 
                 34.257 
                 13.065 
                 1.00 
                 43.37 
                 O 
               
               
                 ATOM 
                 264 
                 N 
                 TRP 
                 A 
                 36 
                 50.951 
                 33.333 
                 15.098 
                 1.00 
                 43.43 
                 N 
               
               
                 ATOM 
                 265 
                 CA 
                 TRP 
                 A 
                 36 
                 50.125 
                 34.387 
                 15.662 
                 1.00 
                 43.65 
                 C 
               
               
                 ATOM 
                 266 
                 C 
                 TRP 
                 A 
                 36 
                 50.808 
                 35.017 
                 16.862 
                 1.00 
                 43.76 
                 C 
               
               
                 ATOM 
                 267 
                 O 
                 TRP 
                 A 
                 36 
                 51.562 
                 34.348 
                 17.536 
                 1.00 
                 44.10 
                 O 
               
               
                 ATOM 
                 268 
                 CB 
                 TRP 
                 A 
                 36 
                 48.736 
                 33.832 
                 16.015 
                 1.00 
                 43.66 
                 C 
               
               
                 ATOM 
                 269 
                 CG 
                 TRP 
                 A 
                 36 
                 48.035 
                 33.281 
                 14.791 
                 1.00 
                 43.52 
                 C 
               
               
                 ATOM 
                 270 
                 CD1 
                 TRP 
                 A 
                 36 
                 48.228 
                 32.056 
                 14.203 
                 1.00 
                 43.11 
                 C 
               
               
                 ATOM 
                 271 
                 CD2 
                 TRP 
                 A 
                 36 
                 47.066 
                 33.955 
                 13.989 
                 1.00 
                 43.23 
                 C 
               
               
                 ATOM 
                 272 
                 NE1 
                 TRP 
                 A 
                 36 
                 47.429 
                 31.932 
                 13.091 
                 1.00 
                 42.76 
                 N 
               
               
                 ATOM 
                 273 
                 CE2 
                 TRP 
                 A 
                 36 
                 46.708 
                 33.079 
                 12.933 
                 1.00 
                 42.13 
                 C 
               
               
                 ATOM 
                 274 
                 CE3 
                 TRP 
                 A 
                 36 
                 46.465 
                 35.212 
                 14.052 
                 1.00 
                 42.31 
                 C 
               
               
                 ATOM 
                 275 
                 CZ2 
                 TRP 
                 A 
                 36 
                 45.786 
                 33.412 
                 11.970 
                 1.00 
                 42.17 
                 C 
               
               
                 ATOM 
                 276 
                 CZ3 
                 TRP 
                 A 
                 36 
                 45.545 
                 35.541 
                 13.101 
                 1.00 
                 42.77 
                 C 
               
               
                 ATOM 
                 277 
                 CH2 
                 TRP 
                 A 
                 36 
                 45.213 
                 34.645 
                 12.060 
                 1.00 
                 43.22 
                 C 
               
               
                 ATOM 
                 278 
                 N 
                 TYR 
                 A 
                 37 
                 50.547 
                 36.306 
                 17.100 
                 1.00 
                 44.26 
                 N 
               
               
                 ATOM 
                 279 
                 CA 
                 TYR 
                 A 
                 37 
                 51.155 
                 37.090 
                 18.178 
                 1.00 
                 44.69 
                 C 
               
               
                 ATOM 
                 280 
                 C 
                 TYR 
                 A 
                 37 
                 50.145 
                 38.050 
                 18.793 
                 1.00 
                 45.68 
                 C 
               
               
                 ATOM 
                 281 
                 O 
                 TYR 
                 A 
                 37 
                 49.574 
                 38.884 
                 18.132 
                 1.00 
                 45.58 
                 O 
               
               
                 ATOM 
                 282 
                 CB 
                 TYR 
                 A 
                 37 
                 52.357 
                 37.862 
                 17.660 
                 1.00 
                 44.51 
                 C 
               
               
                 ATOM 
                 283 
                 CG 
                 TYR 
                 A 
                 37 
                 53.257 
                 36.964 
                 16.865 
                 1.00 
                 44.82 
                 C 
               
               
                 ATOM 
                 284 
                 CD1 
                 TYR 
                 A 
                 37 
                 54.326 
                 36.311 
                 17.461 
                 1.00 
                 45.09 
                 C 
               
               
                 ATOM 
                 285 
                 CD2 
                 TYR 
                 A 
                 37 
                 52.993 
                 36.705 
                 15.529 
                 1.00 
                 45.84 
                 C 
               
               
                 ATOM 
                 286 
                 CE1 
                 TYR 
                 A 
                 37 
                 55.114 
                 35.452 
                 16.740 
                 1.00 
                 45.33 
                 C 
               
               
                 ATOM 
                 287 
                 CE2 
                 TYR 
                 A 
                 37 
                 53.776 
                 35.854 
                 14.802 
                 1.00 
                 45.95 
                 C 
               
               
                 ATOM 
                 288 
                 CZ 
                 TYR 
                 A 
                 37 
                 54.826 
                 35.232 
                 15.411 
                 1.00 
                 45.91 
                 C 
               
               
                 ATOM 
                 289 
                 OH 
                 TYR 
                 A 
                 37 
                 55.589 
                 34.380 
                 14.672 
                 1.00 
                 49.07 
                 O 
               
               
                 ATOM 
                 290 
                 N 
                 ARG 
                 A 
                 38 
                 49.900 
                 37.872 
                 20.079 
                 1.00 
                 47.31 
                 N 
               
               
                 ATOM 
                 291 
                 CA 
                 ARG 
                 A 
                 38 
                 49.134 
                 38.801 
                 20.909 
                 1.00 
                 48.10 
                 C 
               
               
                 ATOM 
                 292 
                 C 
                 ARG 
                 A 
                 38 
                 50.091 
                 39.931 
                 21.209 
                 1.00 
                 47.87 
                 C 
               
               
                 ATOM 
                 293 
                 O 
                 ARG 
                 A 
                 38 
                 51.303 
                 39.726 
                 21.173 
                 1.00 
                 47.88 
                 O 
               
               
                 ATOM 
                 294 
                 CB 
                 ARG 
                 A 
                 38 
                 48.759 
                 38.111 
                 22.249 
                 1.00 
                 48.62 
                 C 
               
               
                 ATOM 
                 295 
                 CG 
                 ARG 
                 A 
                 38 
                 47.377 
                 38.432 
                 22.831 
                 1.00 
                 50.71 
                 C 
               
               
                 ATOM 
                 296 
                 CD 
                 ARG 
                 A 
                 38 
                 46.603 
                 37.207 
                 23.407 
                 1.00 
                 53.44 
                 C 
               
               
                 ATOM 
                 297 
                 NE 
                 ARG 
                 A 
                 38 
                 46.786 
                 37.089 
                 24.850 
                 1.00 
                 55.90 
                 N 
               
               
                 ATOM 
                 298 
                 CZ 
                 ARG 
                 A 
                 38 
                 47.813 
                 36.479 
                 25.449 
                 1.00 
                 58.69 
                 C 
               
               
                 ATOM 
                 299 
                 NH1 
                 ARG 
                 A 
                 38 
                 47.882 
                 36.457 
                 26.782 
                 1.00 
                 59.57 
                 N 
               
               
                 ATOM 
                 300 
                 NH2 
                 ARG 
                 A 
                 38 
                 48.779 
                 35.889 
                 24.738 
                 1.00 
                 59.59 
                 N 
               
               
                 ATOM 
                 301 
                 N 
                 THR 
                 A 
                 39 
                 49.567 
                 41.114 
                 21.489 
                 1.00 
                 47.47 
                 N 
               
               
                 ATOM 
                 302 
                 CA 
                 THR 
                 A 
                 39 
                 50.306 
                 42.060 
                 22.309 
                 1.00 
                 47.36 
                 C 
               
               
                 ATOM 
                 303 
                 C 
                 THR 
                 A 
                 39 
                 49.306 
                 42.440 
                 23.385 
                 1.00 
                 47.23 
                 C 
               
               
                 ATOM 
                 304 
                 O 
                 THR 
                 A 
                 39 
                 48.311 
                 43.116 
                 23.131 
                 1.00 
                 47.09 
                 O 
               
               
                 ATOM 
                 305 
                 CB 
                 THR 
                 A 
                 39 
                 50.927 
                 43.249 
                 21.480 
                 1.00 
                 47.47 
                 C 
               
               
                 ATOM 
                 306 
                 OG1 
                 THR 
                 A 
                 39 
                 52.344 
                 43.323 
                 21.720 
                 1.00 
                 47.03 
                 O 
               
               
                 ATOM 
                 307 
                 CG2 
                 THR 
                 A 
                 39 
                 50.436 
                 44.627 
                 21.920 
                 1.00 
                 47.35 
                 C 
               
               
                 ATOM 
                 308 
                 N 
                 LYS 
                 A 
                 40 
                 49.535 
                 41.920 
                 24.582 
                 1.00 
                 47.19 
                 N 
               
               
                 ATOM 
                 309 
                 CA 
                 LYS 
                 A 
                 40 
                 48.558 
                 42.086 
                 25.633 
                 1.00 
                 47.13 
                 C 
               
               
                 ATOM 
                 310 
                 C 
                 LYS 
                 A 
                 40 
                 48.444 
                 43.571 
                 25.866 
                 1.00 
                 47.19 
                 C 
               
               
                 ATOM 
                 311 
                 O 
                 LYS 
                 A 
                 40 
                 49.445 
                 44.248 
                 26.082 
                 1.00 
                 47.17 
                 O 
               
               
                 ATOM 
                 312 
                 CB 
                 LYS 
                 A 
                 40 
                 48.928 
                 41.324 
                 26.921 
                 1.00 
                 47.02 
                 C 
               
               
                 ATOM 
                 313 
                 CG 
                 LYS 
                 A 
                 40 
                 47.688 
                 40.729 
                 27.623 
                 1.00 
                 46.82 
                 C 
               
               
                 ATOM 
                 314 
                 CD 
                 LYS 
                 A 
                 40 
                 48.015 
                 39.740 
                 28.748 
                 1.00 
                 46.47 
                 C 
               
               
                 ATOM 
                 315 
                 CE 
                 LYS 
                 A 
                 40 
                 47.890 
                 40.377 
                 30.145 
                 1.00 
                 46.50 
                 C 
               
               
                 ATOM 
                 316 
                 NZ 
                 LYS 
                 A 
                 40 
                 46.755 
                 41.347 
                 30.294 
                 1.00 
                 45.86 
                 N 
               
               
                 ATOM 
                 317 
                 N 
                 LEU 
                 A 
                 41 
                 47.225 
                 44.076 
                 25.723 
                 1.00 
                 47.30 
                 N 
               
               
                 ATOM 
                 318 
                 CA 
                 LEU 
                 A 
                 41 
                 46.871 
                 45.412 
                 26.180 
                 1.00 
                 47.33 
                 C 
               
               
                 ATOM 
                 319 
                 C 
                 LEU 
                 A 
                 41 
                 47.530 
                 45.674 
                 27.555 
                 1.00 
                 47.66 
                 C 
               
               
                 ATOM 
                 320 
                 O 
                 LEU 
                 A 
                 41 
                 47.133 
                 45.093 
                 28.587 
                 1.00 
                 47.69 
                 O 
               
               
                 ATOM 
                 321 
                 CB 
                 LEU 
                 A 
                 41 
                 45.346 
                 45.509 
                 26.247 
                 1.00 
                 47.14 
                 C 
               
               
                 ATOM 
                 322 
                 CG 
                 LEU 
                 A 
                 41 
                 44.683 
                 46.802 
                 26.698 
                 1.00 
                 46.34 
                 C 
               
               
                 ATOM 
                 323 
                 CD1 
                 LEU 
                 A 
                 41 
                 43.722 
                 47.282 
                 25.653 
                 1.00 
                 45.95 
                 C 
               
               
                 ATOM 
                 324 
                 CD2 
                 LEU 
                 A 
                 41 
                 43.951 
                 46.576 
                 28.014 
                 1.00 
                 46.62 
                 C 
               
               
                 ATOM 
                 325 
                 N 
                 GLY 
                 A 
                 42 
                 48.559 
                 46.526 
                 27.547 
                 1.00 
                 47.83 
                 N 
               
               
                 ATOM 
                 326 
                 CA 
                 GLY 
                 A 
                 42 
                 49.360 
                 46.802 
                 28.732 
                 1.00 
                 47.73 
                 C 
               
               
                 ATOM 
                 327 
                 C 
                 GLY 
                 A 
                 42 
                 50.836 
                 46.954 
                 28.413 
                 1.00 
                 47.74 
                 C 
               
               
                 ATOM 
                 328 
                 O 
                 GLY 
                 A 
                 42 
                 51.489 
                 47.872 
                 28.901 
                 1.00 
                 47.48 
                 O 
               
               
                 ATOM 
                 329 
                 N 
                 SER 
                 A 
                 43 
                 51.351 
                 46.050 
                 27.583 
                 1.00 
                 48.04 
                 N 
               
               
                 ATOM 
                 330 
                 CA 
                 SER 
                 A 
                 43 
                 52.779 
                 45.973 
                 27.275 
                 1.00 
                 48.28 
                 C 
               
               
                 ATOM 
                 331 
                 C 
                 SER 
                 A 
                 43 
                 53.132 
                 46.240 
                 25.793 
                 1.00 
                 48.76 
                 C 
               
               
                 ATOM 
                 332 
                 O 
                 SER 
                 A 
                 43 
                 52.263 
                 46.291 
                 24.909 
                 1.00 
                 48.44 
                 O 
               
               
                 ATOM 
                 333 
                 CB 
                 SER 
                 A 
                 43 
                 53.307 
                 44.595 
                 27.691 
                 1.00 
                 48.30 
                 C 
               
               
                 ATOM 
                 334 
                 OG 
                 SER 
                 A 
                 43 
                 52.660 
                 43.559 
                 26.975 
                 1.00 
                 47.07 
                 O 
               
               
                 ATOM 
                 335 
                 N 
                 THR 
                 A 
                 44 
                 54.429 
                 46.431 
                 25.548 
                 1.00 
                 49.30 
                 N 
               
               
                 ATOM 
                 336 
                 CA 
                 THR 
                 A 
                 44 
                 54.965 
                 46.557 
                 24.185 
                 1.00 
                 49.61 
                 C 
               
               
                 ATOM 
                 337 
                 C 
                 THR 
                 A 
                 44 
                 55.542 
                 45.219 
                 23.671 
                 1.00 
                 49.81 
                 C 
               
               
                 ATOM 
                 338 
                 O 
                 THR 
                 A 
                 44 
                 55.581 
                 44.967 
                 22.450 
                 1.00 
                 49.86 
                 O 
               
               
                 ATOM 
                 339 
                 CB 
                 THR 
                 A 
                 44 
                 56.019 
                 47.712 
                 24.113 
                 1.00 
                 49.63 
                 C 
               
               
                 ATOM 
                 340 
                 OG1 
                 THR 
                 A 
                 44 
                 56.404 
                 47.937 
                 22.748 
                 1.00 
                 49.78 
                 O 
               
               
                 ATOM 
                 341 
                 CG2 
                 THR 
                 A 
                 44 
                 57.330 
                 47.364 
                 24.847 
                 1.00 
                 49.19 
                 C 
               
               
                 ATOM 
                 342 
                 N 
                 ASN 
                 A 
                 45 
                 55.995 
                 44.395 
                 24.627 
                 1.00 
                 49.77 
                 N 
               
               
                 ATOM 
                 343 
                 CA 
                 ASN 
                 A 
                 45 
                 56.406 
                 43.001 
                 24.416 
                 1.00 
                 49.48 
                 C 
               
               
                 ATOM 
                 344 
                 C 
                 ASN 
                 A 
                 45 
                 55.386 
                 42.201 
                 23.612 
                 1.00 
                 49.23 
                 C 
               
               
                 ATOM 
                 345 
                 O 
                 ASN 
                 A 
                 45 
                 54.319 
                 41.857 
                 24.120 
                 1.00 
                 49.15 
                 O 
               
               
                 ATOM 
                 346 
                 CB 
                 ASN 
                 A 
                 45 
                 56.617 
                 42.324 
                 25.786 
                 1.00 
                 49.49 
                 C 
               
               
                 ATOM 
                 347 
                 CG 
                 ASN 
                 A 
                 45 
                 57.451 
                 41.059 
                 25.705 
                 1.00 
                 49.18 
                 C 
               
               
                 ATOM 
                 348 
                 OD1 
                 ASN 
                 A 
                 45 
                 56.931 
                 39.971 
                 25.446 
                 1.00 
                 47.89 
                 O 
               
               
                 ATOM 
                 349 
                 ND2 
                 ASN 
                 A 
                 45 
                 58.755 
                 41.195 
                 25.957 
                 1.00 
                 48.90 
                 N 
               
               
                 ATOM 
                 350 
                 N 
                 GLU 
                 A 
                 46 
                 55.703 
                 41.923 
                 22.352 
                 1.00 
                 49.07 
                 N 
               
               
                 ATOM 
                 351 
                 CA 
                 GLU 
                 A 
                 46 
                 54.849 
                 41.064 
                 21.544 
                 1.00 
                 49.04 
                 C 
               
               
                 ATOM 
                 352 
                 C 
                 GLU 
                 A 
                 46 
                 55.201 
                 39.618 
                 21.828 
                 1.00 
                 48.82 
                 C 
               
               
                 ATOM 
                 353 
                 O 
                 GLU 
                 A 
                 46 
                 56.369 
                 39.233 
                 21.815 
                 1.00 
                 48.78 
                 O 
               
               
                 ATOM 
                 354 
                 CB 
                 GLU 
                 A 
                 46 
                 54.967 
                 41.353 
                 20.047 
                 1.00 
                 49.09 
                 C 
               
               
                 ATOM 
                 355 
                 CG 
                 GLU 
                 A 
                 46 
                 53.704 
                 40.968 
                 19.284 
                 1.00 
                 49.83 
                 C 
               
               
                 ATOM 
                 356 
                 CD 
                 GLU 
                 A 
                 46 
                 53.952 
                 40.570 
                 17.838 
                 1.00 
                 51.36 
                 C 
               
               
                 ATOM 
                 357 
                 OE1 
                 GLU 
                 A 
                 46 
                 53.070 
                 40.860 
                 16.976 
                 1.00 
                 51.15 
                 O 
               
               
                 ATOM 
                 358 
                 OE2 
                 GLU 
                 A 
                 46 
                 55.014 
                 39.951 
                 17.570 
                 1.00 
                 51.52 
                 O 
               
               
                 ATOM 
                 359 
                 N 
                 GLN 
                 A 
                 47 
                 54.166 
                 38.828 
                 22.082 
                 1.00 
                 48.68 
                 N 
               
               
                 ATOM 
                 360 
                 CA 
                 GLN 
                 A 
                 47 
                 54.310 
                 37.447 
                 22.519 
                 1.00 
                 48.37 
                 C 
               
               
                 ATOM 
                 361 
                 C 
                 GLN 
                 A 
                 47 
                 53.572 
                 36.493 
                 21.577 
                 1.00 
                 47.51 
                 C 
               
               
                 ATOM 
                 362 
                 O 
                 GLN 
                 A 
                 47 
                 52.394 
                 36.706 
                 21.249 
                 1.00 
                 47.38 
                 O 
               
               
                 ATOM 
                 363 
                 CB 
                 GLN 
                 A 
                 47 
                 53.787 
                 37.293 
                 23.954 
                 1.00 
                 48.68 
                 C 
               
               
                 ATOM 
                 364 
                 CG 
                 GLN 
                 A 
                 47 
                 52.342 
                 37.807 
                 24.195 
                 1.00 
                 49.39 
                 C 
               
               
                 ATOM 
                 365 
                 CD 
                 GLN 
                 A 
                 47 
                 51.875 
                 37.558 
                 25.625 
                 1.00 
                 50.87 
                 C 
               
               
                 ATOM 
                 366 
                 OE1 
                 GLN 
                 A 
                 47 
                 50.669 
                 37.523 
                 25.893 
                 1.00 
                 51.36 
                 O 
               
               
                 ATOM 
                 367 
                 NE2 
                 GLN 
                 A 
                 47 
                 52.832 
                 37.379 
                 26.546 
                 1.00 
                 50.64 
                 N 
               
               
                 ATOM 
                 368 
                 N 
                 THR 
                 A 
                 48 
                 54.288 
                 35.448 
                 21.159 
                 1.00 
                 46.35 
                 N 
               
               
                 ATOM 
                 369 
                 CA 
                 THR 
                 A 
                 48 
                 53.721 
                 34.349 
                 20.381 
                 1.00 
                 45.37 
                 C 
               
               
                 ATOM 
                 370 
                 C 
                 THR 
                 A 
                 48 
                 52.475 
                 33.751 
                 21.058 
                 1.00 
                 44.66 
                 C 
               
               
                 ATOM 
                 371 
                 O 
                 THR 
                 A 
                 48 
                 52.422 
                 33.619 
                 22.271 
                 1.00 
                 44.42 
                 O 
               
               
                 ATOM 
                 372 
                 CB 
                 THR 
                 A 
                 48 
                 54.795 
                 33.240 
                 20.174 
                 1.00 
                 45.26 
                 C 
               
               
                 ATOM 
                 373 
                 OG1 
                 THR 
                 A 
                 48 
                 56.010 
                 33.809 
                 19.668 
                 1.00 
                 43.92 
                 O 
               
               
                 ATOM 
                 374 
                 CG2 
                 THR 
                 A 
                 48 
                 54.372 
                 32.261 
                 19.087 
                 1.00 
                 45.53 
                 C 
               
               
                 ATOM 
                 375 
                 N 
                 ILE 
                 A 
                 49 
                 51.470 
                 33.420 
                 20.262 
                 1.00 
                 43.99 
                 N 
               
               
                 ATOM 
                 376 
                 CA 
                 ILE 
                 A 
                 49 
                 50.325 
                 32.645 
                 20.724 
                 1.00 
                 43.43 
                 C 
               
               
                 ATOM 
                 377 
                 C 
                 ILE 
                 A 
                 49 
                 50.598 
                 31.154 
                 20.458 
                 1.00 
                 43.66 
                 C 
               
               
                 ATOM 
                 378 
                 O 
                 ILE 
                 A 
                 49 
                 51.019 
                 30.794 
                 19.352 
                 1.00 
                 44.12 
                 O 
               
               
                 ATOM 
                 379 
                 CB 
                 ILE 
                 A 
                 49 
                 49.060 
                 33.106 
                 19.994 
                 1.00 
                 42.82 
                 C 
               
               
                 ATOM 
                 380 
                 CG1 
                 ILE 
                 A 
                 49 
                 48.633 
                 34.473 
                 20.529 
                 1.00 
                 41.60 
                 C 
               
               
                 ATOM 
                 381 
                 CG2 
                 ILE 
                 A 
                 49 
                 47.949 
                 32.065 
                 20.138 
                 1.00 
                 42.75 
                 C 
               
               
                 ATOM 
                 382 
                 CD1 
                 ILE 
                 A 
                 49 
                 47.627 
                 35.211 
                 19.649 
                 1.00 
                 40.71 
                 C 
               
               
                 ATOM 
                 383 
                 N 
                 SER 
                 A 
                 50 
                 50.357 
                 30.302 
                 21.457 
                 1.00 
                 43.62 
                 N 
               
               
                 ATOM 
                 384 
                 CA 
                 SER 
                 A 
                 50 
                 50.546 
                 28.846 
                 21.321 
                 1.00 
                 43.72 
                 C 
               
               
                 ATOM 
                 385 
                 C 
                 SER 
                 A 
                 50 
                 49.252 
                 28.069 
                 21.024 
                 1.00 
                 43.40 
                 C 
               
               
                 ATOM 
                 386 
                 O 
                 SER 
                 A 
                 50 
                 48.505 
                 27.736 
                 21.944 
                 1.00 
                 43.31 
                 O 
               
               
                 ATOM 
                 387 
                 CB 
                 SER 
                 A 
                 50 
                 51.169 
                 28.288 
                 22.586 
                 1.00 
                 43.69 
                 C 
               
               
                 ATOM 
                 388 
                 OG 
                 SER 
                 A 
                 50 
                 52.525 
                 28.670 
                 22.645 
                 1.00 
                 45.22 
                 O 
               
               
                 ATOM 
                 389 
                 N 
                 ILE 
                 A 
                 51 
                 49.051 
                 27.741 
                 19.744 
                 1.00 
                 43.11 
                 N 
               
               
                 ATOM 
                 390 
                 CA 
                 ILE 
                 A 
                 51 
                 47.804 
                 27.170 
                 19.211 
                 1.00 
                 42.81 
                 C 
               
               
                 ATOM 
                 391 
                 C 
                 ILE 
                 A 
                 51 
                 47.340 
                 25.902 
                 19.933 
                 1.00 
                 42.89 
                 C 
               
               
                 ATOM 
                 392 
                 O 
                 ILE 
                 A 
                 51 
                 48.044 
                 24.893 
                 19.973 
                 1.00 
                 43.22 
                 O 
               
               
                 ATOM 
                 393 
                 CB 
                 ILE 
                 A 
                 51 
                 47.928 
                 26.862 
                 17.691 
                 1.00 
                 42.60 
                 C 
               
               
                 ATOM 
                 394 
                 CG1 
                 ILE 
                 A 
                 51 
                 48.287 
                 28.126 
                 16.869 
                 1.00 
                 42.42 
                 C 
               
               
                 ATOM 
                 395 
                 CG2 
                 ILE 
                 A 
                 51 
                 46.646 
                 26.231 
                 17.177 
                 1.00 
                 42.42 
                 C 
               
               
                 ATOM 
                 396 
                 CD1 
                 ILE 
                 A 
                 51 
                 47.368 
                 29.346 
                 17.030 
                 1.00 
                 41.97 
                 C 
               
               
                 ATOM 
                 397 
                 N 
                 GLY 
                 A 
                 52 
                 46.125 
                 25.975 
                 20.464 
                 1.00 
                 42.68 
                 N 
               
               
                 ATOM 
                 398 
                 CA 
                 GLY 
                 A 
                 52 
                 45.517 
                 24.912 
                 21.226 
                 1.00 
                 42.57 
                 C 
               
               
                 ATOM 
                 399 
                 C 
                 GLY 
                 A 
                 52 
                 44.403 
                 25.490 
                 22.076 
                 1.00 
                 42.68 
                 C 
               
               
                 ATOM 
                 400 
                 O 
                 GLY 
                 A 
                 52 
                 44.396 
                 26.683 
                 22.359 
                 1.00 
                 42.51 
                 O 
               
               
                 ATOM 
                 401 
                 N 
                 GLY 
                 A 
                 53 
                 43.467 
                 24.636 
                 22.488 
                 1.00 
                 42.80 
                 N 
               
               
                 ATOM 
                 402 
                 CA 
                 GLY 
                 A 
                 53 
                 42.378 
                 25.025 
                 23.372 
                 1.00 
                 42.58 
                 C 
               
               
                 ATOM 
                 403 
                 C 
                 GLY 
                 A 
                 53 
                 41.385 
                 26.025 
                 22.801 
                 1.00 
                 42.38 
                 C 
               
               
                 ATOM 
                 404 
                 O 
                 GLY 
                 A 
                 53 
                 40.644 
                 25.714 
                 21.855 
                 1.00 
                 42.63 
                 O 
               
               
                 ATOM 
                 405 
                 N 
                 ARG 
                 A 
                 54 
                 41.353 
                 27.211 
                 23.410 
                 1.00 
                 41.93 
                 N 
               
               
                 ATOM 
                 406 
                 CA 
                 ARG 
                 A 
                 54 
                 40.476 
                 28.301 
                 22.981 
                 1.00 
                 41.82 
                 C 
               
               
                 ATOM 
                 407 
                 C 
                 ARG 
                 A 
                 54 
                 40.875 
                 28.889 
                 21.641 
                 1.00 
                 41.60 
                 C 
               
               
                 ATOM 
                 408 
                 O 
                 ARG 
                 A 
                 54 
                 40.031 
                 29.296 
                 20.881 
                 1.00 
                 41.77 
                 O 
               
               
                 ATOM 
                 409 
                 CB 
                 ARG 
                 A 
                 54 
                 40.516 
                 29.441 
                 23.985 
                 1.00 
                 41.91 
                 C 
               
               
                 ATOM 
                 410 
                 CG 
                 ARG 
                 A 
                 54 
                 39.826 
                 29.154 
                 25.263 
                 1.00 
                 42.28 
                 C 
               
               
                 ATOM 
                 411 
                 CD 
                 ARG 
                 A 
                 54 
                 40.540 
                 29.674 
                 26.510 
                 1.00 
                 43.07 
                 C 
               
               
                 ATOM 
                 412 
                 NE 
                 ARG 
                 A 
                 54 
                 41.425 
                 30.833 
                 26.339 
                 1.00 
                 42.41 
                 N 
               
               
                 ATOM 
                 413 
                 CZ 
                 ARG 
                 A 
                 54 
                 41.047 
                 32.056 
                 25.963 
                 1.00 
                 42.94 
                 C 
               
               
                 ATOM 
                 414 
                 NH1 
                 ARG 
                 A 
                 54 
                 39.789 
                 32.339 
                 25.636 
                 1.00 
                 42.52 
                 N 
               
               
                 ATOM 
                 415 
                 NH2 
                 ARG 
                 A 
                 54 
                 41.957 
                 33.008 
                 25.885 
                 1.00 
                 43.60 
                 N 
               
               
                 ATOM 
                 416 
                 N 
                 TYR 
                 A 
                 55 
                 42.166 
                 28.988 
                 21.378 
                 1.00 
                 41.61 
                 N 
               
               
                 ATOM 
                 417 
                 CA 
                 TYR 
                 A 
                 55 
                 42.650 
                 29.497 
                 20.103 
                 1.00 
                 41.70 
                 C 
               
               
                 ATOM 
                 418 
                 C 
                 TYR 
                 A 
                 55 
                 42.726 
                 28.309 
                 19.159 
                 1.00 
                 41.39 
                 C 
               
               
                 ATOM 
                 419 
                 O 
                 TYR 
                 A 
                 55 
                 43.364 
                 27.317 
                 19.490 
                 1.00 
                 41.66 
                 O 
               
               
                 ATOM 
                 420 
                 CB 
                 TYR 
                 A 
                 55 
                 44.045 
                 30.071 
                 20.256 
                 1.00 
                 41.78 
                 C 
               
               
                 ATOM 
                 421 
                 CG 
                 TYR 
                 A 
                 55 
                 44.264 
                 31.058 
                 21.374 
                 1.00 
                 43.01 
                 C 
               
               
                 ATOM 
                 422 
                 CD1 
                 TYR 
                 A 
                 55 
                 44.114 
                 32.412 
                 21.151 
                 1.00 
                 45.49 
                 C 
               
               
                 ATOM 
                 423 
                 CD2 
                 TYR 
                 A 
                 55 
                 44.698 
                 30.648 
                 22.625 
                 1.00 
                 44.41 
                 C 
               
               
                 ATOM 
                 424 
                 CE1 
                 TYR 
                 A 
                 55 
                 44.364 
                 33.356 
                 22.149 
                 1.00 
                 46.84 
                 C 
               
               
                 ATOM 
                 425 
                 CE2 
                 TYR 
                 A 
                 55 
                 44.951 
                 31.580 
                 23.642 
                 1.00 
                 46.64 
                 C 
               
               
                 ATOM 
                 426 
                 CZ 
                 TYR 
                 A 
                 55 
                 44.783 
                 32.942 
                 23.394 
                 1.00 
                 47.72 
                 C 
               
               
                 ATOM 
                 427 
                 OH 
                 TYR 
                 A 
                 55 
                 45.036 
                 33.905 
                 24.366 
                 1.00 
                 49.23 
                 O 
               
               
                 ATOM 
                 428 
                 N 
                 VAL 
                 A 
                 56 
                 42.074 
                 28.395 
                 18.004 
                 1.00 
                 41.05 
                 N 
               
               
                 ATOM 
                 429 
                 CA 
                 VAL 
                 A 
                 56 
                 42.029 
                 27.272 
                 17.070 
                 1.00 
                 41.07 
                 C 
               
               
                 ATOM 
                 430 
                 C 
                 VAL 
                 A 
                 56 
                 42.311 
                 27.777 
                 15.674 
                 1.00 
                 41.10 
                 C 
               
               
                 ATOM 
                 431 
                 O 
                 VAL 
                 A 
                 56 
                 41.569 
                 28.596 
                 15.132 
                 1.00 
                 41.64 
                 O 
               
               
                 ATOM 
                 432 
                 CB 
                 VAL 
                 A 
                 56 
                 40.694 
                 26.430 
                 17.153 
                 1.00 
                 41.25 
                 C 
               
               
                 ATOM 
                 433 
                 CG1 
                 VAL 
                 A 
                 56 
                 39.609 
                 27.137 
                 17.971 
                 1.00 
                 41.73 
                 C 
               
               
                 ATOM 
                 434 
                 CG2 
                 VAL 
                 A 
                 56 
                 40.172 
                 26.028 
                 15.763 
                 1.00 
                 40.97 
                 C 
               
               
                 ATOM 
                 435 
                 N 
                 GLU 
                 A 
                 57 
                 43.409 
                 27.292 
                 15.105 
                 1.00 
                 40.96 
                 N 
               
               
                 ATOM 
                 436 
                 CA 
                 GLU 
                 A 
                 57 
                 43.907 
                 27.802 
                 13.840 
                 1.00 
                 40.50 
                 C 
               
               
                 ATOM 
                 437 
                 C 
                 GLU 
                 A 
                 57 
                 43.551 
                 26.841 
                 12.720 
                 1.00 
                 40.33 
                 C 
               
               
                 ATOM 
                 438 
                 O 
                 GLU 
                 A 
                 57 
                 43.610 
                 25.629 
                 12.889 
                 1.00 
                 39.83 
                 O 
               
               
                 ATOM 
                 439 
                 CB 
                 GLU 
                 A 
                 57 
                 45.415 
                 27.998 
                 13.907 
                 1.00 
                 40.54 
                 C 
               
               
                 ATOM 
                 440 
                 CG 
                 GLU 
                 A 
                 57 
                 46.000 
                 28.762 
                 12.727 
                 1.00 
                 39.88 
                 C 
               
               
                 ATOM 
                 441 
                 CD 
                 GLU 
                 A 
                 57 
                 47.473 
                 28.469 
                 12.482 
                 1.00 
                 38.40 
                 C 
               
               
                 ATOM 
                 442 
                 OE1 
                 GLU 
                 A 
                 57 
                 48.114 
                 29.301 
                 11.801 
                 1.00 
                 38.52 
                 O 
               
               
                 ATOM 
                 443 
                 OE2 
                 GLU 
                 A 
                 57 
                 47.983 
                 27.414 
                 12.932 
                 1.00 
                 36.20 
                 O 
               
               
                 ATOM 
                 444 
                 N 
                 THR 
                 A 
                 58 
                 43.186 
                 27.423 
                 11.578 
                 1.00 
                 40.58 
                 N 
               
               
                 ATOM 
                 445 
                 CA 
                 THR 
                 A 
                 58 
                 42.790 
                 26.704 
                 10.378 
                 1.00 
                 40.61 
                 C 
               
               
                 ATOM 
                 446 
                 C 
                 THR 
                 A 
                 58 
                 43.598 
                 27.214 
                 9.204 
                 1.00 
                 40.52 
                 C 
               
               
                 ATOM 
                 447 
                 O 
                 THR 
                 A 
                 58 
                 43.541 
                 28.376 
                 8.894 
                 1.00 
                 40.83 
                 O 
               
               
                 ATOM 
                 448 
                 CB 
                 THR 
                 A 
                 58 
                 41.319 
                 26.947 
                 10.131 
                 1.00 
                 40.51 
                 C 
               
               
                 ATOM 
                 449 
                 OG1 
                 THR 
                 A 
                 58 
                 40.594 
                 26.653 
                 11.332 
                 1.00 
                 40.91 
                 O 
               
               
                 ATOM 
                 450 
                 CG2 
                 THR 
                 A 
                 58 
                 40.770 
                 25.955 
                 9.126 
                 1.00 
                 40.94 
                 C 
               
               
                 ATOM 
                 451 
                 N 
                 VAL 
                 A 
                 59 
                 44.354 
                 26.342 
                 8.559 
                 1.00 
                 40.88 
                 N 
               
               
                 ATOM 
                 452 
                 CA 
                 VAL 
                 A 
                 59 
                 45.209 
                 26.761 
                 7.469 
                 1.00 
                 41.62 
                 C 
               
               
                 ATOM 
                 453 
                 C 
                 VAL 
                 A 
                 59 
                 44.781 
                 26.118 
                 6.177 
                 1.00 
                 41.67 
                 C 
               
               
                 ATOM 
                 454 
                 O 
                 VAL 
                 A 
                 59 
                 44.760 
                 24.902 
                 6.034 
                 1.00 
                 40.44 
                 O 
               
               
                 ATOM 
                 455 
                 CB 
                 VAL 
                 A 
                 59 
                 46.709 
                 26.454 
                 7.729 
                 1.00 
                 42.11 
                 C 
               
               
                 ATOM 
                 456 
                 CG1 
                 VAL 
                 A 
                 59 
                 47.562 
                 26.709 
                 6.467 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 457 
                 CG2 
                 VAL 
                 A 
                 59 
                 47.238 
                 27.304 
                 8.895 
                 1.00 
                 42.97 
                 C 
               
               
                 ATOM 
                 458 
                 N 
                 ASN 
                 A 
                 60 
                 44.438 
                 26.981 
                 5.234 
                 1.00 
                 42.73 
                 N 
               
               
                 ATOM 
                 459 
                 CA 
                 ASN 
                 A 
                 60 
                 44.254 
                 26.580 
                 3.848 
                 1.00 
                 43.69 
                 C 
               
               
                 ATOM 
                 460 
                 C 
                 ASN 
                 A 
                 60 
                 45.350 
                 27.108 
                 2.904 
                 1.00 
                 44.08 
                 C 
               
               
                 ATOM 
                 461 
                 O 
                 ASN 
                 A 
                 60 
                 45.186 
                 28.134 
                 2.225 
                 1.00 
                 44.00 
                 O 
               
               
                 ATOM 
                 462 
                 CB 
                 ASN 
                 A 
                 60 
                 42.850 
                 26.963 
                 3.411 
                 1.00 
                 43.92 
                 C 
               
               
                 ATOM 
                 463 
                 CG 
                 ASN 
                 A 
                 60 
                 41.801 
                 26.329 
                 4.299 
                 1.00 
                 44.18 
                 C 
               
               
                 ATOM 
                 464 
                 OD1 
                 ASN 
                 A 
                 60 
                 41.512 
                 25.128 
                 4.195 
                 1.00 
                 43.39 
                 O 
               
               
                 ATOM 
                 465 
                 ND2 
                 ASN 
                 A 
                 60 
                 41.270 
                 27.117 
                 5.219 
                 1.00 
                 44.84 
                 N 
               
               
                 ATOM 
                 466 
                 N 
                 LYS 
                 A 
                 61 
                 46.487 
                 26.399 
                 2.909 
                 1.00 
                 44.37 
                 N 
               
               
                 ATOM 
                 467 
                 CA 
                 LYS 
                 A 
                 61 
                 47.524 
                 26.609 
                 1.918 
                 1.00 
                 44.47 
                 C 
               
               
                 ATOM 
                 468 
                 C 
                 LYS 
                 A 
                 61 
                 46.898 
                 26.038 
                 0.671 
                 1.00 
                 44.64 
                 C 
               
               
                 ATOM 
                 469 
                 O 
                 LYS 
                 A 
                 61 
                 46.173 
                 25.035 
                 0.742 
                 1.00 
                 44.99 
                 O 
               
               
                 ATOM 
                 470 
                 CB 
                 LYS 
                 A 
                 61 
                 48.856 
                 25.930 
                 2.313 
                 1.00 
                 44.51 
                 C 
               
               
                 ATOM 
                 471 
                 CG 
                 LYS 
                 A 
                 61 
                 48.903 
                 24.387 
                 2.322 
                 1.00 
                 44.75 
                 C 
               
               
                 ATOM 
                 472 
                 CD 
                 LYS 
                 A 
                 61 
                 50.173 
                 23.793 
                 1.630 
                 1.00 
                 45.19 
                 C 
               
               
                 ATOM 
                 473 
                 CE 
                 LYS 
                 A 
                 61 
                 51.015 
                 22.846 
                 2.575 
                 1.00 
                 46.53 
                 C 
               
               
                 ATOM 
                 474 
                 NZ 
                 LYS 
                 A 
                 61 
                 50.959 
                 21.330 
                 2.328 
                 1.00 
                 45.04 
                 N 
               
               
                 ATOM 
                 475 
                 N 
                 GLY 
                 A 
                 62 
                 47.119 
                 26.692 
                 −0.457 
                 1.00 
                 44.60 
                 N 
               
               
                 ATOM 
                 476 
                 CA 
                 GLY 
                 A 
                 62 
                 46.387 
                 26.359 
                 −1.667 
                 1.00 
                 44.89 
                 C 
               
               
                 ATOM 
                 477 
                 C 
                 GLY 
                 A 
                 62 
                 45.563 
                 27.560 
                 −2.050 
                 1.00 
                 45.08 
                 C 
               
               
                 ATOM 
                 478 
                 O 
                 GLY 
                 A 
                 62 
                 45.623 
                 28.028 
                 −3.199 
                 1.00 
                 45.76 
                 O 
               
               
                 ATOM 
                 479 
                 N 
                 SER 
                 A 
                 63 
                 44.806 
                 28.073 
                 −1.079 
                 1.00 
                 44.83 
                 N 
               
               
                 ATOM 
                 480 
                 CA 
                 SER 
                 A 
                 63 
                 44.249 
                 29.417 
                 −1.186 
                 1.00 
                 44.31 
                 C 
               
               
                 ATOM 
                 481 
                 C 
                 SER 
                 A 
                 63 
                 45.076 
                 30.389 
                 −0.342 
                 1.00 
                 44.40 
                 C 
               
               
                 ATOM 
                 482 
                 O 
                 SER 
                 A 
                 63 
                 44.659 
                 31.524 
                 −0.106 
                 1.00 
                 45.19 
                 O 
               
               
                 ATOM 
                 483 
                 CB 
                 SER 
                 A 
                 63 
                 42.765 
                 29.447 
                 −0.796 
                 1.00 
                 43.91 
                 C 
               
               
                 ATOM 
                 484 
                 OG 
                 SER 
                 A 
                 63 
                 42.566 
                 29.106 
                 0.552 
                 1.00 
                 42.61 
                 O 
               
               
                 ATOM 
                 485 
                 N 
                 LYS 
                 A 
                 64 
                 46.252 
                 29.969 
                 0.114 
                 1.00 
                 44.25 
                 N 
               
               
                 ATOM 
                 486 
                 CA 
                 LYS 
                 A 
                 64 
                 47.113 
                 30.860 
                 0.890 
                 1.00 
                 44.38 
                 C 
               
               
                 ATOM 
                 487 
                 C 
                 LYS 
                 A 
                 64 
                 46.362 
                 31.577 
                 2.063 
                 1.00 
                 44.90 
                 C 
               
               
                 ATOM 
                 488 
                 O 
                 LYS 
                 A 
                 64 
                 46.748 
                 32.662 
                 2.520 
                 1.00 
                 44.39 
                 O 
               
               
                 ATOM 
                 489 
                 CB 
                 LYS 
                 A 
                 64 
                 47.771 
                 31.866 
                 −0.063 
                 1.00 
                 43.88 
                 C 
               
               
                 ATOM 
                 490 
                 CG 
                 LYS 
                 A 
                 64 
                 49.066 
                 31.391 
                 −0.649 
                 1.00 
                 43.04 
                 C 
               
               
                 ATOM 
                 491 
                 CD 
                 LYS 
                 A 
                 64 
                 49.237 
                 31.859 
                 −2.077 
                 1.00 
                 43.15 
                 C 
               
               
                 ATOM 
                 492 
                 CE 
                 LYS 
                 A 
                 64 
                 50.702 
                 31.983 
                 −2.440 
                 1.00 
                 43.42 
                 C 
               
               
                 ATOM 
                 493 
                 NZ 
                 LYS 
                 A 
                 64 
                 51.009 
                 31.656 
                 −3.874 
                 1.00 
                 43.88 
                 N 
               
               
                 ATOM 
                 494 
                 N 
                 SER 
                 A 
                 65 
                 45.296 
                 30.938 
                 2.545 
                 1.00 
                 45.34 
                 N 
               
               
                 ATOM 
                 495 
                 CA 
                 SER 
                 A 
                 65 
                 44.506 
                 31.436 
                 3.657 
                 1.00 
                 45.55 
                 C 
               
               
                 ATOM 
                 496 
                 C 
                 SER 
                 A 
                 65 
                 44.859 
                 30.722 
                 4.949 
                 1.00 
                 45.70 
                 C 
               
               
                 ATOM 
                 497 
                 O 
                 SER 
                 A 
                 65 
                 45.151 
                 29.524 
                 4.968 
                 1.00 
                 45.65 
                 O 
               
               
                 ATOM 
                 498 
                 CB 
                 SER 
                 A 
                 65 
                 43.043 
                 31.218 
                 3.368 
                 1.00 
                 45.66 
                 C 
               
               
                 ATOM 
                 499 
                 OG 
                 SER 
                 A 
                 65 
                 42.746 
                 31.666 
                 2.060 
                 1.00 
                 47.51 
                 O 
               
               
                 ATOM 
                 500 
                 N 
                 PHE 
                 A 
                 66 
                 44.879 
                 31.496 
                 6.022 
                 1.00 
                 46.04 
                 N 
               
               
                 ATOM 
                 501 
                 CA 
                 PHE 
                 A 
                 66 
                 44.975 
                 30.970 
                 7.373 
                 1.00 
                 46.46 
                 C 
               
               
                 ATOM 
                 502 
                 C 
                 PHE 
                 A 
                 66 
                 44.180 
                 31.868 
                 8.289 
                 1.00 
                 46.96 
                 C 
               
               
                 ATOM 
                 503 
                 O 
                 PHE 
                 A 
                 66 
                 43.821 
                 32.983 
                 7.917 
                 1.00 
                 47.34 
                 O 
               
               
                 ATOM 
                 504 
                 CB 
                 PHE 
                 A 
                 66 
                 46.418 
                 30.795 
                 7.864 
                 1.00 
                 46.58 
                 C 
               
               
                 ATOM 
                 505 
                 CG 
                 PHE 
                 A 
                 66 
                 47.295 
                 32.024 
                 7.739 
                 1.00 
                 46.03 
                 C 
               
               
                 ATOM 
                 506 
                 CD1 
                 PHE 
                 A 
                 66 
                 47.894 
                 32.562 
                 8.850 
                 1.00 
                 45.98 
                 C 
               
               
                 ATOM 
                 507 
                 CD2 
                 PHE 
                 A 
                 66 
                 47.593 
                 32.571 
                 6.502 
                 1.00 
                 45.65 
                 C 
               
               
                 ATOM 
                 508 
                 CE1 
                 PHE 
                 A 
                 66 
                 48.736 
                 33.644 
                 8.736 
                 1.00 
                 46.45 
                 C 
               
               
                 ATOM 
                 509 
                 CE2 
                 PHE 
                 A 
                 66 
                 48.420 
                 33.648 
                 6.387 
                 1.00 
                 46.28 
                 C 
               
               
                 ATOM 
                 510 
                 CZ 
                 PHE 
                 A 
                 66 
                 48.998 
                 34.190 
                 7.507 
                 1.00 
                 46.93 
                 C 
               
               
                 ATOM 
                 511 
                 N 
                 SER 
                 A 
                 67 
                 43.887 
                 31.362 
                 9.483 
                 1.00 
                 47.40 
                 N 
               
               
                 ATOM 
                 512 
                 CA 
                 SER 
                 A 
                 67 
                 42.797 
                 31.900 
                 10.301 
                 1.00 
                 47.25 
                 C 
               
               
                 ATOM 
                 513 
                 C 
                 SER 
                 A 
                 67 
                 42.861 
                 31.390 
                 11.738 
                 1.00 
                 47.20 
                 C 
               
               
                 ATOM 
                 514 
                 O 
                 SER 
                 A 
                 67 
                 43.245 
                 30.241 
                 12.007 
                 1.00 
                 46.85 
                 O 
               
               
                 ATOM 
                 515 
                 CB 
                 SER 
                 A 
                 67 
                 41.445 
                 31.534 
                 9.663 
                 1.00 
                 47.08 
                 C 
               
               
                 ATOM 
                 516 
                 OG 
                 SER 
                 A 
                 67 
                 40.452 
                 31.232 
                 10.624 
                 1.00 
                 46.69 
                 O 
               
               
                 ATOM 
                 517 
                 N 
                 LEU 
                 A 
                 68 
                 42.476 
                 32.272 
                 12.649 
                 1.00 
                 47.00 
                 N 
               
               
                 ATOM 
                 518 
                 CA 
                 LEU 
                 A 
                 68 
                 42.493 
                 31.990 
                 14.065 
                 1.00 
                 47.00 
                 C 
               
               
                 ATOM 
                 519 
                 C 
                 LEU 
                 A 
                 68 
                 41.130 
                 32.354 
                 14.616 
                 1.00 
                 47.52 
                 C 
               
               
                 ATOM 
                 520 
                 O 
                 LEU 
                 A 
                 68 
                 40.742 
                 33.530 
                 14.551 
                 1.00 
                 47.90 
                 O 
               
               
                 ATOM 
                 521 
                 CB 
                 LEU 
                 A 
                 68 
                 43.587 
                 32.842 
                 14.724 
                 1.00 
                 46.58 
                 C 
               
               
                 ATOM 
                 522 
                 CG 
                 LEU 
                 A 
                 68 
                 43.663 
                 32.936 
                 16.246 
                 1.00 
                 45.67 
                 C 
               
               
                 ATOM 
                 523 
                 CD1 
                 LEU 
                 A 
                 68 
                 44.187 
                 31.659 
                 16.863 
                 1.00 
                 44.93 
                 C 
               
               
                 ATOM 
                 524 
                 CD2 
                 LEU 
                 A 
                 68 
                 44.549 
                 34.085 
                 16.631 
                 1.00 
                 46.07 
                 C 
               
               
                 ATOM 
                 525 
                 N 
                 ARG 
                 A 
                 69 
                 40.394 
                 31.355 
                 15.124 
                 1.00 
                 47.58 
                 N 
               
               
                 ATOM 
                 526 
                 CA 
                 ARG 
                 A 
                 69 
                 39.227 
                 31.612 
                 15.975 
                 1.00 
                 47.49 
                 C 
               
               
                 ATOM 
                 527 
                 C 
                 ARG 
                 A 
                 69 
                 39.629 
                 31.518 
                 17.432 
                 1.00 
                 47.38 
                 C 
               
               
                 ATOM 
                 528 
                 O 
                 ARG 
                 A 
                 69 
                 40.130 
                 30.483 
                 17.850 
                 1.00 
                 46.69 
                 O 
               
               
                 ATOM 
                 529 
                 CB 
                 ARG 
                 A 
                 69 
                 38.084 
                 30.631 
                 15.698 
                 1.00 
                 47.74 
                 C 
               
               
                 ATOM 
                 530 
                 CG 
                 ARG 
                 A 
                 69 
                 36.735 
                 31.107 
                 16.207 
                 1.00 
                 48.05 
                 C 
               
               
                 ATOM 
                 531 
                 CD 
                 ARG 
                 A 
                 69 
                 35.559 
                 30.284 
                 15.720 
                 1.00 
                 50.06 
                 C 
               
               
                 ATOM 
                 532 
                 NE 
                 ARG 
                 A 
                 69 
                 34.814 
                 29.685 
                 16.848 
                 1.00 
                 52.61 
                 N 
               
               
                 ATOM 
                 533 
                 CZ 
                 ARG 
                 A 
                 69 
                 33.507 
                 29.870 
                 17.130 
                 1.00 
                 52.39 
                 C 
               
               
                 ATOM 
                 534 
                 NH1 
                 ARG 
                 A 
                 69 
                 32.724 
                 30.653 
                 16.378 
                 1.00 
                 52.14 
                 N 
               
               
                 ATOM 
                 535 
                 NH2 
                 ARG 
                 A 
                 69 
                 32.982 
                 29.261 
                 18.189 
                 1.00 
                 51.54 
                 N 
               
               
                 ATOM 
                 536 
                 N 
                 ILE 
                 A 
                 70 
                 39.427 
                 32.603 
                 18.187 
                 1.00 
                 47.73 
                 N 
               
               
                 ATOM 
                 537 
                 CA 
                 ILE 
                 A 
                 70 
                 39.636 
                 32.606 
                 19.643 
                 1.00 
                 48.12 
                 C 
               
               
                 ATOM 
                 538 
                 C 
                 ILE 
                 A 
                 70 
                 38.291 
                 32.469 
                 20.350 
                 1.00 
                 48.27 
                 C 
               
               
                 ATOM 
                 539 
                 O 
                 ILE 
                 A 
                 70 
                 37.476 
                 33.380 
                 20.289 
                 1.00 
                 48.45 
                 O 
               
               
                 ATOM 
                 540 
                 CB 
                 ILE 
                 A 
                 70 
                 40.311 
                 33.899 
                 20.149 
                 1.00 
                 48.01 
                 C 
               
               
                 ATOM 
                 541 
                 CG1 
                 ILE 
                 A 
                 70 
                 41.379 
                 34.400 
                 19.189 
                 1.00 
                 48.22 
                 C 
               
               
                 ATOM 
                 542 
                 CG2 
                 ILE 
                 A 
                 70 
                 40.912 
                 33.652 
                 21.524 
                 1.00 
                 47.97 
                 C 
               
               
                 ATOM 
                 543 
                 CD1 
                 ILE 
                 A 
                 70 
                 41.707 
                 35.866 
                 19.402 
                 1.00 
                 49.26 
                 C 
               
               
                 ATOM 
                 544 
                 N 
                 ARG 
                 A 
                 71 
                 38.091 
                 31.353 
                 21.048 
                 1.00 
                 48.47 
                 N 
               
               
                 ATOM 
                 545 
                 CA 
                 ARG 
                 A 
                 71 
                 36.793 
                 30.972 
                 21.600 
                 1.00 
                 48.71 
                 C 
               
               
                 ATOM 
                 546 
                 C 
                 ARG 
                 A 
                 71 
                 36.670 
                 31.511 
                 22.987 
                 1.00 
                 48.26 
                 C 
               
               
                 ATOM 
                 547 
                 O 
                 ARG 
                 A 
                 71 
                 37.671 
                 31.684 
                 23.675 
                 1.00 
                 48.07 
                 O 
               
               
                 ATOM 
                 548 
                 CB 
                 ARG 
                 A 
                 71 
                 36.661 
                 29.448 
                 21.702 
                 1.00 
                 49.15 
                 C 
               
               
                 ATOM 
                 549 
                 CG 
                 ARG 
                 A 
                 71 
                 36.940 
                 28.673 
                 20.415 
                 1.00 
                 51.24 
                 C 
               
               
                 ATOM 
                 550 
                 CD 
                 ARG 
                 A 
                 71 
                 37.414 
                 27.240 
                 20.664 
                 1.00 
                 53.73 
                 C 
               
               
                 ATOM 
                 551 
                 NE 
                 ARG 
                 A 
                 71 
                 36.868 
                 26.293 
                 19.682 
                 1.00 
                 56.03 
                 N 
               
               
                 ATOM 
                 552 
                 CZ 
                 ARG 
                 A 
                 71 
                 36.941 
                 24.966 
                 19.790 
                 1.00 
                 56.30 
                 C 
               
               
                 ATOM 
                 553 
                 NH1 
                 ARG 
                 A 
                 71 
                 36.417 
                 24.190 
                 18.841 
                 1.00 
                 56.29 
                 N 
               
               
                 ATOM 
                 554 
                 NH2 
                 ARG 
                 A 
                 71 
                 37.542 
                 24.412 
                 20.838 
                 1.00 
                 56.89 
                 N 
               
               
                 ATOM 
                 555 
                 N 
                 ASP 
                 A 
                 72 
                 35.435 
                 31.734 
                 23.416 
                 1.00 
                 48.12 
                 N 
               
               
                 ATOM 
                 556 
                 CA 
                 ASP 
                 A 
                 72 
                 35.173 
                 32.117 
                 24.795 
                 1.00 
                 48.04 
                 C 
               
               
                 ATOM 
                 557 
                 C 
                 ASP 
                 A 
                 72 
                 36.106 
                 33.276 
                 25.179 
                 1.00 
                 47.53 
                 C 
               
               
                 ATOM 
                 558 
                 O 
                 ASP 
                 A 
                 72 
                 37.067 
                 33.104 
                 25.928 
                 1.00 
                 47.76 
                 O 
               
               
                 ATOM 
                 559 
                 CB 
                 ASP 
                 A 
                 72 
                 35.350 
                 30.890 
                 25.705 
                 1.00 
                 48.14 
                 C 
               
               
                 ATOM 
                 560 
                 CG 
                 ASP 
                 A 
                 72 
                 35.188 
                 31.210 
                 27.176 
                 1.00 
                 49.09 
                 C 
               
               
                 ATOM 
                 561 
                 OD1 
                 ASP 
                 A 
                 72 
                 34.318 
                 32.035 
                 27.531 
                 1.00 
                 51.07 
                 O 
               
               
                 ATOM 
                 562 
                 OD2 
                 ASP 
                 A 
                 72 
                 35.891 
                 30.667 
                 28.051 
                 1.00 
                 49.87 
                 O 
               
               
                 ATOM 
                 563 
                 N 
                 LEU 
                 A 
                 73 
                 35.810 
                 34.456 
                 24.646 
                 1.00 
                 46.77 
                 N 
               
               
                 ATOM 
                 564 
                 CA 
                 LEU 
                 A 
                 73 
                 36.660 
                 35.618 
                 24.835 
                 1.00 
                 46.24 
                 C 
               
               
                 ATOM 
                 565 
                 C 
                 LEU 
                 A 
                 73 
                 36.615 
                 36.074 
                 26.282 
                 1.00 
                 45.94 
                 C 
               
               
                 ATOM 
                 566 
                 O 
                 LEU 
                 A 
                 73 
                 35.542 
                 36.191 
                 26.874 
                 1.00 
                 45.87 
                 O 
               
               
                 ATOM 
                 567 
                 CB 
                 LEU 
                 A 
                 73 
                 36.222 
                 36.772 
                 23.939 
                 1.00 
                 46.11 
                 C 
               
               
                 ATOM 
                 568 
                 CG 
                 LEU 
                 A 
                 73 
                 36.560 
                 36.698 
                 22.459 
                 1.00 
                 45.54 
                 C 
               
               
                 ATOM 
                 569 
                 CD1 
                 LEU 
                 A 
                 73 
                 35.845 
                 37.825 
                 21.761 
                 1.00 
                 45.64 
                 C 
               
               
                 ATOM 
                 570 
                 CD2 
                 LEU 
                 A 
                 73 
                 38.049 
                 36.783 
                 22.216 
                 1.00 
                 45.68 
                 C 
               
               
                 ATOM 
                 571 
                 N 
                 ARG 
                 A 
                 74 
                 37.794 
                 36.314 
                 26.843 
                 1.00 
                 45.60 
                 N 
               
               
                 ATOM 
                 572 
                 CA 
                 ARG 
                 A 
                 74 
                 37.927 
                 36.893 
                 28.175 
                 1.00 
                 45.37 
                 C 
               
               
                 ATOM 
                 573 
                 C 
                 ARG 
                 A 
                 74 
                 38.273 
                 38.376 
                 28.000 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 574 
                 O 
                 ARG 
                 A 
                 74 
                 38.583 
                 38.817 
                 26.891 
                 1.00 
                 44.82 
                 O 
               
               
                 ATOM 
                 575 
                 CB 
                 ARG 
                 A 
                 74 
                 39.010 
                 36.146 
                 28.980 
                 1.00 
                 45.33 
                 C 
               
               
                 ATOM 
                 576 
                 CG 
                 ARG 
                 A 
                 74 
                 38.584 
                 34.734 
                 29.475 
                 1.00 
                 45.30 
                 C 
               
               
                 ATOM 
                 577 
                 CD 
                 ARG 
                 A 
                 74 
                 39.360 
                 33.541 
                 28.851 
                 1.00 
                 44.76 
                 C 
               
               
                 ATOM 
                 578 
                 NE 
                 ARG 
                 A 
                 74 
                 38.631 
                 32.259 
                 28.955 
                 1.00 
                 43.64 
                 N 
               
               
                 ATOM 
                 579 
                 CZ 
                 ARG 
                 A 
                 74 
                 39.075 
                 31.144 
                 29.556 
                 1.00 
                 42.68 
                 C 
               
               
                 ATOM 
                 580 
                 NH1 
                 ARG 
                 A 
                 74 
                 38.322 
                 30.052 
                 29.576 
                 1.00 
                 42.05 
                 N 
               
               
                 ATOM 
                 581 
                 NH2 
                 ARG 
                 A 
                 74 
                 40.266 
                 31.094 
                 30.134 
                 1.00 
                 42.74 
                 N 
               
               
                 ATOM 
                 582 
                 N 
                 VAL 
                 A 
                 75 
                 38.209 
                 39.146 
                 29.079 
                 1.00 
                 44.67 
                 N 
               
               
                 ATOM 
                 583 
                 CA 
                 VAL 
                 A 
                 75 
                 38.682 
                 40.533 
                 29.036 
                 1.00 
                 44.47 
                 C 
               
               
                 ATOM 
                 584 
                 C 
                 VAL 
                 A 
                 75 
                 40.205 
                 40.543 
                 28.869 
                 1.00 
                 44.30 
                 C 
               
               
                 ATOM 
                 585 
                 O 
                 VAL 
                 A 
                 75 
                 40.744 
                 41.405 
                 28.175 
                 1.00 
                 44.10 
                 O 
               
               
                 ATOM 
                 586 
                 CB 
                 VAL 
                 A 
                 75 
                 38.319 
                 41.335 
                 30.307 
                 1.00 
                 44.42 
                 C 
               
               
                 ATOM 
                 587 
                 CG1 
                 VAL 
                 A 
                 75 
                 38.693 
                 42.808 
                 30.125 
                 1.00 
                 44.06 
                 C 
               
               
                 ATOM 
                 588 
                 CG2 
                 VAL 
                 A 
                 75 
                 36.833 
                 41.170 
                 30.660 
                 1.00 
                 44.41 
                 C 
               
               
                 ATOM 
                 589 
                 N 
                 GLU 
                 A 
                 76 
                 40.873 
                 39.573 
                 29.514 
                 1.00 
                 44.03 
                 N 
               
               
                 ATOM 
                 590 
                 CA 
                 GLU 
                 A 
                 76 
                 42.327 
                 39.344 
                 29.397 
                 1.00 
                 43.64 
                 C 
               
               
                 ATOM 
                 591 
                 C 
                 GLU 
                 A 
                 76 
                 42.840 
                 39.312 
                 27.962 
                 1.00 
                 43.24 
                 C 
               
               
                 ATOM 
                 592 
                 O 
                 GLU 
                 A 
                 76 
                 44.036 
                 39.503 
                 27.733 
                 1.00 
                 42.95 
                 O 
               
               
                 ATOM 
                 593 
                 CB 
                 GLU 
                 A 
                 76 
                 42.726 
                 38.014 
                 30.062 
                 1.00 
                 43.51 
                 C 
               
               
                 ATOM 
                 594 
                 CG 
                 GLU 
                 A 
                 76 
                 43.101 
                 38.123 
                 31.531 
                 1.00 
                 43.72 
                 C 
               
               
                 ATOM 
                 595 
                 CD 
                 GLU 
                 A 
                 76 
                 44.528 
                 38.599 
                 31.769 
                 1.00 
                 43.87 
                 C 
               
               
                 ATOM 
                 596 
                 OE1 
                 GLU 
                 A 
                 76 
                 45.099 
                 38.292 
                 32.839 
                 1.00 
                 43.97 
                 O 
               
               
                 ATOM 
                 597 
                 OE2 
                 GLU 
                 A 
                 76 
                 45.085 
                 39.296 
                 30.904 
                 1.00 
                 44.56 
                 O 
               
               
                 ATOM 
                 598 
                 N 
                 ASP 
                 A 
                 77 
                 41.934 
                 39.055 
                 27.018 
                 1.00 
                 42.97 
                 N 
               
               
                 ATOM 
                 599 
                 CA 
                 ASP 
                 A 
                 77 
                 42.277 
                 38.875 
                 25.609 
                 1.00 
                 42.98 
                 C 
               
               
                 ATOM 
                 600 
                 C 
                 ASP 
                 A 
                 77 
                 42.373 
                 40.157 
                 24.790 
                 1.00 
                 42.77 
                 C 
               
               
                 ATOM 
                 601 
                 O 
                 ASP 
                 A 
                 77 
                 42.913 
                 40.136 
                 23.703 
                 1.00 
                 42.39 
                 O 
               
               
                 ATOM 
                 602 
                 CB 
                 ASP 
                 A 
                 77 
                 41.279 
                 37.912 
                 24.954 
                 1.00 
                 43.02 
                 C 
               
               
                 ATOM 
                 603 
                 CG 
                 ASP 
                 A 
                 77 
                 41.334 
                 36.537 
                 25.560 
                 1.00 
                 43.11 
                 C 
               
               
                 ATOM 
                 604 
                 OD1 
                 ASP 
                 A 
                 77 
                 42.385 
                 36.208 
                 26.154 
                 1.00 
                 43.48 
                 O 
               
               
                 ATOM 
                 605 
                 OD2 
                 ASP 
                 A 
                 77 
                 40.386 
                 35.725 
                 25.510 
                 1.00 
                 43.48 
                 O 
               
               
                 ATOM 
                 606 
                 N 
                 SER 
                 A 
                 78 
                 41.859 
                 41.263 
                 25.304 
                 1.00 
                 43.07 
                 N 
               
               
                 ATOM 
                 607 
                 CA 
                 SER 
                 A 
                 78 
                 41.994 
                 42.532 
                 24.613 
                 1.00 
                 43.54 
                 C 
               
               
                 ATOM 
                 608 
                 C 
                 SER 
                 A 
                 78 
                 43.462 
                 42.791 
                 24.304 
                 1.00 
                 44.00 
                 C 
               
               
                 ATOM 
                 609 
                 O 
                 SER 
                 A 
                 78 
                 44.327 
                 42.631 
                 25.167 
                 1.00 
                 43.80 
                 O 
               
               
                 ATOM 
                 610 
                 CB 
                 SER 
                 A 
                 78 
                 41.445 
                 43.691 
                 25.441 
                 1.00 
                 43.62 
                 C 
               
               
                 ATOM 
                 611 
                 OG 
                 SER 
                 A 
                 78 
                 40.216 
                 43.356 
                 26.048 
                 1.00 
                 44.60 
                 O 
               
               
                 ATOM 
                 612 
                 N 
                 GLY 
                 A 
                 79 
                 43.715 
                 43.187 
                 23.058 
                 1.00 
                 44.73 
                 N 
               
               
                 ATOM 
                 613 
                 CA 
                 GLY 
                 A 
                 79 
                 45.050 
                 43.480 
                 22.558 
                 1.00 
                 45.12 
                 C 
               
               
                 ATOM 
                 614 
                 C 
                 GLY 
                 A 
                 79 
                 45.102 
                 43.517 
                 21.037 
                 1.00 
                 45.35 
                 C 
               
               
                 ATOM 
                 615 
                 O 
                 GLY 
                 A 
                 79 
                 44.062 
                 43.549 
                 20.369 
                 1.00 
                 45.53 
                 O 
               
               
                 ATOM 
                 616 
                 N 
                 THR 
                 A 
                 80 
                 46.317 
                 43.496 
                 20.492 
                 1.00 
                 45.41 
                 N 
               
               
                 ATOM 
                 617 
                 CA 
                 THR 
                 A 
                 80 
                 46.524 
                 43.585 
                 19.054 
                 1.00 
                 45.52 
                 C 
               
               
                 ATOM 
                 618 
                 C 
                 THR 
                 A 
                 80 
                 47.169 
                 42.327 
                 18.490 
                 1.00 
                 45.73 
                 C 
               
               
                 ATOM 
                 619 
                 O 
                 THR 
                 A 
                 80 
                 48.314 
                 42.017 
                 18.796 
                 1.00 
                 45.71 
                 O 
               
               
                 ATOM 
                 620 
                 CB 
                 THR 
                 A 
                 80 
                 47.366 
                 44.798 
                 18.741 
                 1.00 
                 45.47 
                 C 
               
               
                 ATOM 
                 621 
                 OG1 
                 THR 
                 A 
                 80 
                 46.544 
                 45.965 
                 18.844 
                 1.00 
                 45.71 
                 O 
               
               
                 ATOM 
                 622 
                 CG2 
                 THR 
                 A 
                 80 
                 47.818 
                 44.794 
                 17.300 
                 1.00 
                 45.82 
                 C 
               
               
                 ATOM 
                 623 
                 N 
                 TYR 
                 A 
                 81 
                 46.416 
                 41.641 
                 17.632 
                 1.00 
                 46.25 
                 N 
               
               
                 ATOM 
                 624 
                 CA 
                 TYR 
                 A 
                 81 
                 46.764 
                 40.329 
                 17.103 
                 1.00 
                 46.37 
                 C 
               
               
                 ATOM 
                 625 
                 C 
                 TYR 
                 A 
                 81 
                 47.323 
                 40.466 
                 15.717 
                 1.00 
                 46.94 
                 C 
               
               
                 ATOM 
                 626 
                 O 
                 TYR 
                 A 
                 81 
                 46.771 
                 41.180 
                 14.900 
                 1.00 
                 46.88 
                 O 
               
               
                 ATOM 
                 627 
                 CB 
                 TYR 
                 A 
                 81 
                 45.528 
                 39.444 
                 17.046 
                 1.00 
                 46.07 
                 C 
               
               
                 ATOM 
                 628 
                 CG 
                 TYR 
                 A 
                 81 
                 44.964 
                 39.157 
                 18.407 
                 1.00 
                 45.69 
                 C 
               
               
                 ATOM 
                 629 
                 CD1 
                 TYR 
                 A 
                 81 
                 45.211 
                 37.938 
                 19.033 
                 1.00 
                 45.97 
                 C 
               
               
                 ATOM 
                 630 
                 CD2 
                 TYR 
                 A 
                 81 
                 44.203 
                 40.109 
                 19.089 
                 1.00 
                 45.33 
                 C 
               
               
                 ATOM 
                 631 
                 CE1 
                 TYR 
                 A 
                 81 
                 44.705 
                 37.660 
                 20.297 
                 1.00 
                 45.78 
                 C 
               
               
                 ATOM 
                 632 
                 CE2 
                 TYR 
                 A 
                 81 
                 43.700 
                 39.843 
                 20.354 
                 1.00 
                 45.41 
                 C 
               
               
                 ATOM 
                 633 
                 CZ 
                 TYR 
                 A 
                 81 
                 43.955 
                 38.618 
                 20.947 
                 1.00 
                 45.24 
                 C 
               
               
                 ATOM 
                 634 
                 OH 
                 TYR 
                 A 
                 81 
                 43.477 
                 38.341 
                 22.195 
                 1.00 
                 45.03 
                 O 
               
               
                 ATOM 
                 635 
                 N 
                 LYS 
                 A 
                 82 
                 48.429 
                 39.779 
                 15.464 
                 1.00 
                 47.75 
                 N 
               
               
                 ATOM 
                 636 
                 CA 
                 LYS 
                 A 
                 82 
                 49.024 
                 39.725 
                 14.140 
                 1.00 
                 48.32 
                 C 
               
               
                 ATOM 
                 637 
                 C 
                 LYS 
                 A 
                 82 
                 49.286 
                 38.281 
                 13.752 
                 1.00 
                 48.72 
                 C 
               
               
                 ATOM 
                 638 
                 O 
                 LYS 
                 A 
                 82 
                 49.633 
                 37.451 
                 14.579 
                 1.00 
                 48.30 
                 O 
               
               
                 ATOM 
                 639 
                 CB 
                 LYS 
                 A 
                 82 
                 50.311 
                 40.541 
                 14.073 
                 1.00 
                 48.32 
                 C 
               
               
                 ATOM 
                 640 
                 CG 
                 LYS 
                 A 
                 82 
                 50.043 
                 42.030 
                 13.997 
                 1.00 
                 48.91 
                 C 
               
               
                 ATOM 
                 641 
                 CD 
                 LYS 
                 A 
                 82 
                 51.254 
                 42.821 
                 14.378 
                 1.00 
                 50.39 
                 C 
               
               
                 ATOM 
                 642 
                 CE 
                 LYS 
                 A 
                 82 
                 50.900 
                 44.278 
                 14.589 
                 1.00 
                 52.20 
                 C 
               
               
                 ATOM 
                 643 
                 NZ 
                 LYS 
                 A 
                 82 
                 51.775 
                 44.922 
                 15.629 
                 1.00 
                 53.56 
                 N 
               
               
                 ATOM 
                 644 
                 N 
                 CYS 
                 A 
                 83 
                 49.074 
                 37.995 
                 12.475 
                 1.00 
                 49.15 
                 N 
               
               
                 ATOM 
                 645 
                 CA 
                 CYS 
                 A 
                 83 
                 49.442 
                 36.717 
                 11.920 
                 1.00 
                 49.17 
                 C 
               
               
                 ATOM 
                 646 
                 C 
                 CYS 
                 A 
                 83 
                 50.727 
                 36.864 
                 11.140 
                 1.00 
                 49.28 
                 C 
               
               
                 ATOM 
                 647 
                 O 
                 CYS 
                 A 
                 83 
                 51.136 
                 37.983 
                 10.811 
                 1.00 
                 49.33 
                 O 
               
               
                 ATOM 
                 648 
                 CB 
                 CYS 
                 A 
                 83 
                 48.351 
                 36.228 
                 11.017 
                 1.00 
                 49.00 
                 C 
               
               
                 ATOM 
                 649 
                 SG 
                 CYS 
                 A 
                 83 
                 48.139 
                 37.232 
                 9.569 
                 1.00 
                 49.18 
                 S 
               
               
                 ATOM 
                 650 
                 N 
                 GLY 
                 A 
                 84 
                 51.341 
                 35.724 
                 10.836 
                 1.00 
                 49.33 
                 N 
               
               
                 ATOM 
                 651 
                 CA 
                 GLY 
                 A 
                 84 
                 52.629 
                 35.673 
                 10.166 
                 1.00 
                 49.19 
                 C 
               
               
                 ATOM 
                 652 
                 C 
                 GLY 
                 A 
                 84 
                 52.664 
                 34.559 
                 9.141 
                 1.00 
                 49.12 
                 C 
               
               
                 ATOM 
                 653 
                 O 
                 GLY 
                 A 
                 84 
                 52.266 
                 33.442 
                 9.430 
                 1.00 
                 49.28 
                 O 
               
               
                 ATOM 
                 654 
                 N 
                 ALA 
                 A 
                 85 
                 53.114 
                 34.862 
                 7.935 
                 1.00 
                 49.01 
                 N 
               
               
                 ATOM 
                 655 
                 CA 
                 ALA 
                 A 
                 85 
                 53.339 
                 33.844 
                 6.937 
                 1.00 
                 49.26 
                 C 
               
               
                 ATOM 
                 656 
                 C 
                 ALA 
                 A 
                 85 
                 54.841 
                 33.726 
                 6.775 
                 1.00 
                 49.76 
                 C 
               
               
                 ATOM 
                 657 
                 O 
                 ALA 
                 A 
                 85 
                 55.508 
                 34.740 
                 6.569 
                 1.00 
                 49.89 
                 O 
               
               
                 ATOM 
                 658 
                 CB 
                 ALA 
                 A 
                 85 
                 52.687 
                 34.240 
                 5.632 
                 1.00 
                 49.16 
                 C 
               
               
                 ATOM 
                 659 
                 N 
                 PHE 
                 A 
                 86 
                 55.369 
                 32.504 
                 6.901 
                 1.00 
                 50.29 
                 N 
               
               
                 ATOM 
                 660 
                 CA 
                 PHE 
                 A 
                 86 
                 56.787 
                 32.209 
                 6.632 
                 1.00 
                 50.83 
                 C 
               
               
                 ATOM 
                 661 
                 C 
                 PHE 
                 A 
                 86 
                 56.962 
                 31.172 
                 5.505 
                 1.00 
                 51.30 
                 C 
               
               
                 ATOM 
                 662 
                 O 
                 PHE 
                 A 
                 86 
                 56.044 
                 30.388 
                 5.203 
                 1.00 
                 51.47 
                 O 
               
               
                 ATOM 
                 663 
                 CB 
                 PHE 
                 A 
                 86 
                 57.500 
                 31.686 
                 7.874 
                 1.00 
                 50.78 
                 C 
               
               
                 ATOM 
                 664 
                 CG 
                 PHE 
                 A 
                 86 
                 57.296 
                 32.520 
                 9.099 
                 1.00 
                 51.53 
                 C 
               
               
                 ATOM 
                 665 
                 CD1 
                 PHE 
                 A 
                 86 
                 58.337 
                 33.299 
                 9.603 
                 1.00 
                 52.02 
                 C 
               
               
                 ATOM 
                 666 
                 CD2 
                 PHE 
                 A 
                 86 
                 56.073 
                 32.502 
                 9.777 
                 1.00 
                 52.06 
                 C 
               
               
                 ATOM 
                 667 
                 CE1 
                 PHE 
                 A 
                 86 
                 58.158 
                 34.064 
                 10.757 
                 1.00 
                 52.26 
                 C 
               
               
                 ATOM 
                 668 
                 CE2 
                 PHE 
                 A 
                 86 
                 55.876 
                 33.270 
                 10.928 
                 1.00 
                 52.10 
                 C 
               
               
                 ATOM 
                 669 
                 CZ 
                 PHE 
                 A 
                 86 
                 56.920 
                 34.056 
                 11.417 
                 1.00 
                 52.60 
                 C 
               
               
                 ATOM 
                 670 
                 N 
                 ARG 
                 A 
                 87 
                 58.163 
                 31.168 
                 4.915 
                 1.00 
                 51.82 
                 N 
               
               
                 ATOM 
                 671 
                 CA 
                 ARG 
                 A 
                 87 
                 58.515 
                 30.298 
                 3.781 
                 1.00 
                 51.91 
                 C 
               
               
                 ATOM 
                 672 
                 C 
                 ARG 
                 A 
                 87 
                 59.001 
                 28.925 
                 4.242 
                 1.00 
                 51.90 
                 C 
               
               
                 ATOM 
                 673 
                 O 
                 ARG 
                 A 
                 87 
                 58.918 
                 27.952 
                 3.493 
                 1.00 
                 51.72 
                 O 
               
               
                 ATOM 
                 674 
                 CB 
                 ARG 
                 A 
                 87 
                 59.609 
                 30.946 
                 2.925 
                 1.00 
                 51.90 
                 C 
               
               
                 ATOM 
                 675 
                 CG 
                 ARG 
                 A 
                 87 
                 59.285 
                 31.033 
                 1.440 
                 1.00 
                 52.27 
                 C 
               
               
                 ATOM 
                 676 
                 CD 
                 ARG 
                 A 
                 87 
                 59.985 
                 32.196 
                 0.751 
                 1.00 
                 52.53 
                 C 
               
               
                 ATOM 
                 677 
                 NE 
                 ARG 
                 A 
                 87 
                 59.902 
                 32.136 
                 −0.707 
                 1.00 
                 53.38 
                 N 
               
               
                 ATOM 
                 678 
                 CZ 
                 ARG 
                 A 
                 87 
                 60.590 
                 31.293 
                 −1.486 
                 1.00 
                 54.43 
                 C 
               
               
                 ATOM 
                 679 
                 NH1 
                 ARG 
                 A 
                 87 
                 60.423 
                 31.344 
                 −2.809 
                 1.00 
                 54.34 
                 N 
               
               
                 ATOM 
                 680 
                 NH2 
                 ARG 
                 A 
                 87 
                 61.453 
                 30.411 
                 −0.969 
                 1.00 
                 54.98 
                 N 
               
               
                 ATOM 
                 681 
                 N 
                 LEU 
                 A 
                 99 
                 62.366 
                 34.803 
                 7.148 
                 1.00 
                 48.13 
                 N 
               
               
                 ATOM 
                 682 
                 CA 
                 LEU 
                 A 
                 99 
                 61.580 
                 35.970 
                 6.729 
                 1.00 
                 48.11 
                 C 
               
               
                 ATOM 
                 683 
                 C 
                 LEU 
                 A 
                 99 
                 60.051 
                 35.873 
                 6.978 
                 1.00 
                 47.80 
                 C 
               
               
                 ATOM 
                 684 
                 O 
                 LEU 
                 A 
                 99 
                 59.295 
                 35.253 
                 6.215 
                 1.00 
                 47.42 
                 O 
               
               
                 ATOM 
                 685 
                 CB 
                 LEU 
                 A 
                 99 
                 61.848 
                 36.317 
                 5.256 
                 1.00 
                 48.34 
                 C 
               
               
                 ATOM 
                 686 
                 CG 
                 LEU 
                 A 
                 99 
                 61.841 
                 35.196 
                 4.211 
                 1.00 
                 48.54 
                 C 
               
               
                 ATOM 
                 687 
                 CD1 
                 LEU 
                 A 
                 99 
                 60.746 
                 35.451 
                 3.132 
                 1.00 
                 48.20 
                 C 
               
               
                 ATOM 
                 688 
                 CD2 
                 LEU 
                 A 
                 99 
                 63.255 
                 35.054 
                 3.600 
                 1.00 
                 47.97 
                 C 
               
               
                 ATOM 
                 689 
                 N 
                 SER 
                 A 
                 100 
                 59.641 
                 36.505 
                 8.076 
                 1.00 
                 47.37 
                 N 
               
               
                 ATOM 
                 690 
                 CA 
                 SER 
                 A 
                 100 
                 58.263 
                 36.875 
                 8.346 
                 1.00 
                 47.04 
                 C 
               
               
                 ATOM 
                 691 
                 C 
                 SER 
                 A 
                 100 
                 57.684 
                 37.768 
                 7.233 
                 1.00 
                 46.75 
                 C 
               
               
                 ATOM 
                 692 
                 O 
                 SER 
                 A 
                 100 
                 58.413 
                 38.487 
                 6.570 
                 1.00 
                 46.99 
                 O 
               
               
                 ATOM 
                 693 
                 CB 
                 SER 
                 A 
                 100 
                 58.229 
                 37.667 
                 9.673 
                 1.00 
                 46.92 
                 C 
               
               
                 ATOM 
                 694 
                 OG 
                 SER 
                 A 
                 100 
                 57.110 
                 37.317 
                 10.475 
                 1.00 
                 47.46 
                 O 
               
               
                 ATOM 
                 695 
                 N 
                 GLU 
                 A 
                 101 
                 56.376 
                 37.721 
                 7.023 
                 1.00 
                 46.31 
                 N 
               
               
                 ATOM 
                 696 
                 CA 
                 GLU 
                 A 
                 101 
                 55.660 
                 38.937 
                 6.639 
                 1.00 
                 46.11 
                 C 
               
               
                 ATOM 
                 697 
                 C 
                 GLU 
                 A 
                 101 
                 54.328 
                 38.924 
                 7.349 
                 1.00 
                 44.85 
                 C 
               
               
                 ATOM 
                 698 
                 O 
                 GLU 
                 A 
                 101 
                 53.675 
                 37.918 
                 7.372 
                 1.00 
                 44.33 
                 O 
               
               
                 ATOM 
                 699 
                 CB 
                 GLU 
                 A 
                 101 
                 55.524 
                 39.113 
                 5.132 
                 1.00 
                 46.54 
                 C 
               
               
                 ATOM 
                 700 
                 CG 
                 GLU 
                 A 
                 101 
                 54.675 
                 38.081 
                 4.410 
                 1.00 
                 49.34 
                 C 
               
               
                 ATOM 
                 701 
                 CD 
                 GLU 
                 A 
                 101 
                 55.438 
                 37.372 
                 3.300 
                 1.00 
                 52.97 
                 C 
               
               
                 ATOM 
                 702 
                 OE1 
                 GLU 
                 A 
                 101 
                 55.890 
                 38.064 
                 2.356 
                 1.00 
                 55.23 
                 O 
               
               
                 ATOM 
                 703 
                 OE2 
                 GLU 
                 A 
                 101 
                 55.598 
                 36.123 
                 3.376 
                 1.00 
                 55.84 
                 O 
               
               
                 ATOM 
                 704 
                 N 
                 LYS 
                 A 
                 102 
                 53.950 
                 40.050 
                 7.939 
                 1.00 
                 44.25 
                 N 
               
               
                 ATOM 
                 705 
                 CA 
                 LYS 
                 A 
                 102 
                 52.908 
                 40.088 
                 8.953 
                 1.00 
                 43.97 
                 C 
               
               
                 ATOM 
                 706 
                 C 
                 LYS 
                 A 
                 102 
                 51.747 
                 41.024 
                 8.619 
                 1.00 
                 43.73 
                 C 
               
               
                 ATOM 
                 707 
                 O 
                 LYS 
                 A 
                 102 
                 51.950 
                 42.118 
                 8.109 
                 1.00 
                 43.86 
                 O 
               
               
                 ATOM 
                 708 
                 CB 
                 LYS 
                 A 
                 102 
                 53.548 
                 40.502 
                 10.279 
                 1.00 
                 44.02 
                 C 
               
               
                 ATOM 
                 709 
                 CG 
                 LYS 
                 A 
                 102 
                 54.611 
                 39.507 
                 10.770 
                 1.00 
                 44.31 
                 C 
               
               
                 ATOM 
                 710 
                 CD 
                 LYS 
                 A 
                 102 
                 54.571 
                 39.285 
                 12.286 
                 1.00 
                 44.93 
                 C 
               
               
                 ATOM 
                 711 
                 CE 
                 LYS 
                 A 
                 102 
                 54.919 
                 40.565 
                 13.066 
                 1.00 
                 45.78 
                 C 
               
               
                 ATOM 
                 712 
                 NZ 
                 LYS 
                 A 
                 102 
                 55.844 
                 40.345 
                 14.224 
                 1.00 
                 45.77 
                 N 
               
               
                 ATOM 
                 713 
                 N 
                 GLY 
                 A 
                 103 
                 50.523 
                 40.600 
                 8.923 
                 1.00 
                 43.50 
                 N 
               
               
                 ATOM 
                 714 
                 CA 
                 GLY 
                 A 
                 103 
                 49.358 
                 41.453 
                 8.754 
                 1.00 
                 43.47 
                 C 
               
               
                 ATOM 
                 715 
                 C 
                 GLY 
                 A 
                 103 
                 49.452 
                 42.664 
                 9.652 
                 1.00 
                 43.24 
                 C 
               
               
                 ATOM 
                 716 
                 O 
                 GLY 
                 A 
                 103 
                 50.251 
                 42.663 
                 10.554 
                 1.00 
                 44.06 
                 O 
               
               
                 ATOM 
                 717 
                 N 
                 ALA 
                 A 
                 104 
                 48.665 
                 43.705 
                 9.422 
                 1.00 
                 43.06 
                 N 
               
               
                 ATOM 
                 718 
                 CA 
                 ALA 
                 A 
                 104 
                 48.750 
                 44.902 
                 10.262 
                 1.00 
                 42.99 
                 C 
               
               
                 ATOM 
                 719 
                 C 
                 ALA 
                 A 
                 104 
                 47.958 
                 44.776 
                 11.576 
                 1.00 
                 42.96 
                 C 
               
               
                 ATOM 
                 720 
                 O 
                 ALA 
                 A 
                 104 
                 47.924 
                 45.701 
                 12.406 
                 1.00 
                 42.63 
                 O 
               
               
                 ATOM 
                 721 
                 CB 
                 ALA 
                 A 
                 104 
                 48.295 
                 46.085 
                 9.505 
                 1.00 
                 43.28 
                 C 
               
               
                 ATOM 
                 722 
                 N 
                 GLY 
                 A 
                 105 
                 47.306 
                 43.637 
                 11.767 
                 1.00 
                 42.51 
                 N 
               
               
                 ATOM 
                 723 
                 CA 
                 GLY 
                 A 
                 105 
                 46.757 
                 43.346 
                 13.067 
                 1.00 
                 42.31 
                 C 
               
               
                 ATOM 
                 724 
                 C 
                 GLY 
                 A 
                 105 
                 45.302 
                 43.726 
                 13.257 
                 1.00 
                 41.97 
                 C 
               
               
                 ATOM 
                 725 
                 O 
                 GLY 
                 A 
                 105 
                 44.699 
                 44.464 
                 12.477 
                 1.00 
                 41.85 
                 O 
               
               
                 ATOM 
                 726 
                 N 
                 THR 
                 A 
                 106 
                 44.753 
                 43.187 
                 14.334 
                 1.00 
                 41.36 
                 N 
               
               
                 ATOM 
                 727 
                 CA 
                 THR 
                 A 
                 106 
                 43.365 
                 43.308 
                 14.680 
                 1.00 
                 40.73 
                 C 
               
               
                 ATOM 
                 728 
                 C 
                 THR 
                 A 
                 106 
                 43.414 
                 43.897 
                 16.077 
                 1.00 
                 40.07 
                 C 
               
               
                 ATOM 
                 729 
                 O 
                 THR 
                 A 
                 106 
                 43.987 
                 43.294 
                 16.972 
                 1.00 
                 40.05 
                 O 
               
               
                 ATOM 
                 730 
                 CB 
                 THR 
                 A 
                 106 
                 42.723 
                 41.874 
                 14.678 
                 1.00 
                 41.01 
                 C 
               
               
                 ATOM 
                 731 
                 OG1 
                 THR 
                 A 
                 106 
                 42.896 
                 41.244 
                 13.393 
                 1.00 
                 41.37 
                 O 
               
               
                 ATOM 
                 732 
                 CG2 
                 THR 
                 A 
                 106 
                 41.192 
                 41.909 
                 14.880 
                 1.00 
                 40.73 
                 C 
               
               
                 ATOM 
                 733 
                 N 
                 VAL 
                 A 
                 107 
                 42.850 
                 45.078 
                 16.280 
                 1.00 
                 39.30 
                 N 
               
               
                 ATOM 
                 734 
                 CA 
                 VAL 
                 A 
                 107 
                 42.791 
                 45.629 
                 17.628 
                 1.00 
                 38.84 
                 C 
               
               
                 ATOM 
                 735 
                 C 
                 VAL 
                 A 
                 107 
                 41.513 
                 45.153 
                 18.341 
                 1.00 
                 38.25 
                 C 
               
               
                 ATOM 
                 736 
                 O 
                 VAL 
                 A 
                 107 
                 40.449 
                 45.765 
                 18.230 
                 1.00 
                 37.76 
                 O 
               
               
                 ATOM 
                 737 
                 CB 
                 VAL 
                 A 
                 107 
                 42.903 
                 47.153 
                 17.609 
                 1.00 
                 38.89 
                 C 
               
               
                 ATOM 
                 738 
                 CG1 
                 VAL 
                 A 
                 107 
                 42.771 
                 47.696 
                 19.003 
                 1.00 
                 39.50 
                 C 
               
               
                 ATOM 
                 739 
                 CG2 
                 VAL 
                 A 
                 107 
                 44.250 
                 47.583 
                 17.018 
                 1.00 
                 38.81 
                 C 
               
               
                 ATOM 
                 740 
                 N 
                 LEU 
                 A 
                 108 
                 41.628 
                 44.033 
                 19.047 
                 1.00 
                 37.85 
                 N 
               
               
                 ATOM 
                 741 
                 CA 
                 LEU 
                 A 
                 108 
                 40.480 
                 43.435 
                 19.720 
                 1.00 
                 37.95 
                 C 
               
               
                 ATOM 
                 742 
                 C 
                 LEU 
                 A 
                 108 
                 40.263 
                 44.075 
                 21.076 
                 1.00 
                 37.90 
                 C 
               
               
                 ATOM 
                 743 
                 O 
                 LEU 
                 A 
                 108 
                 41.218 
                 44.325 
                 21.827 
                 1.00 
                 37.90 
                 O 
               
               
                 ATOM 
                 744 
                 CB 
                 LEU 
                 A 
                 108 
                 40.641 
                 41.921 
                 19.875 
                 1.00 
                 38.13 
                 C 
               
               
                 ATOM 
                 745 
                 CG 
                 LEU 
                 A 
                 108 
                 39.674 
                 41.188 
                 20.817 
                 1.00 
                 38.58 
                 C 
               
               
                 ATOM 
                 746 
                 CD1 
                 LEU 
                 A 
                 108 
                 38.324 
                 40.947 
                 20.132 
                 1.00 
                 39.30 
                 C 
               
               
                 ATOM 
                 747 
                 CD2 
                 LEU 
                 A 
                 108 
                 40.275 
                 39.883 
                 21.355 
                 1.00 
                 37.97 
                 C 
               
               
                 ATOM 
                 748 
                 N 
                 THR 
                 A 
                 109 
                 38.988 
                 44.328 
                 21.376 
                 1.00 
                 37.62 
                 N 
               
               
                 ATOM 
                 749 
                 CA 
                 THR 
                 A 
                 109 
                 38.567 
                 45.006 
                 22.592 
                 1.00 
                 37.27 
                 C 
               
               
                 ATOM 
                 750 
                 C 
                 THR 
                 A 
                 109 
                 37.389 
                 44.227 
                 23.139 
                 1.00 
                 36.65 
                 C 
               
               
                 ATOM 
                 751 
                 O 
                 THR 
                 A 
                 109 
                 36.394 
                 44.059 
                 22.454 
                 1.00 
                 36.27 
                 O 
               
               
                 ATOM 
                 752 
                 CB 
                 THR 
                 A 
                 109 
                 38.171 
                 46.458 
                 22.265 
                 1.00 
                 37.47 
                 C 
               
               
                 ATOM 
                 753 
                 OG1 
                 THR 
                 A 
                 109 
                 39.347 
                 47.266 
                 22.112 
                 1.00 
                 37.69 
                 O 
               
               
                 ATOM 
                 754 
                 CG2 
                 THR 
                 A 
                 109 
                 37.446 
                 47.111 
                 23.426 
                 1.00 
                 38.07 
                 C 
               
               
                 ATOM 
                 755 
                 N 
                 VAL 
                 A 
                 110 
                 37.510 
                 43.763 
                 24.378 
                 1.00 
                 36.34 
                 N 
               
               
                 ATOM 
                 756 
                 CA 
                 VAL 
                 A 
                 110 
                 36.562 
                 42.815 
                 24.957 
                 1.00 
                 36.14 
                 C 
               
               
                 ATOM 
                 757 
                 C 
                 VAL 
                 A 
                 110 
                 35.880 
                 43.403 
                 26.157 
                 1.00 
                 35.82 
                 C 
               
               
                 ATOM 
                 758 
                 O 
                 VAL 
                 A 
                 110 
                 36.546 
                 43.920 
                 27.035 
                 1.00 
                 35.99 
                 O 
               
               
                 ATOM 
                 759 
                 CB 
                 VAL 
                 A 
                 110 
                 37.267 
                 41.549 
                 25.429 
                 1.00 
                 36.16 
                 C 
               
               
                 ATOM 
                 760 
                 CG1 
                 VAL 
                 A 
                 110 
                 36.267 
                 40.606 
                 26.101 
                 1.00 
                 36.38 
                 C 
               
               
                 ATOM 
                 761 
                 CG2 
                 VAL 
                 A 
                 110 
                 37.976 
                 40.871 
                 24.252 
                 1.00 
                 36.41 
                 C 
               
               
                 ATOM 
                 762 
                 N 
                 LYS 
                 A 
                 111 
                 34.556 
                 43.280 
                 26.196 
                 1.00 
                 35.74 
                 N 
               
               
                 ATOM 
                 763 
                 CA 
                 LYS 
                 A 
                 111 
                 33.712 
                 43.808 
                 27.277 
                 1.00 
                 35.65 
                 C 
               
               
                 ATOM 
                 764 
                 C 
                 LYS 
                 A 
                 111 
                 33.882 
                 45.319 
                 27.426 
                 1.00 
                 35.69 
                 C 
               
               
                 ATOM 
                 765 
                 O 
                 LYS 
                 A 
                 111 
                 33.593 
                 46.069 
                 26.493 
                 1.00 
                 35.75 
                 O 
               
               
                 ATOM 
                 766 
                 CB 
                 LYS 
                 A 
                 111 
                 33.971 
                 43.086 
                 28.607 
                 1.00 
                 35.42 
                 C 
               
               
                 ATOM 
                 767 
                 CG 
                 LYS 
                 A 
                 111 
                 33.345 
                 43.774 
                 29.823 
                 1.00 
                 35.29 
                 C 
               
               
                 ATOM 
                 768 
                 CD 
                 LYS 
                 A 
                 111 
                 33.221 
                 42.838 
                 31.025 
                 1.00 
                 34.49 
                 C 
               
               
                 ATOM 
                 769 
                 CE 
                 LYS 
                 A 
                 111 
                 31.800 
                 42.353 
                 31.211 
                 1.00 
                 33.74 
                 C 
               
               
                 ATOM 
                 770 
                 NZ 
                 LYS 
                 A 
                 111 
                 31.760 
                 41.205 
                 32.135 
                 1.00 
                 33.10 
                 N 
               
               
                 TER 
                 771 
                   
                 LYS 
                 A 
                 111 
               
               
                 HETATM 
                 772 
                 O 
                 HOH 
                   
                 1 
                 49.245 
                 46.328 
                 5.022 
                 1.00 
                 62.33 
                 O 
               
               
                 HETATM 
                 773 
                 O 
                 HOH 
                   
                 2 
                 51.667 
                 42.393 
                 5.253 
                 1.00 
                 64.26 
                 O 
               
               
                 HETATM 
                 774 
                 O 
                 HOH 
                   
                 3 
                 45.146 
                 47.489 
                 13.258 
                 1.00 
                 72.01 
                 O 
               
               
                 HETATM 
                 775 
                 O 
                 HOH 
                   
                 4 
                 34.352 
                 33.440 
                 15.578 
                 1.00 
                 45.87 
                 O 
               
               
                 HETATM 
                 776 
                 O 
                 HOH 
                   
                 5 
                 45.505 
                 44.955 
                 4.778 
                 1.00 
                 64.32 
                 O 
               
               
                 HETATM 
                 777 
                 O 
                 HOH 
                   
                 6 
                 52.352 
                 45.006 
                 8.090 
                 1.00 
                 59.13 
                 O 
               
               
                 HETATM 
                 778 
                 O 
                 HOH 
                   
                 7 
                 47.204 
                 46.514 
                 3.486 
                 1.00 
                 68.76 
                 O 
               
               
                 HETATM 
                 779 
                 O 
                 HOH 
                   
                 8 
                 52.395 
                 44.051 
                 10.998 
                 1.00 
                 71.90 
                 O 
               
               
                 HETATM 
                 780 
                 O 
                 HOH 
                   
                 9 
                 52.999 
                 37.102 
                 −8.462 
                 1.00 
                 86.85 
                 O 
               
               
                 HETATM 
                 781 
                 O 
                 HOH 
                   
                 10 
                 41.419 
                 38.464 
                 5.175 
                 1.00 
                 59.45 
                 O 
               
               
                 HETATM 
                 782 
                 O 
                 HOH 
                   
                 11 
                 49.959 
                 34.680 
                 −3.470 
                 1.00 
                 67.87 
                 O 
               
               
                 HETATM 
                 783 
                 O 
                 HOH 
                   
                 12 
                 53.994 
                 41.486 
                 −5.678 
                 1.00 
                 65.92 
                 O 
               
               
                 HETATM 
                 784 
                 O 
                 HOH 
                   
                 13 
                 51.536 
                 27.053 
                 17.915 
                 1.00 
                 74.52 
                 O 
               
               
                 HETATM 
                 785 
                 O 
                 HOH 
                   
                 14 
                 47.163 
                 43.295 
                 6.450 
                 0.50 
                 37.28 
                 O 
               
               
                 HETATM 
                 786 
                 O 
                 HOH 
                   
                 15 
                 40.047 
                 28.796 
                 12.708 
                 1.00 
                 49.93 
                 O 
               
               
                 HETATM 
                 787 
                 O 
                 HOH 
                   
                 16 
                 40.421 
                 33.389 
                 3.038 
                 1.00 
                 72.11 
                 O 
               
               
                 HETATM 
                 788 
                 O 
                 HOH 
                   
                 17 
                 55.257 
                 43.445 
                 8.358 
                 1.00 
                 69.83 
                 O 
               
               
                 HETATM 
                 789 
                 O 
                 HOH 
                   
                 18 
                 46.613 
                 34.179 
                 −2.484 
                 1.00 
                 75.26 
                 O 
               
               
                 HETATM 
                 790 
                 O 
                 HOH 
                   
                 19 
                 41.926 
                 30.672 
                 −4.416 
                 1.00 
                 69.47 
                 O 
               
               
                 HETATM 
                 791 
                 O 
                 HOH 
                   
                 20 
                 38.111 
                 45.323 
                 8.830 
                 1.00 
                 71.05 
                 O 
               
               
                 HETATM 
                 792 
                 O 
                 HOH 
                   
                 21 
                 33.282 
                 42.452 
                 35.017 
                 1.00 
                 56.31 
                 O 
               
               
                 HETATM 
                 793 
                 O 
                 HOH 
                   
                 22 
                 38.097 
                 28.022 
                 27.567 
                 1.00 
                 82.82 
                 O 
               
               
                 HETATM 
                 794 
                 O 
                 HOH 
                   
                 23 
                 36.861 
                 38.358 
                 7.741 
                 1.00 
                 59.93 
                 O 
               
               
                 HETATM 
                 795 
                 O 
                 HOH 
                   
                 24 
                 35.632 
                 41.106 
                 33.951 
                 1.00 
                 64.85 
                 O 
               
               
                 HETATM 
                 796 
                 O 
                 HOH 
                   
                 25 
                 39.694 
                 51.545 
                 17.552 
                 1.00 
                 88.01 
                 O 
               
               
                 HETATM 
                 797 
                 O 
                 HOH 
                   
                 26 
                 38.301 
                 46.295 
                 27.232 
                 1.00 
                 79.40 
                 O 
               
               
                 HETATM 
                 798 
                 O 
                 HOH 
                   
                 27 
                 46.017 
                 40.012 
                 −5.952 
                 1.00 
                 71.49 
                 O 
               
               
                 HETATM 
                 799 
                 O 
                 HOH 
                   
                 28 
                 33.459 
                 47.017 
                 11.159 
                 1.00 
                 91.29 
                 O 
               
               
                 HETATM 
                 800 
                 O 
                 HOH 
                   
                 29 
                 54.056 
                 48.074 
                 21.658 
                 1.00 
                 87.62 
                 O 
               
               
                 HETATM 
                 801 
                 O 
                 HOH 
                   
                 30 
                 42.698 
                 30.957 
                 −9.926 
                 1.00 
                 85.37 
                 O 
               
               
                 HETATM 
                 802 
                 O 
                 HOH 
                   
                 31 
                 49.053 
                 46.541 
                 23.570 
                 0.50 
                 40.58 
                 O 
               
               
                 HETATM 
                 803 
                 O 
                 HOH 
                   
                 32 
                 36.644 
                 26.866 
                 16.515 
                 1.00 
                 63.49 
                 O 
               
               
                 HETATM 
                 804 
                 O 
                 HOH 
                   
                 33 
                 35.842 
                 41.211 
                 8.228 
                 1.00 
                 61.91 
                 O 
               
               
                 HETATM 
                 805 
                 O 
                 HOH 
                   
                 34 
                 45.847 
                 31.003 
                 −4.217 
                 1.00 
                 60.17 
                 O 
               
               
                 HETATM 
                 806 
                 O 
                 HOH 
                   
                 35 
                 36.559 
                 42.530 
                 6.037 
                 1.00 
                 80.60 
                 O 
               
               
                 HETATM 
                 807 
                 O 
                 HOH 
                   
                 36 
                 41.738 
                 38.583 
                 −0.756 
                 1.00 
                 78.58 
                 O 
               
               
                 HETATM 
                 808 
                 O 
                 HOH 
                   
                 37 
                 41.721 
                 37.198 
                 −2.911 
                 1.00 
                 70.53 
                 O 
               
               
                 HETATM 
                 809 
                 O 
                 HOH 
                   
                 38 
                 55.564 
                 31.245 
                 15.877 
                 1.00 
                 66.47 
                 O 
               
               
                 HETATM 
                 810 
                 O 
                 HOH 
                   
                 39 
                 48.594 
                 26.834 
                 −5.493 
                 1.00 
                 71.61 
                 O 
               
               
                 HETATM 
                 811 
                 O 
                 HOH 
                   
                 40 
                 57.648 
                 37.697 
                 17.683 
                 1.00 
                 76.43 
                 O 
               
               
                 HETATM 
                 812 
                 O 
                 HOH 
                   
                 41 
                 54.466 
                 30.209 
                 22.435 
                 1.00 
                 82.25 
                 O 
               
               
                 HETATM 
                 813 
                 O 
                 HOH 
                   
                 42 
                 46.207 
                 40.360 
                 32.941 
                 1.00 
                 74.06 
                 O 
               
               
                 HETATM 
                 814 
                 O 
                 HOH 
                   
                 43 
                 29.341 
                 42.492 
                 20.689 
                 1.00 
                 80.60 
                 O 
               
               
                 HETATM 
                 815 
                 O 
                 HOH 
                   
                 44 
                 50.735 
                 47.197 
                 19.342 
                 1.00 
                 88.78 
                 O 
               
               
                 HETATM 
                 816 
                 O 
                 HOH 
                   
                 45 
                 39.469 
                 48.751 
                 19.274 
                 1.00 
                 64.53 
                 O 
               
               
                 HETATM 
                 817 
                 O 
                 HOH 
                   
                 46 
                 54.578 
                 43.702 
                 3.150 
                 1.00 
                 53.90 
                 O 
               
               
                 HETATM 
                 818 
                 O 
                 HOH 
                   
                 47 
                 51.878 
                 45.740 
                 1.436 
                 0.50 
                 43.20 
                 O 
               
               
                 HETATM 
                 819 
                 O 
                 HOH 
                   
                 48 
                 26.610 
                 38.072 
                 22.759 
                 1.00 
                 73.32 
                 O 
               
               
                 HETATM 
                 820 
                 O 
                 HOH 
                   
                 49 
                 33.027 
                 41.919 
                 15.357 
                 1.00 
                 89.15 
                 O 
               
               
                 HETATM 
                 821 
                 O 
                 HOH 
                   
                 50 
                 49.309 
                 31.953 
                 24.818 
                 1.00 
                 75.95 
                 O 
               
               
                 HETATM 
                 822 
                 O 
                 HOH 
                   
                 51 
                 44.607 
                 44.158 
                 29.925 
                 0.50 
                 38.52 
                 O 
               
               
                 HETATM 
                 823 
                 O 
                 HOH 
                   
                 52 
                 42.536 
                 26.524 
                 0.006 
                 1.00 
                 74.15 
                 O 
               
               
                 HETATM 
                 824 
                 O 
                 HOH 
                   
                 53 
                 51.130 
                 19.337 
                 0.472 
                 1.00 
                 89.67 
                 O 
               
               
                 HETATM 
                 825 
                 O 
                 HOH 
                   
                 54 
                 56.592 
                 41.377 
                 −2.899 
                 1.00 
                 52.63 
                 O 
               
               
                 HETATM 
                 826 
                 O 
                 HOH 
                   
                 55 
                 30.159 
                 45.430 
                 25.057 
                 1.00 
                 75.58 
                 O 
               
               
                 HETATM 
                 827 
                 O 
                 HOH 
                   
                 56 
                 59.017 
                 28.005 
                 8.578 
                 1.00 
                 83.63 
                 O 
               
               
                 HETATM 
                 828 
                 O 
                 HOH 
                   
                 57 
                 50.030 
                 33.674 
                 −8.476 
                 1.00 
                 76.97 
                 O 
               
               
                 HETATM 
                 829 
                 O 
                 HOH 
                   
                 58 
                 41.264 
                 29.369 
                 5.970 
                 1.00 
                 70.36 
                 O 
               
               
                 HETATM 
                 830 
                 O 
                 HOH 
                   
                 59 
                 35.397 
                 35.904 
                 9.882 
                 1.00 
                 66.45 
                 O 
               
               
                 HETATM 
                 831 
                 O 
                 HOH 
                   
                 60 
                 29.699 
                 24.263 
                 29.792 
                 1.00 
                 77.96 
                 O 
               
               
                 HETATM 
                 832 
                 O 
                 HOH 
                   
                 61 
                 41.632 
                 39.734 
                 2.099 
                 1.00 
                 49.35 
                 O 
               
               
                 HETATM 
                 833 
                 O 
                 HOH 
                   
                 62 
                 26.312 
                 40.818 
                 31.981 
                 1.00 
                 87.48 
                 O 
               
               
                 HETATM 
                 834 
                 O 
                 HOH 
                   
                 63 
                 43.409 
                 32.875 
                 −2.653 
                 1.00 
                 97.68 
                 O 
               
               
                 HETATM 
                 835 
                 O 
                 HOH 
                   
                 64 
                 39.233 
                 30.631 
                 0.994 
                 1.00 
                 60.94 
                 O 
               
               
                 HETATM 
                 836 
                 O 
                 HOH 
                   
                 65 
                 50.583 
                 48.025 
                 0.811 
                 0.50 
                 55.46 
                 O 
               
               
                 HETATM 
                 837 
                 O 
                 HOH 
                   
                 66 
                 59.008 
                 24.532 
                 6.787 
                 0.50 
                 41.79 
                 O 
               
               
                 HETATM 
                 838 
                 O 
                 HOH 
                   
                 67 
                 57.610 
                 30.961 
                 12.027 
                 1.00 
                 68.40 
                 O 
               
               
                 HETATM 
                 839 
                 O 
                 HOH 
                   
                 68 
                 54.850 
                 26.829 
                 −1.181 
                 1.00 
                 81.14 
                 O 
               
               
                 HETATM 
                 840 
                 O 
                 HOH 
                   
                 69 
                 34.060 
                 39.827 
                 6.446 
                 1.00 
                 72.84 
                 O 
               
               
                 HETATM 
                 841 
                 O 
                 HOH 
                   
                 70 
                 27.701 
                 35.938 
                 20.953 
                 1.00 
                 71.47 
                 O 
               
               
                 HETATM 
                 842 
                 O 
                 HOH 
                   
                 71 
                 47.661 
                 26.712 
                 24.623 
                 1.00 
                 78.24 
                 O 
               
               
                 HETATM 
                 843 
                 O 
                 HOH 
                   
                 72 
                 43.403 
                 49.234 
                 14.571 
                 1.00 
                 81.06 
                 O 
               
               
                 HETATM 
                 844 
                 O 
                 HOH 
                   
                 73 
                 40.989 
                 30.459 
                 −7.252 
                 1.00 
                 75.18 
                 O 
               
               
                 HETATM 
                 845 
                 O 
                 HOH 
                   
                 74 
                 50.187 
                 28.078 
                 −0.705 
                 1.00 
                 88.41 
                 O 
               
               
                 HETATM 
                 846 
                 O 
                 HOH 
                   
                 75 
                 52.501 
                 22.888 
                 23.124 
                 1.00 
                 72.12 
                 O 
               
               
                 HETATM 
                 847 
                 O 
                 HOH 
                   
                 76 
                 51.937 
                 26.536 
                 26.291 
                 1.00 
                 76.44 
                 O 
               
               
                 HETATM 
                 848 
                 O 
                 HOH 
                   
                 77 
                 57.772 
                 29.623 
                 −5.664 
                 1.00 
                 67.63 
                 O 
               
               
                 HETATM 
                 849 
                 O 
                 HOH 
                   
                 78 
                 50.926 
                 25.600 
                 5.056 
                 1.00 
                 80.32 
                 O 
               
               
                 HETATM 
                 850 
                 O 
                 HOH 
                   
                 79 
                 61.922 
                 29.045 
                 9.305 
                 1.00 
                 77.07 
                 O 
               
               
                 HETATM 
                 851 
                 O 
                 HOH 
                   
                 80 
                 54.189 
                 23.727 
                 5.680 
                 1.00 
                 76.46 
                 O 
               
               
                 HETATM 
                 852 
                 O 
                 HOH 
                   
                 81 
                 38.768 
                 24.307 
                 10.848 
                 1.00 
                 69.70 
                 O 
               
               
                 HETATM 
                 853 
                 O 
                 HOH 
                   
                 82 
                 36.445 
                 22.153 
                 24.035 
                 1.00 
                 78.79 
                 O 
               
               
                 HETATM 
                 854 
                 O 
                 HOH 
                   
                 83 
                 47.196 
                 46.033 
                 21.492 
                 1.00 
                 74.35 
                 O 
               
               
                 HETATM 
                 855 
                 O 
                 HOH 
                   
                 84 
                 35.057 
                 43.461 
                 13.870 
                 1.00 
                 69.66 
                 O 
               
               
                 HETATM 
                 856 
                 O 
                 HOH 
                   
                 85 
                 51.118 
                 42.221 
                 17.798 
                 1.00 
                 84.91 
                 O 
               
               
                 HETATM 
                 857 
                 O 
                 HOH 
                   
                 86 
                 50.992 
                 23.568 
                 30.307 
                 1.00 
                 85.90 
                 O 
               
               
                 HETATM 
                 858 
                 O 
                 HOH 
                   
                 87 
                 24.118 
                 39.727 
                 34.347 
                 1.00 
                 68.74 
                 O 
               
               
                 HETATM 
                 859 
                 O 
                 HOH 
                   
                 88 
                 38.823 
                 28.953 
                 8.669 
                 1.00 
                 85.42 
                 O 
               
               
                 HETATM 
                 860 
                 O 
                 HOH 
                   
                 89 
                 49.288 
                 26.659 
                 27.113 
                 1.00 
                 85.90 
                 O 
               
               
                 HETATM 
                 861 
                 O 
                 HOH 
                   
                 90 
                 37.335 
                 18.846 
                 21.135 
                 1.00 
                 92.05 
                 O 
               
               
                 HETATM 
                 862 
                 O 
                 HOH 
                   
                 91 
                 57.599 
                 27.914 
                 1.058 
                 1.00 
                 76.63 
                 O 
               
               
                 HETATM 
                 863 
                 O 
                 HOH 
                   
                 92 
                 60.682 
                 24.384 
                 −4.788 
                 1.00 
                 91.50 
                 O 
               
               
                 HETATM 
                 864 
                 O 
                 HOH 
                   
                 93 
                 34.218 
                 35.108 
                 7.727 
                 1.00 
                 61.57 
                 O 
               
               
                 HETATM 
                 865 
                 O 
                 HOH 
                   
                 94 
                 62.389 
                 21.875 
                 −9.626 
                 1.00 
                 83.23 
                 O 
               
               
                 HETATM 
                 866 
                 O 
                 HOH 
                   
                 95 
                 44.801 
                 42.200 
                 27.630 
                 1.00 
                 93.68 
                 O 
               
               
                 HETATM 
                 867 
                 O 
                 HOH 
                   
                 96 
                 56.200 
                 28.893 
                 20.739 
                 1.00 
                 76.88 
                 O 
               
               
                 HETATM 
                 868 
                 O 
                 HOH 
                   
                 97 
                 57.817 
                 39.521 
                 1.149 
                 0.50 
                 33.39 
                 O 
               
               
                 CONECT 
                 168 
                 649 
               
               
                 CONECT 
                 649 
                 168 
               
               
                 MASTER 
                   
                 365 
                 0 
                   
                 0 
                 1 13 
                 0 0 
                 6 867 
                 1 
                 2 
                 9 
               
            
           
           
               
            
               
                 END 
               
               
                   
               
            
           
         
       
     
     
       
         
           
               
               
               
             
               
                 APPENDIX I(b) 
               
               
                   
               
             
            
               
                 HEADER 
                 IMMUNE SYSTEM 
                 05-APR-04 1VES 
               
            
           
           
               
               
               
            
               
                 TITLE 
                   
                 STRUCTURE OF NEW ANTIGEN RECEPTOR VARIABLE DOMAIN FROM 
               
               
                 TITLE 
                  2 
                  SHARKS 
               
               
                 COMPND 
                   
                 MOL_ID: 1; 
               
               
                 COMPND 
                  2 
                  MOLECULE: NEW ANTIGEN RECEPTOR; 
               
               
                 COMPND 
                  3 
                  CHAIN: A, B; 
               
               
                 COMPND 
                  4 
                  FRAGMENT: VARIABLE DOMAIN; 
               
               
                 COMPND 
                  5 
                  SYNONYM: VNAR; 
               
               
                 COMPND 
                  6 
                  ENGINEERED: YES 
               
               
                 SOURCE 
                   
                 MOL_ID: 1; 
               
               
                 SOURCE 
                  2 
                  ORGANISM_SCIENTIFIC: ORECTOLOBUS MACULATUS; 
               
               
                 SOURCE 
                  3 
                  ORGANISM_COMMON: SPOTTED WOBBEGONG; 
               
               
                 SOURCE 
                  4 
                  EXPRESSION_SYSTEM: ESCHERICHIA COLI; 
               
               
                 SOURCE 
                  5 
                  EXPRESSION_SYSTEM_COMMON: BACTERIA 
               
               
                 KEYWDS 
                   
                 IG VNAR, 12Y-2 
               
               
                 EXPDTA 
                   
                 X-RAY DIFFRACTION 
               
               
                 AUTHOR 
                   
                 V.A.STRELTSOV 
               
            
           
           
               
               
               
               
            
               
                 JRNL 
                   
                 AUTH 
                 V.A.STRELTSOV,J.N.VARGHESE,P.J.HUDSON,R.A.IRVING, 
               
            
           
           
               
               
               
            
               
                 JRNL 
                   
                 AUTH 2 J.A.CARMICHAEL,S.D.NUTTALL 
               
            
           
           
               
               
               
               
            
               
                 JRNL 
                   
                 TITL 
                 CRYSTAL STRUCTURE OF A SHARK NEW ANTIGEN RECEPTOR 
               
            
           
           
               
               
               
            
               
                 JRNL 
                   
                 TITL 2 (IGNAR) VARIABLE DOMAIN 
               
            
           
           
               
               
               
               
            
               
                 JRNL 
                   
                 REF 
                 TO BE PUBLISHED 
               
            
           
           
               
               
               
            
               
                 JRNL 
                   
                 REFN 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  1 
                   
               
               
                 REMARK 
                  2 
                   
               
               
                 REMARK 
                  2 
                  RESOLUTION. 2.18 ANGSTROMS. 
               
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  PROGRAM 
                 : REFMAC 5.1.24 
               
               
                 REMARK 
                  3 
                  AUTHORS 
                 : MURSHUDOV,VAGIN,DODSON 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 REFINEMENT TARGET : MAXIMUM LIKELIHOOD 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  RESOLUTION RANGE HIGH 
                 (ANGSTROMS) 
                 : 2.18 
               
               
                 REMARK 
                  3 
                  RESOLUTION RANGE LOW 
                 (ANGSTROMS) 
                 : 18.12 
               
               
                 REMARK 
                  3 
                  DATA CUTOFF 
                 (SIGMA(F)) 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  COMPLETENESS FOR RANGE 
                 (%) 
                 : 99.9 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  NUMBER OF REFLECTIONS 
                 : 14981 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 FIT TO DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  CROSS-VALIDATION METHOD 
                 : THROUGHOUT 
               
               
                 REMARK 
                  3 
                  FREE R VALUE TEST SET SELECTION 
                 : RANDOM 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  R VALUE 
                 (WORKING + TEST SET) 
                 : 0.179 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  R VALUE 
                 (WORKING SET) 
                 : 0.176 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  FREE R VALUE 
                 : 0.247 
               
               
                 REMARK 
                  3 
                  FREE R VALUE TEST SET SIZE (%) 
                 : 5.000 
               
               
                 REMARK 
                  3 
                  FREE R VALUE TEST SET COUNT 
                 : 783 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 FIT IN THE HIGHEST RESOLUTION BIN. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  TOTAL NUMBER OF BINS USED 
                 : 20 
               
               
                 REMARK 
                  3 
                  BIN RESOLUTION RANGE HIGH 
                 : 2.18 
               
               
                 REMARK 
                  3 
                  BIN RESOLUTION RANGE LOW 
                 : 2.23 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  REFLECTION IN BIN 
                 (WORKING SET) 
                 : 1057 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  BIN COMPLETENESS (WORKING+TEST) (%) 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  BIN R VALUE 
                 (WORKING SET) 
                 : 0.2250 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  BIN FREE R VALUE SET COUNT 
                 : 46 
               
               
                 REMARK 
                  3 
                  BIN FREE R VALUE 
                 : 0.3110 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                  ALL ATOMS 
                 : 2120 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  B VALUES. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 FROM WILSON PLOT 
                 (A**2) 
                 : NULL 
               
               
                 REMARK 
                  3 
                 MEAN B VALUE 
                 (OVERALL, A**2) 
                 : 21.29 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 OVERALL ANISOTROPIC B VALUE. 
               
               
                 REMARK 
                  3 
                  B11 (A**2) : −1.07000 
               
               
                 REMARK 
                  3 
                  B22 (A**2) : 0.07000 
               
               
                 REMARK 
                  3 
                  B33 (A**2) : 1.00000 
               
               
                 REMARK 
                  3 
                  B12 (A**2) : 0.00000 
               
               
                 REMARK 
                  3 
                  B13 (A**2) : 0.00000 
               
               
                 REMARK 
                  3 
                  B23 (A**2) : 0.00000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  ESTIMATED OVERALL COORDINATE ERROR. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 ESU BASED ON R VALUE 
                   (A): 
                 0.223 
               
               
                 REMARK 
                  3 
                 ESU BASED ON FREE R VALUE 
                   (A): 
                 0.206 
               
               
                 REMARK 
                  3 
                 ESU BASED ON MAXIMUM LIKELIHOOD 
                   (A): 
                 0.140 
               
               
                 REMARK 
                  3 
                 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD 
                 (A**2): 
                 5.392 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                 CORRELATION COEFFICIENTS. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                 CORRELATION COEFFICIENT FO-FC 
                 : 0.961 
               
               
                 REMARK 
                  3 
                 CORRELATION COEFFICIENT FO-FC FREE 
                 : 0.922 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  RMS DEVIATIONS FROM IDEAL VALUES 
                 COUNT 
                 RMS 
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 BOND LENGTHS REFINED ATOMS 
                   (A): 
                 1794 
                 ; 
                 0.012 
                 ; 
                 0.021 
               
               
                 REMARK 
                  3 
                 BOND LENGTHS OTHERS 
                   (A): 
                 1596 
                 ; 
                 0.002 
                 ; 
                 0.020 
               
               
                 REMARK 
                  3 
                 BOND ANGLES REFINED ATOMS 
                 (DEGREES): 
                 2422 
                 ; 
                 1.484 
                 ; 
                 1.958 
               
               
                 REMARK 
                  3 
                 BOND ANGLES OTHERS 
                 (DEGREES): 
                 3716 
                 ; 
                 0.868 
                 ; 
                 3.000 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 1 
                 (DEGREES): 
                  224 
                 ; 
                 6.648 
                 ; 
                 5.000 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 2 
                 (DEGREES): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 3 
                 (DEGREES): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 TORSION ANGLES, PERIOD 4 
                 (DEGREES): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 CHIRAL-CENTER RESTRAINTS 
                 (A**3): 
                  270 
                 ; 
                 0.101 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 GENERAL PLANES REFINED ATOMS 
                   (A): 
                 1994 
                 ; 
                 0.005 
                 ; 
                 0.020 
               
               
                 REMARK 
                  3 
                 GENERAL PLANES OTHERS 
                   (A): 
                  384 
                 ; 
                 0.002 
                 ; 
                 0.020 
               
               
                 REMARK 
                  3 
                 NON-BONDED CONTACTS REFINED ATOMS 
                   (A): 
                  303 
                 ; 
                 0.193 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 NON-BONDED CONTACTS OTHERS 
                   (A): 
                 1944 
                 ; 
                 0.251 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 NON-BONDED TORSION REFINED ATOMS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 NON-BONDED TORSION OTHERS 
                   (A): 
                 1227 
                 ; 
                 0.086 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 H-BOND (X...Y) REFINED ATOMS 
                   (A): 
                  216 
                 ; 
                 0.188 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 H-BOND (X...Y) OTHERS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 POTENTIAL METAL-ION REFINED ATOMS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 POTENTIAL METAL-ION OTHERS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 SYMMETRY VDW REFINED ATOMS 
                   (A): 
                  29 
                 ; 
                 0.208 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 SYMMETRY VDW OTHERS 
                   (A): 
                  115 
                 ; 
                 0.251 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 SYMMETRY H-BOND REFINED ATOMS 
                   (A): 
                  43 
                 ; 
                 0.199 
                 ; 
                 0.200 
               
               
                 REMARK 
                  3 
                 SYMMETRY H-BOND OTHERS 
                   (A): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  ISOTROPIC THERMAL FACTOR RESTRAINTS. 
                 COUNT 
                   
                 RMS 
                   
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 MAIN-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                 1110 
                 ; 
                 0.591 
                 ; 
                 1.500 
               
               
                 REMARK 
                  3 
                 MAIN-CHAIN BOND OTHER ATOMS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 MAIN-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                 1780 
                 ; 
                 1.140 
                 ; 
                 2.000 
               
               
                 REMARK 
                  3 
                 SIDE-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                  684 
                 ; 
                 1.826 
                 ; 
                 3.000 
               
               
                 REMARK 
                  3 
                 SIDE-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                  642 
                 ; 
                 3.050 
                 ; 
                 4.500 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 ANISOTROPIC THERMAL FACTOR RESTRAINTS. 
                   
                 COUNT 
                   
                 RMS 
                   
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                 RIGID-BOND RESTRAINTS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 SPHERICITY; FREE ATOMS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
               
                 REMARK 
                  3 
                 SPHERICITY; BONDED ATOMS 
                 (A**2): 
                 NULL 
                 ; 
                  NULL 
                 ; 
                  NULL 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  NCS RESTRAINTS STATISTICS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 NUMBER OF DIFFERENT NCS GROUPS : 0 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  TLS DETAILS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 NUMBER OF TLS GROUPS : 2 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 TLS GROUP : 1 
               
               
                 REMARK 
                  3 
                  NUMBER OF COMPONENTS GROUP : 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                  3 
                  RESIDUE RANGE : 
                 A 
                  1 
                   
                 A 
                  113 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  ORIGIN FOR THE GROUP (A): 
                 5.3834 
                 33.1578 
                 25.0745 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  T11: 
                  0.1096 
                 T22: 
                  0.0299 
               
               
                 REMARK 
                  3 
                  T33: 
                  0.1185 
                 T12: 
                  0.0303 
               
               
                 REMARK 
                  3 
                  T13: 
                 −0.0055 
                 T23: 
                 −0.0341 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  L11: 
                  3.3390 
                 L22: 
                  4.7309 
               
               
                 REMARK 
                  3 
                  L33: 
                  3.2713 
                 L12: 
                 −0.1654 
               
               
                 REMARK 
                  3 
                  L13: 
                  0.6888 
                 L23: 
                 −0.6154 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  S11: 
                  0.1195 
                 S12: 
                  0.0442 
                 S13: 
                 −0.2338 
               
               
                 REMARK 
                  3 
                  S21: 
                 −0.2682 
                 S22: 
                  0.0273 
                 S23: 
                 −0.3948 
               
               
                 REMARK 
                  3 
                  S31: 
                  0.1461 
                 S32: 
                  0.1933 
                 S33: 
                 −0.1468 
               
            
           
           
               
               
            
               
                 REMARK 
                  3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 TLS GROUP : 2 
               
               
                 REMARK 
                  3 
                  NUMBER OF COMPONENTS GROUP : 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                  3 
                  RESIDUE RANGE : 
                 B 
                  1 
                   
                 B 
                  113 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  ORIGIN FOR THE GROUP (A): 
                 −20.7040 
                 46.2053 
                 38.5402 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  T11: 
                  0.1451 
                 T22: 
                  0.2403 
               
               
                 REMARK 
                  3 
                  T33: 
                  0.1040 
                 T12: 
                 −0.0402 
               
               
                 REMARK 
                  3 
                  T13: 
                  0.0700 
                 T23: 
                 −0.0394 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  L11: 
                  3.2727 
                 L22: 
                  4.0810 
               
               
                 REMARK 
                  3 
                  L33: 
                  5.0389 
                 L12: 
                  0.5719 
               
               
                 REMARK 
                  3 
                  L13: 
                  0.1006 
                 L23: 
                  0.6479 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                  3 
                  S11: 
                  0.1393 
                 S12: 
                 −0.0589 
                 S13: 
                 −0.0029 
               
               
                 REMARK 
                  3 
                  S21: 
                  0.1389 
                 S22: 
                 −0.3008 
                 S23: 
                  0.2593 
               
               
                 REMARK 
                  3 
                  S31: 
                 −0.0779 
                 S32: 
                 −0.5470 
                 S33: 
                  0.1615 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  BULK SOLVENT MODELLING. 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                 METHOD USED : BABINET MODEL WITH MASK 
               
               
                 REMARK 
                  3 
                 PARAMETERS FOR MASK CALCULATION 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                  3 
                 VDW PROBE RADIUS 
                 : 1.40 
               
               
                 REMARK 
                  3 
                 ION PROBE RADIUS 
                 : 0.80 
               
               
                 REMARK 
                  3 
                 SHRINKAGE RADIUS 
                 : 0.80 
               
            
           
           
               
               
               
            
               
                 REMARK 
                  3 
                   
               
               
                 REMARK 
                  3 
                  OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE 
               
               
                 REMARK 
                  3 
                  RIDING POSITIONS 
               
               
                 REMARK 
                  4 
                   
               
               
                 REMARK 
                  4 
                 1VES COMPLIES WITH FORMAT V. 2.3, 09-JULY-1998 
               
               
                 REMARK 
                 100 
                   
               
               
                 REMARK 
                 100 
                 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 07-APR-2004. 
               
               
                 REMARK 
                 100 
                 THE RCSB ID CODE IS RCSB006538. 
               
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 EXPERIMENTAL DETAILS 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  EXPERIMENT TYPE 
                 : X-RAY DIFFRACTION 
               
               
                 REMARK 
                 200 
                  DATE OF DATA COLLECTION 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  TEMPERATURE 
                 (KELVIN) 
                 : 113.0 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  PH 
                 : 4.60 
               
               
                 REMARK 
                 200 
                  NUMBER OF CRYSTALS USED 
                 : 1 
               
            
           
           
               
               
            
               
                 REMARK 
                 200 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  SYNCHROTRON 
                 (Y/N) 
                 : N 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  RADIATION SOURCE 
                 : ROTATING ANODE 
               
               
                 REMARK 
                 200 
                  BEAMLINE 
                 : NULL 
               
               
                 REMARK 
                 200 
                  X-RAY GENERATOR MODEL 
                 : RIGAKU HR3 HB 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  MONOCHROMATIC OR LAUE 
                 (M/L) 
                 : M 
               
               
                 REMARK 
                 200 
                  WAVELENGTH OR RANGE 
                 (A) 
                 : 1.5418 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  MONOCHROMATOR 
                 : NI FILTER 
               
               
                 REMARK 
                 200 
                  OPTICS 
                 : AXCO MICROCAPILLARY FOCUSING 
               
               
                 REMARK 
                 200 
                   
                 OPTICS 
               
            
           
           
               
               
            
               
                 REMARK 
                 200 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  DETECTOR TYPE 
                 : IMAGE PLATE 
               
               
                 REMARK 
                 200 
                  DETECTOR MANUFACTURER 
                 : MAR 180 
               
               
                 REMARK 
                 200 
                  INTENSITY-INTEGRATION SOFTWARE 
                 : DENZO 
               
               
                 REMARK 
                 200 
                  DATA SCALING SOFTWARE 
                 : SCALEPACK 
               
            
           
           
               
               
            
               
                 REMARK 
                 200 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  NUMBER OF UNIQUE REFLECTIONS 
                 : 14981 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  RESOLUTION RANGE HIGH 
                 (A) 
                 : 2.180 
               
               
                 REMARK 
                 200 
                  RESOLUTION RANGE LOW 
                 (A) 
                 : 18.120 
               
               
                 REMARK 
                 200 
                  REJECTION CRITERIA 
                 (SIGMA(I)) 
                 : 0.000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                  OVERALL. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  COMPLETENESS FOR RANGE 
                 (%) 
                 : 100.0 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  DATA REDUNDANCY 
                 : 6.600 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  R MERGE 
                 (I) 
                 : 0.05400 
               
               
                 REMARK 
                 200 
                  R SYM 
                 (I) 
                 : 0.05400 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  &lt;I/SIGMA(I)&gt; FOR THE DATA SET 
                 : 32.5000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 IN THE HIGHEST RESOLUTION SHELL. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) 
                 : 2.18 
               
               
                 REMARK 
                 200 
                  HIGHEST RESOLUTION SHELL, RANGE LOW (A) 
                 : 2.24 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  COMPLETENESS FOR SHELL 
                 (%) 
                 : 99.4 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  DATA REDUNDANCY IN SHELL 
                 : 6.30 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 200 
                  R MERGE FOR SHELL 
                 (I) 
                 : NULL 
               
               
                 REMARK 
                 200 
                  R SYM FOR SHELL 
                 (I) 
                 : NULL 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 200 
                  &lt;I/SIGMA(I)&gt; FOR SHELL 
                 : 4.000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 200 
                   
               
               
                 REMARK 
                 200 
                 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH 
               
               
                 REMARK 
                 200 
                 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT 
               
               
                 REMARK 
                 200 
                 SOFTWARE USED: MOLREP 
               
               
                 REMARK 
                 200 
                 STARTING MODEL: 12Y-1 VNAR PDB ENTRY 1VER 
               
               
                 REMARK 
                 200 
               
               
                 REMARK 
                 200 
                 REMARK: NULL 
               
               
                 REMARK 
                 280 
               
               
                 REMARK 
                 280 
                 CRYSTAL 
               
               
                 REMARK 
                 280 
                 SOLVENT CONTENT, VS (%): NULL 
               
               
                 REMARK 
                 280 
                 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): NULL 
               
               
                 REMARK 
                 280 
               
               
                 REMARK 
                 280 
                 CRYSTALLIZATION CONDITIONS: 0.1M SODIUM CITRATE, 20% V/V ISO- 
               
               
                 REMARK 
                 280 
                  PROPANOL, 20% PEG4000, PH 4.6, VAPOR DIFFUSION, HANGING DROP, 
               
               
                 REMARK 
                 280 
                  TEMPERATURE 298 K 
               
               
                 REMARK 
                 290 
               
               
                 REMARK 
                 290 
                 CRYSTALLOGRAPHIC SYMMETRY 
               
               
                 REMARK 
                 290 
                 SYMMETRY OPERATORS FOR SPACE GROUP: I 21 21 21 
               
               
                 REMARK 
                 290 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                  SYMOP 
                 SYMMETRY 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                   NNNMMM 
                 OPERATOR 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                 1555 
                 X,Y,Z 
               
               
                 REMARK 
                 290 
                 2555 
                 1/2−X,−Y,1/2+Z 
               
               
                 REMARK 
                 290 
                 3555 
                 −X,1/2+Y,1/2−Z 
               
               
                 REMARK 
                 290 
                 4555 
                 1/2+X,1/2−Y,−Z 
               
               
                 REMARK 
                 290 
                 5555 
                 1/2+X,1/2+Y,1/2+Z 
               
               
                 REMARK 
                 290 
                 6555 
                 −X,1/2−Y,Z 
               
               
                 REMARK 
                 290 
                 7555 
                 1/2−X,Y,−Z 
               
               
                 REMARK 
                 290 
                 8555 
                 X,−Y,1/2−Z 
               
            
           
           
               
               
            
               
                 REMARK 
                 290 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 290 
                   WHERE 
                 NNN 
                 −&gt; OPERATOR NUMBER 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 290 
                 MMM 
                 −&gt; TRANSLATION VECTOR 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 290 
                   
               
               
                 REMARK 
                 290 
                 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS 
               
               
                 REMARK 
                 290 
                 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM 
               
               
                 REMARK 
                 290 
                 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY 
               
               
                 REMARK 
                 290 
                 RELATED MOLECULES. 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 290 
                  SMTRY1 
                 1 
                  1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 1 
                  0.000000 
                  1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 1 
                  0.000000 
                  0.000000 
                  1.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 2 
                 −1.000000 
                  0.000000 
                  0.000000 
                 32.64150 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 2 
                  0.000000 
                 −1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 2 
                  0.000000 
                  0.000000 
                  1.000000 
                 49.11200 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 3 
                 −1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 3 
                  0.000000 
                  1.000000 
                  0.000000 
                 46.02300 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 3 
                  0.000000 
                  0.000000 
                 −1.000000 
                 49.11200 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 4 
                  1.000000 
                  0.000000 
                  0.000000 
                 32.64150 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 4 
                  0.000000 
                 −1.000000 
                  0.000000 
                 46.02300 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 4 
                  0.000000 
                  0.000000 
                 −1.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 5 
                  1.000000 
                  0.000000 
                  0.000000 
                 32.64150 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 5 
                  0.000000 
                  1.000000 
                  0.000000 
                 46.02300 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 5 
                  0.000000 
                  0.000000 
                  1.000000 
                 49.11200 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 6 
                 −1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 6 
                  0.000000 
                 −1.000000 
                  0.000000 
                 46.02300 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 6 
                  0.000000 
                  0.000000 
                  1.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 7 
                 −1.000000 
                  0.000000 
                  0.000000 
                 32.64150 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 7 
                  0.000000 
                  1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 7 
                  0.000000 
                  0.000000 
                 −1.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY1 
                 8 
                  1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY2 
                 8 
                  0.000000 
                 −1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 290 
                 SMTRY3 
                 8 
                  0.000000 
                  0.000000 
                 −1.000000 
                 49.11200 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 290 
                   
               
               
                 REMARK 
                 290 
                 REMARK: NULL 
               
               
                 REMARK 
                 300 
                   
               
               
                 REMARK 
                 300 
                 BIOMOLECULE: 1, 2 
               
               
                 REMARK 
                 300 
                 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT 
               
               
                 REMARK 
                 300 
                 WHICH CONSISTS OF 2 CHAIN(S). SEE REMARK 350 FOR 
               
               
                 REMARK 
                 300 
                 INFORMATION ON GENERATING THE BIOLOGICAL MOLECULE(S). 
               
               
                 REMARK 
                 350 
                   
               
               
                 REMARK 
                 350 
                 GENERATING THE BIOMOLECULE 
               
               
                 REMARK 
                 350 
                 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN 
               
               
                 REMARK 
                 350 
                 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE 
               
               
                 REMARK 
                 350 
                 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS 
               
               
                 REMARK 
                 350 
                 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND 
               
               
                 REMARK 
                 350 
                 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. 
               
               
                 REMARK 
                 350 
                   
               
               
                 REMARK 
                 350 
                 BIOMOLECULE: 1 
               
               
                 REMARK 
                 350 
                 APPLY THE FOLLOWING TO CHAINS: A 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 350 
                 BIOMT1 
                 1 
                  1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 350 
                 BIOMT2 
                 1 
                  0.000000 
                  1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 350 
                 BIOMT3 
                 1 
                  0.000000 
                  0.000000 
                  1.000000 
                  0.00000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 350 
                 BIOMOLECULE: 2 
               
               
                 REMARK 
                 350 
                 APPLY THE FOLLOWING TO CHAINS: B 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 350 
                 BIOMT1 
                 2 
                  1.000000 
                  0.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 350 
                 BIOMT2 
                 2 
                  0.000000 
                  1.000000 
                  0.000000 
                  0.00000 
               
               
                 REMARK 
                 350 
                 BIOMT3 
                 2 
                  0.000000 
                  0.000000 
                  1.000000 
                  0.00000 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 375 
                   
               
               
                 REMARK 
                 375 
                 SPECIAL POSITION 
               
               
                 REMARK 
                 375 
                 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS 
               
               
                 REMARK 
                 375 
                 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL 
               
               
                 REMARK 
                 375 
                 POSITIONS. 
               
               
                 REMARK 
                 375 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 375 
                 ATOM RES 
                 CSSEQI 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 375 
                  HOH 
                  60 
                 LIES ON A SPECIAL POSITION. 
               
               
                 REMARK 
                 375 
                  HOH 
                 167 
                 LIES ON A SPECIAL POSITION. 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. 
               
               
                 REMARK 
                 500 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                 ATM1 
                 RES C 
                 SSEQI 
                 ATM2 
                 RES C 
                 SSEQI 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                 O 
                 HOH 
                 132 
                 O 
                 HOH 
                 324 
                 2.11 
               
               
                 REMARK 
                 500 
                 OE1 
                 GLU A 
                  76 
                 O 
                 HOH 
                 319 
                 2.14 
               
               
                 REMARK 
                 500 
                 O 
                 HOH 
                  55 
                 O 
                 HOH 
                 162 
                 2.14 
               
               
                 REMARK 
                 500 
                 O 
                 HOH 
                 262 
                 O 
                 HOH 
                 326 
                 2.14 
               
               
                 REMARK 
                 500 
                 O 
                 HOH 
                  47 
                 O 
                 HOH 
                 268 
                 2.15 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                 SUBTOPIC: COVALENT BOND LENGTHS 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES 
               
               
                 REMARK 
                 500 
                 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE 
               
               
                 REMARK 
                 500 
                 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN 
               
               
                 REMARK 
                 500 
                 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 STANDARD TABLE: 
               
               
                 REMARK 
                 500 
                 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),F6.3) 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 EXPECTED VALUES: ENGH AND HUBER, 1991 
               
               
                 REMARK 
                 500 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                  M RES 
                 CSSEQI 
                 ATM1 
                 RES 
                 CSSEQI 
                 ATM2 
                 DEVIATION 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                  LYS 
                 A 61 
                  CG 
                 LYS 
                 A 61 
                  CD 
                  0.080 
               
               
                 REMARK 
                 500 
                  ARG 
                 B 25 
                  CG 
                 ARG 
                 B 25 
                  CD 
                 −0.072 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                 SUBTOPIC: COVALENT BOND ANGLES 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES 
               
               
                 REMARK 
                 500 
                 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE 
               
               
                 REMARK 
                 500 
                 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN 
               
               
                 REMARK 
                 500 
                 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 STANDARD TABLE: 
               
               
                 REMARK 
                 500 
                 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                 EXPECTED VALUES: ENGH AND HUBER, 1991 
               
               
                 REMARK 
                 500 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                  M RES 
                 CSSEQI 
                 ATM1 
                 ATM2 
                 ATM3 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                  TYR 
                 A 94 
                  CA 
                 - 
                  C 
                 - 
                  N 
                 ANGL. DEV. = 10.7 DEGREES 
               
               
                 REMARK 
                 500 
                  ASN 
                 A 95 
                  C 
                 - 
                  N 
                 - 
                  CA 
                 ANGL. DEV. = 10.8 DEGREES 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                  GEOMETRY AND STEREOCHEMISTRY 
               
               
                 REMARK 
                 500 
                  SUBTOPIC: NON-CIS, NON-TRANS 
               
               
                 REMARK 
                 500 
                   
               
               
                 REMARK 
                 500 
                  THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH 
               
               
                 REMARK 
                 500 
                  CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED 
               
               
                 REMARK 
                 500 
                  ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/− 30 AND 
               
               
                 REMARK 
                 500 
                  CIS IS DEFINED AS 0 +/− 30 DEGREES. 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 500 
                   
                   
                 MODEL 
                 OMEGA 
               
               
                 REMARK 
                 500 
                  VAL A 112 
                 LYS A 113 
                   
                 149.69 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 525 
                   
               
               
                 REMARK 
                 525 
                  SOLVENT 
               
               
                 REMARK 
                 525 
                  THE FOLLOWING SOLVENT MOLECULES LIE FARTHER THAN EXPECTED 
               
               
                 REMARK 
                 525 
                  FROM THE PROTEIN OR NUCLEIC ACID MOLECULE AND MAY BE 
               
               
                 REMARK 
                 525 
                  ASSOCIATED WITH A SYMMETRY RELATED MOLECULE (M=MODEL 
               
               
                 REMARK 
                 525 
                  NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE 
               
               
                 REMARK 
                 525 
                  NUMBER; I=INSERTION CODE): 
               
               
                 REMARK 
                 525 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 525 
                  M RES 
                 CSSEQI 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 525 
                  HOH 
                 298 
                 DISTANCE = 
                  8.93 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 311 
                 DISTANCE = 
                  5.86 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 312 
                 DISTANCE = 
                  7.03 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 313 
                 DISTANCE = 
                  7.02 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 341 
                 DISTANCE = 
                  5.38 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 342 
                 DISTANCE = 
                  5.10 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 350 
                 DISTANCE = 
                  8.50 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 351 
                 DISTANCE = 
                  8.05 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 353 
                 DISTANCE = 
                  6.37 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 354 
                 DISTANCE = 
                  6.80 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 355 
                 DISTANCE = 
                 12.75 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 356 
                 DISTANCE = 
                  6.59 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 357 
                 DISTANCE = 
                  5.98 ANGSTROMS 
               
               
                 REMARK 
                 525 
                  HOH 
                 358 
                 DISTANCE = 
                 13.58 ANGSTROMS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 900 
                   
               
               
                 REMARK 
                 900 
                 RELATED ENTRIES 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 900 
                 RELATED ID: 1VER 
                 RELATED DB: PD 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 900 
                 THE SAME PROTEIN (12Y-1) 
               
               
                 REMARK 
                 999 
                   
               
               
                 REMARK 
                 999 
                 SEQUENCE 
               
               
                 REMARK 
                 999 
                 A SEQUENCE DATABASE REFERENCE FOR THIS PROTEIN DOES 
               
               
                 REMARK 
                 999 
                  NOT CURRENTLY EXIST. 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 SEQRES 
                  1 
                 A 
                 113 
                 ALA 
                 TRP 
                 VAL 
                 ASP 
                 GLN 
                 THR 
                 PRO 
                 ARG 
                 THR 
                 ALA 
                 THR 
                 LYS 
                 GLU 
               
               
                 SEQRES 
                  2 
                 A 
                 113 
                 THR 
                 GLY 
                 GLU 
                 SER 
                 LEU 
                 THR 
                 ILE 
                 ASN 
                 CYS 
                 VAL 
                 LEU 
                 ARG 
                 ASP 
               
               
                 SEQRES 
                  3 
                 A 
                 113 
                 ALA 
                 SER 
                 PHE 
                 GLU 
                 LEU 
                 LYS 
                 ASP 
                 THR 
                 GLY 
                 TRP 
                 TYR 
                 ARG 
                 THR 
               
               
                 SEQRES 
                  4 
                 A 
                 113 
                 LYS 
                 LEU 
                 GLY 
                 SER 
                 THR 
                 ASN 
                 GLU 
                 GLN 
                 SER 
                 ILE 
                 SER 
                 ILE 
                 GLY 
               
               
                 SEQRES 
                  5 
                 A 
                 113 
                 GLY 
                 ARG 
                 TYR 
                 VAL 
                 GLU 
                 THR 
                 VAL 
                 ASN 
                 LYS 
                 GLY 
                 SER 
                 LYS 
                 SER 
               
               
                 SEQRES 
                  6 
                 A 
                 113 
                 PHE 
                 SER 
                 LEU 
                 ARG 
                 ILE 
                 SER 
                 ASP 
                 LEU 
                 ARG 
                 VAL 
                 GLU 
                 ASP 
                 SER 
               
               
                 SEQRES 
                  7 
                 A 
                 113 
                 GLY 
                 THR 
                 TYR 
                 LYS 
                 CYS 
                 GLN 
                 ALA 
                 PHE 
                 TYR 
                 SER 
                 LEU 
                 PRO 
                 LEU 
               
               
                 SEQRES 
                  8 
                 A 
                 113 
                 GLY 
                 ASP 
                 TYR 
                 ASN 
                 TYR 
                 SER 
                 LEU 
                 LEU 
                 PHE 
                 ARG 
                 GLY 
                 GLU 
                 LYS 
               
               
                 SEQRES 
                  9 
                 A 
                 113 
                 GLY 
                 ALA 
                 GLY 
                 THR 
                 ALA 
                 LEU 
                 THR 
                 VAL 
                 LYS 
               
               
                 SEQRES 
                  1 
                 B 
                 113 
                 ALA 
                 TRP 
                 VAL 
                 ASP 
                 GLN 
                 THR 
                 PRO 
                 ARG 
                 THR 
                 ALA 
                 THR 
                 LYS 
                 GLU 
               
               
                 SEQRES 
                  2 
                 B 
                 113 
                 THR 
                 GLY 
                 GLU 
                 SER 
                 LEU 
                 THR 
                 ILE 
                 ASN 
                 CYS 
                 VAL 
                 LEU 
                 ARG 
                 ASP 
               
               
                 SEQRES 
                  3 
                 B 
                 113 
                 ALA 
                 SER 
                 PHE 
                 GLU 
                 LEU 
                 LYS 
                 ASP 
                 THR 
                 GLY 
                 TRP 
                 TYR 
                 ARG 
                 THR 
               
               
                 SEQRES 
                  4 
                 B 
                 113 
                 LYS 
                 LEU 
                 GLY 
                 SER 
                 THR 
                 ASN 
                 GLU 
                 GLN 
                 SER 
                 ILE 
                 SER 
                 ILE 
                 GLY 
               
               
                 SEQRES 
                  5 
                 B 
                 113 
                 GLY 
                 ARG 
                 TYR 
                 VAL 
                 GLU 
                 THR 
                 VAL 
                 ASN 
                 LYS 
                 GLY 
                 SER 
                 LYS 
                 SER 
               
               
                 SEQRES 
                  6 
                 B 
                 113 
                 PHE 
                 SER 
                 LEU 
                 ARG 
                 ILE 
                 SER 
                 ASP 
                 LEU 
                 ARG 
                 VAL 
                 GLU 
                 ASP 
                 SER 
               
               
                 SEQRES 
                  7 
                 B 
                 113 
                 GLY 
                 THR 
                 TYR 
                 LYS 
                 CYS 
                 GLN 
                 ALA 
                 PHE 
                 TYR 
                 SER 
                 LEU 
                 PRO 
                 LEU 
               
               
                 SEQRES 
                  8 
                 B 
                 113 
                 GLY 
                 ASP 
                 TYR 
                 ASN 
                 TYR 
                 SER 
                 LEU 
                 LEU 
                 PHE 
                 ARG 
                 GLY 
                 GLU 
                 LYS 
               
               
                 SEQRES 
                  9 
                 B 
                 113 
                 GLY 
                 ALA 
                 GLY 
                 THR 
                 ALA 
                 LEU 
                 THR 
                 VAL 
                 LYS 
               
            
           
           
               
               
               
               
            
               
                 FORMUL 
                  3 
                  HOH 
                 *358(H2 O1) 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 HELIX 
                  1 
                 1 
                 ARG A 
                   
                   
                 74 
                 ASP A 
                   
                  77 
                  5 
                   
                   
                   
                   
                   
                   
                   
                   4 
               
               
                 HELIX 
                  2 
                 2 
                 ARG B 
                   
                   
                 74 
                 ASP B 
                   
                  77 
                  5 
                   
                   
                   
                   
                   
                   
                   
                   4 
               
               
                 SHEET 
                  1 
                 A 
                 4 
                 TRP 
                 A 
                  2 
                  THR 
                 A 
                  6 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 A 
                 4 
                 LEU 
                 A 
                  18 
                  ARG 
                 A 
                  25 
                 −1 
                 O 
                 ARG 
                 A 
                  25 
                 N 
                 TRP 
                 A 
                  2 
               
               
                 SHEET 
                  3 
                 A 
                 4 
                 SER 
                 A 
                  65 
                  ILE 
                 A 
                  70 
                 −1 
                 O 
                 LEU 
                 A 
                  68 
                 N 
                 ILE 
                 A 
                  20 
               
               
                 SHEET 
                  4 
                 A 
                 4 
                 TYR 
                 A 
                  55 
                  ASN 
                 A 
                  60 
                 −1 
                 N 
                 ASN 
                 A 
                  60 
                 O 
                 SER 
                 A 
                  65 
               
               
                 SHEET 
                  1 
                 B 
                 5 
                 THR 
                 A 
                  9 
                  GLU 
                 A 
                  13 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 B 
                 5 
                 THR 
                 A 
                 108 
                  LYS 
                 A 
                 113 
                  1 
                 O 
                 THR 
                 A 
                 111 
                 N 
                 LYS 
                 A 
                  12 
               
               
                 SHEET 
                  3 
                 B 
                 5 
                 GLY 
                 A 
                  79 
                  LEU 
                 A 
                  89 
                 −1 
                 N 
                 GLY 
                 A 
                  79 
                 O 
                 LEU 
                 A 
                 110 
               
               
                 SHEET 
                  4 
                 B 
                 5 
                 ASP 
                 A 
                  33 
                  LYS 
                 A 
                  40 
                 −1 
                 N 
                 TYR 
                 A 
                  37 
                 Q 
                 LYS 
                 A 
                  82 
               
               
                 SHEET 
                  5 
                 B 
                 5 
                 GLN 
                 A 
                  47 
                  SER 
                 A 
                  48 
                 −1 
                 O 
                 GLN 
                 A 
                  47 
                 N 
                 ARG 
                 A 
                  38 
               
               
                 SHEET 
                  1 
                 C 
                 4 
                 THR 
                 A 
                  9 
                  GLU 
                 A 
                  13 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 C 
                 4 
                 THR 
                 A 
                 108 
                  LYS 
                 A 
                 113 
                  1 
                 O 
                 THR 
                 A 
                 111 
                 N 
                 LYS 
                 A 
                  12 
               
               
                 SHEET 
                  3 
                 C 
                 4 
                 GLY 
                 A 
                  79 
                  LEU 
                 A 
                  89 
                 −1 
                 N 
                 GLY 
                 A 
                  79 
                 O 
                 LEU 
                 A 
                 110 
               
               
                 SHEET 
                  4 
                 C 
                 4 
                 LEU 
                 A 
                  98 
                  LYS 
                 A 
                 104 
                 −1 
                 O 
                 PHE 
                 A 
                 100 
                 N 
                 TYR 
                 A 
                  87 
               
               
                 SHEET 
                  1 
                 D 
                 4 
                 TRP 
                 B 
                  2 
                  THR 
                 B 
                  6 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 D 
                 4 
                 LEU 
                 B 
                  18 
                  ARG 
                 B 
                  25 
                 −1 
                 O 
                 ARG 
                 B 
                  25 
                 N 
                 TRP 
                 B 
                  2 
               
               
                 SHEET 
                  3 
                 D 
                 4 
                 SER 
                 B 
                  65 
                  ILE 
                 B 
                  70 
                 −1 
                 O 
                 ILE 
                 B 
                  70 
                 N 
                 LEU 
                 B 
                  18 
               
               
                 SHEET 
                  4 
                 D 
                 4 
                 TYR 
                 B 
                  55 
                  ASN 
                 B 
                  60 
                 −1 
                 N 
                 ASN 
                 B 
                  60 
                 O 
                 SER 
                 B 
                  65 
               
               
                 SHEET 
                  1 
                 E 
                 5 
                 THR 
                 B 
                  9 
                  GLU 
                 B 
                  13 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 E 
                 5 
                 THR 
                 B 
                 108 
                  LYS 
                 B 
                 113 
                  1 
                 O 
                 THR 
                 B 
                 111 
                 N 
                 LYS 
                 B 
                  12 
               
               
                 SHEET 
                  3 
                 E 
                 5 
                 GLY 
                 B 
                  79 
                  LEU 
                 B 
                  89 
                 −1 
                 N 
                 GLY 
                 B 
                  79 
                 O 
                 LEU 
                 B 
                 110 
               
               
                 SHEET 
                  4 
                 E 
                 5 
                 ASP 
                 B 
                  33 
                  LYS 
                 B 
                  40 
                 −1 
                 N 
                 TYR 
                 B 
                  37 
                 O 
                 LYS 
                 B 
                  82 
               
               
                 SHEET 
                  5 
                 E 
                 5 
                 GLN 
                 B 
                  47 
                  SER 
                 B 
                  48 
                 −1 
                 O 
                 GLN 
                 B 
                  47 
                 N 
                 ARG 
                 B 
                  38 
               
               
                 SHEET 
                  1 
                 F 
                 4 
                 THR 
                 B 
                  9 
                  GLU 
                 B 
                  13 
                  0 
                   
                   
                   
                   
                   
                   
                   
                   
               
               
                 SHEET 
                  2 
                 F 
                 4 
                 THR 
                 B 
                 108 
                  LYS 
                 B 
                 113 
                  1 
                 O 
                 THR 
                 B 
                 111 
                 N 
                 LYS 
                 B 
                  12 
               
               
                 SHEET 
                  3 
                 F 
                 4 
                 GLY 
                 B 
                  79 
                  LEU 
                 B 
                  89 
                 −1 
                 N 
                 GLY 
                 B 
                  79 
                 O 
                 LEU 
                 B 
                 110 
               
               
                 SHEET 
                  4 
                 F 
                 4 
                 LEU 
                 B 
                  98 
                  LYS 
                 B 
                 104 
                 −1 
                 O 
                 PHE 
                 B 
                 100 
                 N 
                 TYR 
                 B 
                  87 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
            
               
                 SSBOND 
                  1 
                 CYS 
                 A 
                 22 
                 CYS 
                 A 
                 83 
                   
                   
               
               
                 SSBOND 
                  2 
                 CYS 
                 B 
                 22 
                 CYS 
                 B 
                 83 
               
               
                 CISPEP 
                  1 
                 THR 
                 A 
                  6 
                 PRO 
                 A 
                  7 
                 0 
                 −8.21 
               
               
                 CISPEP 
                  2 
                 TYR 
                 A 
                 94 
                 ASN 
                 A 
                 95 
                 0 
                 −6.39 
               
               
                 CISPEP 
                  3 
                 THR 
                 B 
                  6 
                 PRO 
                 B 
                  7 
                 0 
                 −3.51 
               
               
                 CISPEP 
                  4 
                 PRO 
                 B 
                 90 
                 LEU 
                 B 
                 91 
                 0 
                  3.64 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
            
               
                 CRYST1 
                  65.283 
                 92.046 
                 98.224 
                 90.00 
                 90.00 
                 90.00 
                 I 21 
                 21 21 
                 16 
               
            
           
           
               
               
               
               
               
            
               
                 ORIGX1 
                  1.000000 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 ORIGX2 
                  0.000000 
                 1.000000 
                 0.000000 
                 0.00000 
               
               
                 ORIGX3 
                  0.000000 
                 0.000000 
                 1.000000 
                 0.00000 
               
               
                 SCALE1 
                  0.015318 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 SCALE2 
                  0.000000 
                 0.010864 
                 0.000000 
                 0.00000 
               
               
                 SCALE3 
                  0.000000 
                 0.000000 
                 0.010181 
                 0.00000 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 ATOM 
                 1 
                 N 
                 ALA 
                 A 
                 1 
                 −9.545 
                 39.140 
                 18.378 
                 1.00 
                 15.32 
                 N 
               
               
                 ATOM 
                 2 
                 CA 
                 ALA 
                 A 
                 1 
                 −8.794 
                 38.432 
                 19.437 
                 1.00 
                 16.13 
                 C 
               
               
                 ATOM 
                 3 
                 C 
                 ALA 
                 A 
                 1 
                 −7.548 
                 39.217 
                 19.826 
                 1.00 
                 16.68 
                 C 
               
               
                 ATOM 
                 4 
                 O 
                 ALA 
                 A 
                 1 
                 −7.010 
                 39.977 
                 19.012 
                 1.00 
                 16.60 
                 O 
               
               
                 ATOM 
                 5 
                 CB 
                 ALA 
                 A 
                 1 
                 −8.408 
                 37.046 
                 18.960 
                 1.00 
                 16.79 
                 C 
               
               
                 ATOM 
                 6 
                 N 
                 TRP 
                 A 
                 2 
                 −7.111 
                 39.048 
                 21.078 
                 1.00 
                 16.98 
                 N 
               
               
                 ATOM 
                 7 
                 CA 
                 TRP 
                 A 
                 2 
                 −5.862 
                 39.620 
                 21.552 
                 1.00 
                 17.64 
                 C 
               
               
                 ATOM 
                 8 
                 C 
                 TRP 
                 A 
                 2 
                 −5.260 
                 38.787 
                 22.680 
                 1.00 
                 18.87 
                 C 
               
               
                 ATOM 
                 9 
                 O 
                 TRP 
                 A 
                 2 
                 −5.963 
                 38.059 
                 23.370 
                 1.00 
                 19.72 
                 O 
               
               
                 ATOM 
                 10 
                 CB 
                 TRP 
                 A 
                 2 
                 −6.069 
                 41.092 
                 21.974 
                 1.00 
                 18.44 
                 C 
               
               
                 ATOM 
                 11 
                 CG 
                 TRP 
                 A 
                 2 
                 −6.976 
                 41.289 
                 23.105 
                 1.00 
                 18.44 
                 C 
               
               
                 ATOM 
                 12 
                 CD1 
                 TRP 
                 A 
                 2 
                 −8.346 
                 41.195 
                 23.092 
                 1.00 
                 21.94 
                 C 
               
               
                 ATOM 
                 13 
                 CD2 
                 TRP 
                 A 
                 2 
                 −6.613 
                 41.616 
                 24.447 
                 1.00 
                 19.52 
                 C 
               
               
                 ATOM 
                 14 
                 NE1 
                 TRP 
                 A 
                 2 
                 −8.849 
                 41.469 
                 24.338 
                 1.00 
                 22.38 
                 N 
               
               
                 ATOM 
                 15 
                 CE2 
                 TRP 
                 A 
                 2 
                 −7.811 
                 41.725 
                 25.193 
                 1.00 
                 20.62 
                 C 
               
               
                 ATOM 
                 16 
                 CE3 
                 TRP 
                 A 
                 2 
                 −5.399 
                 41.870 
                 25.095 
                 1.00 
                 18.50 
                 C 
               
               
                 ATOM 
                 17 
                 CZ2 
                 TRP 
                 A 
                 2 
                 −7.825 
                 42.048 
                 26.558 
                 1.00 
                 19.76 
                 C 
               
               
                 ATOM 
                 18 
                 CZ3 
                 TRP 
                 A 
                 2 
                 −5.422 
                 42.212 
                 26.453 
                 1.00 
                 20.59 
                 C 
               
               
                 ATOM 
                 19 
                 CH2 
                 TRP 
                 A 
                 2 
                 −6.625 
                 42.294 
                 27.161 
                 1.00 
                 18.64 
                 C 
               
               
                 ATOM 
                 20 
                 N 
                 VAL 
                 A 
                 3 
                 −3.943 
                 38.845 
                 22.809 
                 1.00 
                 19.14 
                 N 
               
               
                 ATOM 
                 21 
                 CA 
                 VAL 
                 A 
                 3 
                 −3.232 
                 38.167 
                 23.869 
                 1.00 
                 19.37 
                 C 
               
               
                 ATOM 
                 22 
                 C 
                 VAL 
                 A 
                 3 
                 −2.927 
                 39.147 
                 24.993 
                 1.00 
                 18.82 
                 C 
               
               
                 ATOM 
                 23 
                 O 
                 VAL 
                 A 
                 3 
                 −2.330 
                 40.236 
                 24.792 
                 1.00 
                 17.99 
                 O 
               
               
                 ATOM 
                 24 
                 CB 
                 VAL 
                 A 
                 3 
                 −1.929 
                 37.489 
                 23.381 
                 1.00 
                 19.52 
                 C 
               
               
                 ATOM 
                 25 
                 CG1 
                 VAL 
                 A 
                 3 
                 −1.186 
                 36.857 
                 24.535 
                 1.00 
                 20.40 
                 C 
               
               
                 ATOM 
                 26 
                 CG2 
                 VAL 
                 A 
                 3 
                 −2.251 
                 36.437 
                 22.333 
                 1.00 
                 18.97 
                 C 
               
               
                 ATOM 
                 27 
                 N 
                 ASP 
                 A 
                 4 
                 −3.365 
                 38.725 
                 26.175 
                 1.00 
                 17.88 
                 N 
               
               
                 ATOM 
                 28 
                 CA 
                 ASP 
                 A 
                 4 
                 −3.223 
                 39.473 
                 27.406 
                 1.00 
                 18.63 
                 C 
               
               
                 ATOM 
                 29 
                 C 
                 ASP 
                 A 
                 4 
                 −1.983 
                 38.946 
                 28.134 
                 1.00 
                 18.37 
                 C 
               
               
                 ATOM 
                 30 
                 O 
                 ASP 
                 A 
                 4 
                 −2.035 
                 37.909 
                 28.778 
                 1.00 
                 18.22 
                 O 
               
               
                 ATOM 
                 31 
                 CB 
                 ASP 
                 A 
                 4 
                 −4.489 
                 39.238 
                 28.221 
                 1.00 
                 19.11 
                 C 
               
               
                 ATOM 
                 32 
                 CG 
                 ASP 
                 A 
                 4 
                 −4.542 
                 40.031 
                 29.474 
                 1.00 
                 19.12 
                 C 
               
               
                 ATOM 
                 33 
                 OD1 
                 ASP 
                 A 
                 4 
                 −3.571 
                 40.746 
                 29.799 
                 1.00 
                 18.98 
                 O 
               
               
                 ATOM 
                 34 
                 OD2 
                 ASP 
                 A 
                 4 
                 −5.553 
                 40.002 
                 30.189 
                 1.00 
                 19.61 
                 O 
               
               
                 ATOM 
                 35 
                 N 
                 GLN 
                 A 
                 5 
                 −0.872 
                 39.673 
                 28.022 
                 1.00 
                 18.58 
                 N 
               
               
                 ATOM 
                 36 
                 CA 
                 GLN 
                 A 
                 5 
                 0.425 
                 39.258 
                 28.554 
                 1.00 
                 19.07 
                 C 
               
               
                 ATOM 
                 37 
                 C 
                 GLN 
                 A 
                 5 
                 0.820 
                 40.096 
                 29.787 
                 1.00 
                 19.50 
                 C 
               
               
                 ATOM 
                 38 
                 O 
                 GLN 
                 A 
                 5 
                 0.930 
                 41.331 
                 29.694 
                 1.00 
                 19.48 
                 O 
               
               
                 ATOM 
                 39 
                 CB 
                 GLN 
                 A 
                 5 
                 1.522 
                 39.386 
                 27.498 
                 1.00 
                 19.16 
                 C 
               
               
                 ATOM 
                 40 
                 CG 
                 GLN 
                 A 
                 5 
                 2.892 
                 38.959 
                 28.076 
                 1.00 
                 18.91 
                 C 
               
               
                 ATOM 
                 41 
                 CD 
                 GLN 
                 A 
                 5 
                 4.025 
                 38.930 
                 27.080 
                 1.00 
                 20.12 
                 C 
               
               
                 ATOM 
                 42 
                 OE1 
                 GLN 
                 A 
                 5 
                 3.808 
                 38.996 
                 25.860 
                 1.00 
                 19.01 
                 O 
               
               
                 ATOM 
                 43 
                 NE2 
                 GLN 
                 A 
                 5 
                 5.257 
                 38.774 
                 27.601 
                 1.00 
                 21.06 
                 N 
               
               
                 ATOM 
                 44 
                 N 
                 THR 
                 A 
                 6 
                 1.012 
                 39.408 
                 30.922 
                 1.00 
                 19.09 
                 N 
               
               
                 ATOM 
                 45 
                 CA 
                 THR 
                 A 
                 6 
                 1.455 
                 39.999 
                 32.185 
                 1.00 
                 19.10 
                 C 
               
               
                 ATOM 
                 46 
                 C 
                 THR 
                 A 
                 6 
                 2.649 
                 39.241 
                 32.756 
                 1.00 
                 18.83 
                 C 
               
               
                 ATOM 
                 47 
                 O 
                 THR 
                 A 
                 6 
                 2.811 
                 38.051 
                 32.503 
                 1.00 
                 18.32 
                 O 
               
               
                 ATOM 
                 48 
                 CB 
                 THR 
                 A 
                 6 
                 0.336 
                 39.996 
                 33.272 
                 1.00 
                 19.25 
                 C 
               
               
                 ATOM 
                 49 
                 OG1 
                 THR 
                 A 
                 6 
                 −0.242 
                 38.695 
                 33.415 
                 1.00 
                 20.21 
                 O 
               
               
                 ATOM 
                 50 
                 CG2 
                 THR 
                 A 
                 6 
                 −0.839 
                 40.879 
                 32.862 
                 1.00 
                 20.66 
                 C 
               
               
                 ATOM 
                 51 
                 N 
                 PRO 
                 A 
                 7 
                 3.490 
                 39.909 
                 33.536 
                 1.00 
                 18.47 
                 N 
               
               
                 ATOM 
                 52 
                 CA 
                 PRO 
                 A 
                 7 
                 3.446 
                 41.358 
                 33.746 
                 1.00 
                 18.39 
                 C 
               
               
                 ATOM 
                 53 
                 C 
                 PRO 
                 A 
                 7 
                 4.101 
                 42.136 
                 32.581 
                 1.00 
                 18.90 
                 C 
               
               
                 ATOM 
                 54 
                 O 
                 PRO 
                 A 
                 7 
                 4.863 
                 41.586 
                 31.800 
                 1.00 
                 19.06 
                 O 
               
               
                 ATOM 
                 55 
                 CB 
                 PRO 
                 A 
                 7 
                 4.249 
                 41.535 
                 35.035 
                 1.00 
                 18.51 
                 C 
               
               
                 ATOM 
                 56 
                 CG 
                 PRO 
                 A 
                 7 
                 5.270 
                 40.458 
                 34.979 
                 1.00 
                 18.08 
                 C 
               
               
                 ATOM 
                 57 
                 CD 
                 PRO 
                 A 
                 7 
                 4.567 
                 39.269 
                 34.305 
                 1.00 
                 18.29 
                 C 
               
               
                 ATOM 
                 58 
                 N 
                 ARG 
                 A 
                 8 
                 3.824 
                 43.428 
                 32.481 
                 1.00 
                 19.39 
                 N 
               
               
                 ATOM 
                 59 
                 CA 
                 ARG 
                 A 
                 8 
                 4.423 
                 44.236 
                 31.427 
                 1.00 
                 20.40 
                 C 
               
               
                 ATOM 
                 60 
                 C 
                 ARG 
                 A 
                 8 
                 5.901 
                 44.520 
                 31.671 
                 1.00 
                 20.17 
                 C 
               
               
                 ATOM 
                 61 
                 O 
                 ARG 
                 A 
                 8 
                 6.677 
                 44.614 
                 30.731 
                 1.00 
                 20.60 
                 O 
               
               
                 ATOM 
                 62 
                 CB 
                 ARG 
                 A 
                 8 
                 3.729 
                 45.562 
                 31.330 
                 1.00 
                 21.36 
                 C 
               
               
                 ATOM 
                 63 
                 CG 
                 ARG 
                 A 
                 8 
                 2.267 
                 45.512 
                 31.058 
                 1.00 
                 26.32 
                 C 
               
               
                 ATOM 
                 64 
                 CD 
                 ARG 
                 A 
                 8 
                 1.723 
                 46.911 
                 30.612 
                 1.00 
                 32.78 
                 C 
               
               
                 ATOM 
                 65 
                 NE 
                 ARG 
                 A 
                 8 
                 0.712 
                 46.823 
                 29.555 
                 1.00 
                 39.53 
                 N 
               
               
                 ATOM 
                 66 
                 CZ 
                 ARG 
                 A 
                 8 
                 0.909 
                 46.247 
                 28.363 
                 1.00 
                 41.67 
                 C 
               
               
                 ATOM 
                 67 
                 NH1 
                 ARG 
                 A 
                 8 
                 2.081 
                 45.690 
                 28.054 
                 1.00 
                 41.52 
                 N 
               
               
                 ATOM 
                 68 
                 NH2 
                 ARG 
                 A 
                 8 
                 −0.081 
                 46.223 
                 27.483 
                 1.00 
                 44.76 
                 N 
               
               
                 ATOM 
                 69 
                 N 
                 THR 
                 A 
                 9 
                 6.257 
                 44.755 
                 32.922 
                 1.00 
                 19.16 
                 N 
               
               
                 ATOM 
                 70 
                 CA 
                 THR 
                 A 
                 9 
                 7.650 
                 44.901 
                 33.306 
                 1.00 
                 19.79 
                 C 
               
               
                 ATOM 
                 71 
                 C 
                 THR 
                 A 
                 9 
                 7.915 
                 44.061 
                 34.546 
                 1.00 
                 19.40 
                 C 
               
               
                 ATOM 
                 72 
                 O 
                 THR 
                 A 
                 9 
                 7.002 
                 43.753 
                 35.316 
                 1.00 
                 19.52 
                 O 
               
               
                 ATOM 
                 73 
                 CB 
                 THR 
                 A 
                 9 
                 8.035 
                 46.376 
                 33.619 
                 1.00 
                 19.33 
                 C 
               
               
                 ATOM 
                 74 
                 OG1 
                 THR 
                 A 
                 9 
                 7.222 
                 46.871 
                 34.684 
                 1.00 
                 20.29 
                 O 
               
               
                 ATOM 
                 75 
                 CG2 
                 THR 
                 A 
                 9 
                 7.730 
                 47.333 
                 32.449 
                 1.00 
                 20.56 
                 C 
               
               
                 ATOM 
                 76 
                 N 
                 ALA 
                 A 
                 10 
                 9.181 
                 43.716 
                 34.731 
                 1.00 
                 19.17 
                 N 
               
               
                 ATOM 
                 77 
                 CA 
                 ALA 
                 A 
                 10 
                 9.621 
                 43.034 
                 35.927 
                 1.00 
                 18.67 
                 C 
               
               
                 ATOM 
                 78 
                 C 
                 ALA 
                 A 
                 10 
                 11.091 
                 43.315 
                 36.193 
                 1.00 
                 18.87 
                 C 
               
               
                 ATOM 
                 79 
                 O 
                 ALA 
                 A 
                 10 
                 11.874 
                 43.475 
                 35.265 
                 1.00 
                 18.47 
                 O 
               
               
                 ATOM 
                 80 
                 CB 
                 ALA 
                 A 
                 10 
                 9.388 
                 41.559 
                 35.780 
                 1.00 
                 18.21 
                 C 
               
               
                 ATOM 
                 81 
                 N 
                 THR 
                 A 
                 11 
                 11.434 
                 43.391 
                 37.479 
                 1.00 
                 19.55 
                 N 
               
               
                 ATOM 
                 82 
                 CA 
                 THR 
                 A 
                 11 
                 12.804 
                 43.457 
                 37.960 
                 1.00 
                 20.22 
                 C 
               
               
                 ATOM 
                 83 
                 C 
                 THR 
                 A 
                 11 
                 13.033 
                 42.289 
                 38.912 
                 1.00 
                 20.63 
                 C 
               
               
                 ATOM 
                 84 
                 O 
                 THR 
                 A 
                 11 
                 12.264 
                 42.070 
                 39.845 
                 1.00 
                 20.97 
                 O 
               
               
                 ATOM 
                 85 
                 CB 
                 THR 
                 A 
                 11 
                 13.033 
                 44.787 
                 38.690 
                 1.00 
                 20.37 
                 C 
               
               
                 ATOM 
                 86 
                 OG1 
                 THR 
                 A 
                 11 
                 12.846 
                 45.867 
                 37.770 
                 1.00 
                 20.04 
                 O 
               
               
                 ATOM 
                 87 
                 CG2 
                 THR 
                 A 
                 11 
                 14.489 
                 44.931 
                 39.151 
                 1.00 
                 20.37 
                 C 
               
               
                 ATOM 
                 88 
                 N 
                 LYS 
                 A 
                 12 
                 14.082 
                 41.530 
                 38.655 
                 1.00 
                 21.26 
                 N 
               
               
                 ATOM 
                 89 
                 CA 
                 LYS 
                 A 
                 12 
                 14.424 
                 40.372 
                 39.459 
                 1.00 
                 21.82 
                 C 
               
               
                 ATOM 
                 90 
                 C 
                 LYS 
                 A 
                 12 
                 15.893 
                 40.438 
                 39.791 
                 1.00 
                 22.04 
                 C 
               
               
                 ATOM 
                 91 
                 O 
                 LYS 
                 A 
                 12 
                 16.651 
                 41.144 
                 39.126 
                 1.00 
                 22.38 
                 O 
               
               
                 ATOM 
                 92 
                 CB 
                 LYS 
                 A 
                 12 
                 14.105 
                 39.091 
                 38.683 
                 1.00 
                 21.97 
                 C 
               
               
                 ATOM 
                 93 
                 CG 
                 LYS 
                 A 
                 12 
                 12.634 
                 38.936 
                 38.327 
                 1.00 
                 22.31 
                 C 
               
               
                 ATOM 
                 94 
                 CD 
                 LYS 
                 A 
                 12 
                 11.764 
                 38.741 
                 39.565 
                 1.00 
                 24.83 
                 C 
               
               
                 ATOM 
                 95 
                 CE 
                 LYS 
                 A 
                 12 
                 10.287 
                 38.577 
                 39.202 
                 1.00 
                 26.64 
                 C 
               
               
                 ATOM 
                 96 
                 NZ 
                 LYS 
                 A 
                 12 
                 9.480 
                 37.955 
                 40.305 
                 1.00 
                 29.33 
                 N 
               
               
                 ATOM 
                 97 
                 N 
                 GLU 
                 A 
                 13 
                 16.284 
                 39.750 
                 40.857 
                 1.00 
                 22.55 
                 N 
               
               
                 ATOM 
                 98 
                 CA 
                 GLU 
                 A 
                 13 
                 17.689 
                 39.566 
                 41.190 
                 1.00 
                 22.57 
                 C 
               
               
                 ATOM 
                 99 
                 C 
                 GLU 
                 A 
                 13 
                 18.116 
                 38.280 
                 40.506 
                 1.00 
                 22.01 
                 C 
               
               
                 ATOM 
                 100 
                 O 
                 GLU 
                 A 
                 13 
                 17.271 
                 37.462 
                 40.150 
                 1.00 
                 21.38 
                 O 
               
               
                 ATOM 
                 101 
                 CB 
                 GLU 
                 A 
                 13 
                 17.881 
                 39.456 
                 42.710 
                 1.00 
                 23.24 
                 C 
               
               
                 ATOM 
                 102 
                 CG 
                 GLU 
                 A 
                 13 
                 17.221 
                 40.587 
                 43.496 
                 1.00 
                 25.57 
                 C 
               
               
                 ATOM 
                 103 
                 CD 
                 GLU 
                 A 
                 13 
                 17.761 
                 40.775 
                 44.916 
                 1.00 
                 29.95 
                 C 
               
               
                 ATOM 
                 104 
                 OE1 
                 GLU 
                 A 
                 13 
                 18.899 
                 40.333 
                 45.239 
                 1.00 
                 31.64 
                 O 
               
               
                 ATOM 
                 105 
                 OE2 
                 GLU 
                 A 
                 13 
                 17.032 
                 41.393 
                 45.733 
                 1.00 
                 33.30 
                 O 
               
               
                 ATOM 
                 106 
                 N 
                 THR 
                 A 
                 14 
                 19.419 
                 38.098 
                 40.314 
                 1.00 
                 21.84 
                 N 
               
               
                 ATOM 
                 107 
                 CA 
                 THR 
                 A 
                 14 
                 19.942 
                 36.855 
                 39.760 
                 1.00 
                 21.60 
                 C 
               
               
                 ATOM 
                 108 
                 C 
                 THR 
                 A 
                 14 
                 19.574 
                 35.713 
                 40.711 
                 1.00 
                 21.52 
                 C 
               
               
                 ATOM 
                 109 
                 O 
                 THR 
                 A 
                 14 
                 19.536 
                 35.898 
                 41.932 
                 1.00 
                 20.88 
                 O 
               
               
                 ATOM 
                 110 
                 CB 
                 THR 
                 A 
                 14 
                 21.494 
                 36.916 
                 39.555 
                 1.00 
                 21.62 
                 C 
               
               
                 ATOM 
                 111 
                 OG1 
                 THR 
                 A 
                 14 
                 22.147 
                 37.283 
                 40.775 
                 1.00 
                 21.67 
                 O 
               
               
                 ATOM 
                 112 
                 CG2 
                 THR 
                 A 
                 14 
                 21.894 
                 38.012 
                 38.574 
                 1.00 
                 21.13 
                 C 
               
               
                 ATOM 
                 113 
                 N 
                 GLY 
                 A 
                 15 
                 19.249 
                 34.549 
                 40.150 
                 1.00 
                 21.90 
                 N 
               
               
                 ATOM 
                 114 
                 CA 
                 GLY 
                 A 
                 15 
                 18.859 
                 33.401 
                 40.955 
                 1.00 
                 22.03 
                 C 
               
               
                 ATOM 
                 115 
                 C 
                 GLY 
                 A 
                 15 
                 17.361 
                 33.283 
                 41.186 
                 1.00 
                 22.17 
                 C 
               
               
                 ATOM 
                 116 
                 O 
                 GLY 
                 A 
                 15 
                 16.888 
                 32.210 
                 41.554 
                 1.00 
                 21.94 
                 O 
               
               
                 ATOM 
                 117 
                 N 
                 GLU 
                 A 
                 16 
                 16.610 
                 34.369 
                 40.982 
                 1.00 
                 22.35 
                 N 
               
               
                 ATOM 
                 118 
                 CA 
                 GLU 
                 A 
                 16 
                 15.150 
                 34.339 
                 41.162 
                 1.00 
                 22.54 
                 C 
               
               
                 ATOM 
                 119 
                 C 
                 GLU 
                 A 
                 16 
                 14.486 
                 33.740 
                 39.927 
                 1.00 
                 22.68 
                 C 
               
               
                 ATOM 
                 120 
                 O 
                 GLU 
                 A 
                 16 
                 15.175 
                 33.386 
                 38.962 
                 1.00 
                 22.39 
                 O 
               
               
                 ATOM 
                 121 
                 CB 
                 GLU 
                 A 
                 16 
                 14.602 
                 35.749 
                 41.433 
                 1.00 
                 22.57 
                 C 
               
               
                 ATOM 
                 122 
                 CG 
                 GLU 
                 A 
                 16 
                 15.079 
                 36.337 
                 42.746 
                 1.00 
                 23.97 
                 C 
               
               
                 ATOM 
                 123 
                 CD 
                 GLU 
                 A 
                 16 
                 14.377 
                 37.629 
                 43.137 
                 1.00 
                 24.41 
                 C 
               
               
                 ATOM 
                 124 
                 OE1 
                 GLU 
                 A 
                 16 
                 14.028 
                 38.434 
                 42.262 
                 1.00 
                 22.72 
                 O 
               
               
                 ATOM 
                 125 
                 OE2 
                 GLU 
                 A 
                 16 
                 14.205 
                 37.853 
                 44.354 
                 1.00 
                 28.36 
                 O 
               
               
                 ATOM 
                 126 
                 N 
                 SER 
                 A 
                 17 
                 13.152 
                 33.630 
                 39.971 
                 1.00 
                 22.69 
                 N 
               
               
                 ATOM 
                 127 
                 CA 
                 SER 
                 A 
                 17 
                 12.336 
                 33.179 
                 38.838 
                 1.00 
                 22.73 
                 C 
               
               
                 ATOM 
                 128 
                 C 
                 SER 
                 A 
                 17 
                 11.374 
                 34.262 
                 38.378 
                 1.00 
                 21.71 
                 C 
               
               
                 ATOM 
                 129 
                 O 
                 SER 
                 A 
                 17 
                 10.951 
                 35.079 
                 39.167 
                 1.00 
                 21.49 
                 O 
               
               
                 ATOM 
                 130 
                 CB 
                 SER 
                 A 
                 17 
                 11.486 
                 31.970 
                 39.228 
                 1.00 
                 22.48 
                 C 
               
               
                 ATOM 
                 131 
                 OG 
                 SER 
                 A 
                 17 
                 12.316 
                 30.895 
                 39.591 
                 1.00 
                 26.64 
                 O 
               
               
                 ATOM 
                 132 
                 N 
                 LEU 
                 A 
                 18 
                 11.030 
                 34.234 
                 37.092 
                 1.00 
                 21.08 
                 N 
               
               
                 ATOM 
                 133 
                 CA 
                 LEU 
                 A 
                 18 
                 9.965 
                 35.047 
                 36.536 
                 1.00 
                 20.89 
                 C 
               
               
                 ATOM 
                 134 
                 C 
                 LEU 
                 A 
                 18 
                 8.886 
                 34.144 
                 35.952 
                 1.00 
                 20.71 
                 C 
               
               
                 ATOM 
                 135 
                 O 
                 LEU 
                 A 
                 18 
                 9.189 
                 33.225 
                 35.204 
                 1.00 
                 21.21 
                 O 
               
               
                 ATOM 
                 136 
                 CB 
                 LEU 
                 A 
                 18 
                 10.519 
                 35.882 
                 35.402 
                 1.00 
                 21.29 
                 C 
               
               
                 ATOM 
                 137 
                 CG 
                 LEU 
                 A 
                 18 
                 9.809 
                 37.138 
                 34.870 
                 1.00 
                 21.60 
                 C 
               
               
                 ATOM 
                 138 
                 CD1 
                 LEU 
                 A 
                 18 
                 9.814 
                 37.122 
                 33.381 
                 1.00 
                 21.64 
                 C 
               
               
                 ATOM 
                 139 
                 CD2 
                 LEU 
                 A 
                 18 
                 8.433 
                 37.400 
                 35.427 
                 1.00 
                 23.34 
                 C 
               
               
                 ATOM 
                 140 
                 N 
                 THR 
                 A 
                 19 
                 7.630 
                 34.423 
                 36.251 
                 1.00 
                 20.13 
                 N 
               
               
                 ATOM 
                 141 
                 CA 
                 THR 
                 A 
                 19 
                 6.526 
                 33.784 
                 35.550 
                 1.00 
                 19.98 
                 C 
               
               
                 ATOM 
                 142 
                 C 
                 THR 
                 A 
                 19 
                 5.861 
                 34.824 
                 34.686 
                 1.00 
                 19.47 
                 C 
               
               
                 ATOM 
                 143 
                 O 
                 THR 
                 A 
                 19 
                 5.528 
                 35.897 
                 35.160 
                 1.00 
                 20.11 
                 O 
               
               
                 ATOM 
                 144 
                 CB 
                 THR 
                 A 
                 19 
                 5.553 
                 33.199 
                 36.573 
                 1.00 
                 20.46 
                 C 
               
               
                 ATOM 
                 145 
                 OG1 
                 THR 
                 A 
                 19 
                 6.197 
                 32.115 
                 37.255 
                 1.00 
                 17.99 
                 O 
               
               
                 ATOM 
                 146 
                 CG2 
                 THR 
                 A 
                 19 
                 4.325 
                 32.538 
                 35.876 
                 1.00 
                 19.65 
                 C 
               
               
                 ATOM 
                 147 
                 N 
                 ILE 
                 A 
                 20 
                 5.710 
                 34.538 
                 33.403 
                 1.00 
                 19.31 
                 N 
               
               
                 ATOM 
                 148 
                 CA 
                 ILE 
                 A 
                 20 
                 4.965 
                 35.398 
                 32.489 
                 1.00 
                 18.89 
                 C 
               
               
                 ATOM 
                 149 
                 C 
                 ILE 
                 A 
                 20 
                 3.702 
                 34.640 
                 32.137 
                 1.00 
                 18.68 
                 C 
               
               
                 ATOM 
                 150 
                 O 
                 ILE 
                 A 
                 20 
                 3.780 
                 33.481 
                 31.737 
                 1.00 
                 18.03 
                 O 
               
               
                 ATOM 
                 151 
                 CB 
                 ILE 
                 A 
                 20 
                 5.765 
                 35.676 
                 31.218 
                 1.00 
                 18.83 
                 C 
               
               
                 ATOM 
                 152 
                 CG1 
                 ILE 
                 A 
                 20 
                 7.142 
                 36.265 
                 31.574 
                 1.00 
                 21.66 
                 C 
               
               
                 ATOM 
                 153 
                 CG2 
                 ILE 
                 A 
                 20 
                 4.935 
                 36.550 
                 30.252 
                 1.00 
                 19.66 
                 C 
               
               
                 ATOM 
                 154 
                 CD1 
                 ILE 
                 A 
                 20 
                 8.099 
                 36.433 
                 30.374 
                 1.00 
                 23.01 
                 C 
               
               
                 ATOM 
                 155 
                 N 
                 ASN 
                 A 
                 21 
                 2.549 
                 35.293 
                 32.277 
                 1.00 
                 18.35 
                 N 
               
               
                 ATOM 
                 156 
                 CA 
                 ASN 
                 A 
                 21 
                 1.260 
                 34.685 
                 31.989 
                 1.00 
                 19.67 
                 C 
               
               
                 ATOM 
                 157 
                 C 
                 ASN 
                 A 
                 21 
                 0.644 
                 35.318 
                 30.746 
                 1.00 
                 20.00 
                 C 
               
               
                 ATOM 
                 158 
                 O 
                 ASN 
                 A 
                 21 
                 0.570 
                 36.546 
                 30.640 
                 1.00 
                 20.11 
                 O 
               
               
                 ATOM 
                 159 
                 CB 
                 ASN 
                 A 
                 21 
                 0.310 
                 34.883 
                 33.179 
                 1.00 
                 20.34 
                 C 
               
               
                 ATOM 
                 160 
                 CG 
                 ASN 
                 A 
                 21 
                 0.743 
                 34.107 
                 34.414 
                 1.00 
                 23.88 
                 C 
               
               
                 ATOM 
                 161 
                 OD1 
                 ASN 
                 A 
                 21 
                 0.884 
                 32.884 
                 34.364 
                 1.00 
                 27.13 
                 O 
               
               
                 ATOM 
                 162 
                 ND2 
                 ASN 
                 A 
                 21 
                 0.943 
                 34.807 
                 35.531 
                 1.00 
                 22.89 
                 N 
               
               
                 ATOM 
                 163 
                 N 
                 CYS 
                 A 
                 22 
                 0.155 
                 34.472 
                 29.841 
                 1.00 
                 19.78 
                 N 
               
               
                 ATOM 
                 164 
                 CA 
                 CYS 
                 A 
                 22 
                 −0.550 
                 34.913 
                 28.653 
                 1.00 
                 18.87 
                 C 
               
               
                 ATOM 
                 165 
                 C 
                 CYS 
                 A 
                 22 
                 −1.932 
                 34.294 
                 28.600 
                 1.00 
                 18.28 
                 C 
               
               
                 ATOM 
                 166 
                 O 
                 CYS 
                 A 
                 22 
                 −2.099 
                 33.099 
                 28.874 
                 1.00 
                 18.57 
                 O 
               
               
                 ATOM 
                 167 
                 CB 
                 CYS 
                 A 
                 22 
                 0.251 
                 34.591 
                 27.375 
                 1.00 
                 18.23 
                 C 
               
               
                 ATOM 
                 168 
                 SG 
                 CYS 
                 A 
                 22 
                 1.687 
                 35.685 
                 27.122 
                 1.00 
                 22.18 
                 S 
               
               
                 ATOM 
                 169 
                 N 
                 VAL 
                 A 
                 23 
                 −2.930 
                 35.099 
                 28.241 
                 1.00 
                 17.04 
                 N 
               
               
                 ATOM 
                 170 
                 CA 
                 VAL 
                 A 
                 23 
                 −4.289 
                 34.573 
                 28.085 
                 1.00 
                 17.69 
                 C 
               
               
                 ATOM 
                 171 
                 C 
                 VAL 
                 A 
                 23 
                 −4.780 
                 35.074 
                 26.736 
                 1.00 
                 17.84 
                 C 
               
               
                 ATOM 
                 172 
                 O 
                 VAL 
                 A 
                 23 
                 −4.752 
                 36.272 
                 26.452 
                 1.00 
                 17.82 
                 O 
               
               
                 ATOM 
                 173 
                 CB 
                 VAL 
                 A 
                 23 
                 −5.257 
                 35.034 
                 29.209 
                 1.00 
                 16.92 
                 C 
               
               
                 ATOM 
                 174 
                 CG1 
                 VAL 
                 A 
                 23 
                 −6.628 
                 34.402 
                 29.040 
                 1.00 
                 16.56 
                 C 
               
               
                 ATOM 
                 175 
                 CG2 
                 VAL 
                 A 
                 23 
                 −4.682 
                 34.676 
                 30.574 
                 1.00 
                 18.84 
                 C 
               
               
                 ATOM 
                 176 
                 N 
                 LEU 
                 A 
                 24 
                 −5.205 
                 34.150 
                 25.896 
                 1.00 
                 18.50 
                 N 
               
               
                 ATOM 
                 177 
                 CA 
                 LEU 
                 A 
                 24 
                 −5.848 
                 34.505 
                 24.625 
                 1.00 
                 18.68 
                 C 
               
               
                 ATOM 
                 178 
                 C 
                 LEU 
                 A 
                 24 
                 −7.287 
                 34.970 
                 24.888 
                 1.00 
                 18.14 
                 C 
               
               
                 ATOM 
                 179 
                 O 
                 LEU 
                 A 
                 24 
                 −8.116 
                 34.183 
                 25.284 
                 1.00 
                 18.93 
                 O 
               
               
                 ATOM 
                 180 
                 CB 
                 LEU 
                 A 
                 24 
                 −5.870 
                 33.273 
                 23.754 
                 1.00 
                 19.49 
                 C 
               
               
                 ATOM 
                 181 
                 CG 
                 LEU 
                 A 
                 24 
                 −5.907 
                 33.369 
                 22.218 
                 1.00 
                 21.72 
                 C 
               
               
                 ATOM 
                 182 
                 CD1 
                 LEU 
                 A 
                 24 
                 −6.724 
                 32.226 
                 21.629 
                 1.00 
                 21.29 
                 C 
               
               
                 ATOM 
                 183 
                 CD2 
                 LEU 
                 A 
                 24 
                 −6.311 
                 34.697 
                 21.692 
                 1.00 
                 20.69 
                 C 
               
               
                 ATOM 
                 184 
                 N 
                 ARG 
                 A 
                 25 
                 −7.569 
                 36.242 
                 24.642 
                 1.00 
                 17.64 
                 N 
               
               
                 ATOM 
                 185 
                 CA 
                 ARG 
                 A 
                 25 
                 −8.868 
                 36.862 
                 24.894 
                 1.00 
                 17.04 
                 C 
               
               
                 ATOM 
                 186 
                 C 
                 ARG 
                 A 
                 25 
                 −9.727 
                 37.050 
                 23.621 
                 1.00 
                 17.73 
                 C 
               
               
                 ATOM 
                 187 
                 O 
                 ARG 
                 A 
                 25 
                 −9.215 
                 37.396 
                 22.549 
                 1.00 
                 16.17 
                 O 
               
               
                 ATOM 
                 188 
                 CB 
                 ARG 
                 A 
                 25 
                 −8.647 
                 38.248 
                 25.479 
                 1.00 
                 17.56 
                 C 
               
               
                 ATOM 
                 189 
                 CG 
                 ARG 
                 A 
                 25 
                 −7.649 
                 38.332 
                 26.652 
                 1.00 
                 17.53 
                 C 
               
               
                 ATOM 
                 190 
                 CD 
                 ARG 
                 A 
                 25 
                 −8.169 
                 37.706 
                 27.893 
                 1.00 
                 15.71 
                 C 
               
               
                 ATOM 
                 191 
                 NE 
                 ARG 
                 A 
                 25 
                 −9.439 
                 38.300 
                 28.305 
                 1.00 
                 15.64 
                 N 
               
               
                 ATOM 
                 192 
                 CZ 
                 ARG 
                 A 
                 25 
                 −9.622 
                 39.154 
                 29.313 
                 1.00 
                 14.07 
                 C 
               
               
                 ATOM 
                 193 
                 NH1 
                 ARG 
                 A 
                 25 
                 −8.604 
                 39.617 
                 30.029 
                 1.00 
                 15.08 
                 N 
               
               
                 ATOM 
                 194 
                 NH2 
                 ARG 
                 A 
                 25 
                 −10.841 
                 39.592 
                 29.562 
                 1.00 
                 13.06 
                 N 
               
               
                 ATOM 
                 195 
                 N 
                 ASP 
                 A 
                 26 
                 −11.036 
                 36.867 
                 23.764 
                 1.00 
                 18.00 
                 N 
               
               
                 ATOM 
                 196 
                 CA 
                 ASP 
                 A 
                 26 
                 −11.988 
                 37.148 
                 22.696 
                 1.00 
                 19.25 
                 C 
               
               
                 ATOM 
                 197 
                 C 
                 ASP 
                 A 
                 26 
                 −11.575 
                 36.398 
                 21.429 
                 1.00 
                 19.75 
                 C 
               
               
                 ATOM 
                 198 
                 O 
                 ASP 
                 A 
                 26 
                 −11.446 
                 36.979 
                 20.340 
                 1.00 
                 20.42 
                 O 
               
               
                 ATOM 
                 199 
                 CB 
                 ASP 
                 A 
                 26 
                 −12.075 
                 38.658 
                 22.424 
                 1.00 
                 19.21 
                 C 
               
               
                 ATOM 
                 200 
                 CG 
                 ASP 
                 A 
                 26 
                 −13.200 
                 39.012 
                 21.457 
                 1.00 
                 21.12 
                 C 
               
               
                 ATOM 
                 201 
                 OD1 
                 ASP 
                 A 
                 26 
                 −13.038 
                 39.948 
                 20.634 
                 1.00 
                 23.28 
                 O 
               
               
                 ATOM 
                 202 
                 OD2 
                 ASP 
                 A 
                 26 
                 −14.288 
                 38.390 
                 21.446 
                 1.00 
                 22.43 
                 O 
               
               
                 ATOM 
                 203 
                 N 
                 ALA 
                 A 
                 27 
                 −11.367 
                 35.101 
                 21.596 
                 1.00 
                 19.84 
                 N 
               
               
                 ATOM 
                 204 
                 CA 
                 ALA 
                 A 
                 27 
                 −10.842 
                 34.247 
                 20.552 
                 1.00 
                 20.65 
                 C 
               
               
                 ATOM 
                 205 
                 C 
                 ALA 
                 A 
                 27 
                 −11.891 
                 33.953 
                 19.486 
                 1.00 
                 21.01 
                 C 
               
               
                 ATOM 
                 206 
                 O 
                 ALA 
                 A 
                 27 
                 −13.064 
                 33.807 
                 19.789 
                 1.00 
                 21.53 
                 O 
               
               
                 ATOM 
                 207 
                 CB 
                 ALA 
                 A 
                 27 
                 −10.311 
                 32.928 
                 21.173 
                 1.00 
                 20.13 
                 C 
               
               
                 ATOM 
                 208 
                 N 
                 SER 
                 A 
                 28 
                 −11.453 
                 33.887 
                 18.233 
                 1.00 
                 21.92 
                 N 
               
               
                 ATOM 
                 209 
                 CA 
                 SER 
                 A 
                 28 
                 −12.274 
                 33.408 
                 17.128 
                 1.00 
                 22.37 
                 C 
               
               
                 ATOM 
                 210 
                 C 
                 SER 
                 A 
                 28 
                 −11.935 
                 31.949 
                 16.842 
                 1.00 
                 22.77 
                 C 
               
               
                 ATOM 
                 211 
                 O 
                 SER 
                 A 
                 28 
                 −12.830 
                 31.137 
                 16.616 
                 1.00 
                 23.65 
                 O 
               
               
                 ATOM 
                 212 
                 CB 
                 SER 
                 A 
                 28 
                 −12.036 
                 34.237 
                 15.853 
                 1.00 
                 22.37 
                 C 
               
               
                 ATOM 
                 213 
                 OG 
                 SER 
                 A 
                 28 
                 −12.317 
                 35.605 
                 16.069 
                 1.00 
                 22.84 
                 O 
               
               
                 ATOM 
                 214 
                 N 
                 PHE 
                 A 
                 29 
                 −10.641 
                 31.638 
                 16.835 
                 1.00 
                 22.53 
                 N 
               
               
                 ATOM 
                 215 
                 CA 
                 PHE 
                 A 
                 29 
                 −10.137 
                 30.321 
                 16.469 
                 1.00 
                 22.25 
                 C 
               
               
                 ATOM 
                 216 
                 C 
                 PHE 
                 A 
                 29 
                 −9.596 
                 29.606 
                 17.697 
                 1.00 
                 22.55 
                 C 
               
               
                 ATOM 
                 217 
                 O 
                 PHE 
                 A 
                 29 
                 −9.297 
                 30.236 
                 18.716 
                 1.00 
                 21.65 
                 O 
               
               
                 ATOM 
                 218 
                 CB 
                 PHE 
                 A 
                 29 
                 −9.050 
                 30.465 
                 15.410 
                 1.00 
                 21.99 
                 C 
               
               
                 ATOM 
                 219 
                 CG 
                 PHE 
                 A 
                 29 
                 −9.491 
                 31.247 
                 14.202 
                 1.00 
                 22.87 
                 C 
               
               
                 ATOM 
                 220 
                 CD1 
                 PHE 
                 A 
                 29 
                 −10.415 
                 30.715 
                 13.324 
                 1.00 
                 22.45 
                 C 
               
               
                 ATOM 
                 221 
                 CD2 
                 PHE 
                 A 
                 29 
                 −8.999 
                 32.528 
                 13.959 
                 1.00 
                 22.23 
                 C 
               
               
                 ATOM 
                 222 
                 CE1 
                 PHE 
                 A 
                 29 
                 −10.841 
                 31.441 
                 12.224 
                 1.00 
                 23.02 
                 C 
               
               
                 ATOM 
                 223 
                 CE2 
                 PHE 
                 A 
                 29 
                 −9.409 
                 33.249 
                 12.861 
                 1.00 
                 22.01 
                 C 
               
               
                 ATOM 
                 224 
                 CZ 
                 PHE 
                 A 
                 29 
                 −10.333 
                 32.715 
                 11.992 
                 1.00 
                 23.18 
                 C 
               
               
                 ATOM 
                 225 
                 N 
                 GLU 
                 A 
                 30 
                 −9.487 
                 28.285 
                 17.594 
                 1.00 
                 23.28 
                 N 
               
               
                 ATOM 
                 226 
                 CA 
                 GLU 
                 A 
                 30 
                 −9.087 
                 27.435 
                 18.716 
                 1.00 
                 24.16 
                 C 
               
               
                 ATOM 
                 227 
                 C 
                 GLU 
                 A 
                 30 
                 −7.578 
                 27.456 
                 18.866 
                 1.00 
                 23.70 
                 C 
               
               
                 ATOM 
                 228 
                 O 
                 GLU 
                 A 
                 30 
                 −6.846 
                 27.260 
                 17.901 
                 1.00 
                 22.38 
                 O 
               
               
                 ATOM 
                 229 
                 CB 
                 GLU 
                 A 
                 30 
                 −9.509 
                 25.975 
                 18.500 
                 1.00 
                 24.28 
                 C 
               
               
                 ATOM 
                 230 
                 CG 
                 GLU 
                 A 
                 30 
                 −10.965 
                 25.743 
                 18.147 
                 1.00 
                 27.72 
                 C 
               
               
                 ATOM 
                 231 
                 CD 
                 GLU 
                 A 
                 30 
                 −11.183 
                 24.367 
                 17.543 
                 1.00 
                 30.78 
                 C 
               
               
                 ATOM 
                 232 
                 OE1 
                 GLU 
                 A 
                 30 
                 −11.872 
                 24.247 
                 16.501 
                 1.00 
                 33.08 
                 O 
               
               
                 ATOM 
                 233 
                 OE2 
                 GLU 
                 A 
                 30 
                 −10.648 
                 23.395 
                 18.122 
                 1.00 
                 34.13 
                 O 
               
               
                 ATOM 
                 234 
                 N 
                 LEU 
                 A 
                 31 
                 −7.110 
                 27.670 
                 20.083 
                 1.00 
                 25.10 
                 N 
               
               
                 ATOM 
                 235 
                 CA 
                 LEU 
                 A 
                 31 
                 −5.674 
                 27.654 
                 20.347 
                 1.00 
                 25.75 
                 C 
               
               
                 ATOM 
                 236 
                 C 
                 LEU 
                 A 
                 31 
                 −5.098 
                 26.262 
                 20.072 
                 1.00 
                 26.30 
                 C 
               
               
                 ATOM 
                 237 
                 O 
                 LEU 
                 A 
                 31 
                 −5.584 
                 25.272 
                 20.610 
                 1.00 
                 27.18 
                 O 
               
               
                 ATOM 
                 238 
                 CB 
                 LEU 
                 A 
                 31 
                 −5.412 
                 28.059 
                 21.791 
                 1.00 
                 26.27 
                 C 
               
               
                 ATOM 
                 239 
                 CG 
                 LEU 
                 A 
                 31 
                 −3.944 
                 28.189 
                 22.199 
                 1.00 
                 26.18 
                 C 
               
               
                 ATOM 
                 240 
                 CD1 
                 LEU 
                 A 
                 31 
                 −3.256 
                 29.266 
                 21.376 
                 1.00 
                 27.21 
                 C 
               
               
                 ATOM 
                 241 
                 CD2 
                 LEU 
                 A 
                 31 
                 −3.871 
                 28.497 
                 23.665 
                 1.00 
                 24.85 
                 C 
               
               
                 ATOM 
                 242 
                 N 
                 LYS 
                 A 
                 32 
                 −4.093 
                 26.191 
                 19.204 
                 1.00 
                 26.63 
                 N 
               
               
                 ATOM 
                 243 
                 CA 
                 LYS 
                 A 
                 32 
                 −3.472 
                 24.920 
                 18.830 
                 1.00 
                 27.19 
                 C 
               
               
                 ATOM 
                 244 
                 C 
                 LYS 
                 A 
                 32 
                 −2.050 
                 24.735 
                 19.399 
                 1.00 
                 27.32 
                 C 
               
               
                 ATOM 
                 245 
                 O 
                 LYS 
                 A 
                 32 
                 −1.738 
                 23.676 
                 19.959 
                 1.00 
                 29.44 
                 O 
               
               
                 ATOM 
                 246 
                 CB 
                 LYS 
                 A 
                 32 
                 −3.465 
                 24.784 
                 17.311 
                 1.00 
                 27.22 
                 C 
               
               
                 ATOM 
                 247 
                 CG 
                 LYS 
                 A 
                 32 
                 −4.868 
                 24.598 
                 16.683 
                 1.00 
                 28.87 
                 C 
               
               
                 ATOM 
                 248 
                 CD 
                 LYS 
                 A 
                 32 
                 −5.729 
                 23.562 
                 17.425 
                 1.00 
                 30.06 
                 C 
               
               
                 ATOM 
                 249 
                 CE 
                 LYS 
                 A 
                 32 
                 −7.067 
                 23.300 
                 16.738 
                 1.00 
                 31.53 
                 C 
               
               
                 ATOM 
                 250 
                 NZ 
                 LYS 
                 A 
                 32 
                 −8.044 
                 22.702 
                 17.719 
                 1.00 
                 32.23 
                 N 
               
               
                 ATOM 
                 251 
                 N 
                 ASP 
                 A 
                 33 
                 −1.205 
                 25.745 
                 19.235 
                 1.00 
                 25.91 
                 N 
               
               
                 ATOM 
                 252 
                 CA 
                 ASP 
                 A 
                 33 
                 0.173 
                 25.738 
                 19.692 
                 1.00 
                 25.17 
                 C 
               
               
                 ATOM 
                 253 
                 C 
                 ASP 
                 A 
                 33 
                 0.501 
                 27.137 
                 20.232 
                 1.00 
                 24.01 
                 C 
               
               
                 ATOM 
                 254 
                 O 
                 ASP 
                 A 
                 33 
                 −0.299 
                 28.066 
                 20.103 
                 1.00 
                 22.47 
                 O 
               
               
                 ATOM 
                 255 
                 CB 
                 ASP 
                 A 
                 33 
                 1.128 
                 25.388 
                 18.555 
                 1.00 
                 25.62 
                 C 
               
               
                 ATOM 
                 256 
                 CG 
                 ASP 
                 A 
                 33 
                 2.537 
                 24.989 
                 19.043 
                 1.00 
                 28.98 
                 C 
               
               
                 ATOM 
                 257 
                 OD1 
                 ASP 
                 A 
                 33 
                 2.698 
                 24.558 
                 20.216 
                 1.00 
                 32.36 
                 O 
               
               
                 ATOM 
                 258 
                 OD2 
                 ASP 
                 A 
                 33 
                 3.560 
                 25.093 
                 18.322 
                 1.00 
                 32.29 
                 O 
               
               
                 ATOM 
                 259 
                 N 
                 THR 
                 A 
                 34 
                 1.662 
                 27.243 
                 20.872 
                 1.00 
                 22.48 
                 N 
               
               
                 ATOM 
                 260 
                 CA 
                 THR 
                 A 
                 34 
                 2.151 
                 28.470 
                 21.460 
                 1.00 
                 22.17 
                 C 
               
               
                 ATOM 
                 261 
                 C 
                 THR 
                 A 
                 34 
                 3.646 
                 28.602 
                 21.244 
                 1.00 
                 21.74 
                 C 
               
               
                 ATOM 
                 262 
                 O 
                 THR 
                 A 
                 34 
                 4.358 
                 27.618 
                 21.122 
                 1.00 
                 21.43 
                 O 
               
               
                 ATOM 
                 263 
                 CB 
                 THR 
                 A 
                 34 
                 1.888 
                 28.485 
                 22.961 
                 1.00 
                 21.97 
                 C 
               
               
                 ATOM 
                 264 
                 OG1 
                 THR 
                 A 
                 34 
                 2.412 
                 27.294 
                 23.557 
                 1.00 
                 23.15 
                 O 
               
               
                 ATOM 
                 265 
                 CG2 
                 THR 
                 A 
                 34 
                 0.409 
                 28.455 
                 23.278 
                 1.00 
                 22.95 
                 C 
               
               
                 ATOM 
                 266 
                 N 
                 GLY 
                 A 
                 35 
                 4.121 
                 29.838 
                 21.250 
                 1.00 
                 21.66 
                 N 
               
               
                 ATOM 
                 267 
                 CA 
                 GLY 
                 A 
                 35 
                 5.534 
                 30.118 
                 21.096 
                 1.00 
                 21.46 
                 C 
               
               
                 ATOM 
                 268 
                 C 
                 GLY 
                 A 
                 35 
                 5.966 
                 31.234 
                 22.008 
                 1.00 
                 20.74 
                 C 
               
               
                 ATOM 
                 269 
                 O 
                 GLY 
                 A 
                 35 
                 5.136 
                 32.033 
                 22.416 
                 1.00 
                 21.18 
                 O 
               
               
                 ATOM 
                 270 
                 N 
                 TRP 
                 A 
                 36 
                 7.261 
                 31.259 
                 22.322 
                 1.00 
                 20.14 
                 N 
               
               
                 ATOM 
                 271 
                 CA 
                 TRP 
                 A 
                 36 
                 7.865 
                 32.251 
                 23.196 
                 1.00 
                 19.89 
                 C 
               
               
                 ATOM 
                 272 
                 C 
                 TRP 
                 A 
                 36 
                 9.108 
                 32.819 
                 22.516 
                 1.00 
                 20.02 
                 C 
               
               
                 ATOM 
                 273 
                 O 
                 TRP 
                 A 
                 36 
                 9.907 
                 32.078 
                 21.925 
                 1.00 
                 19.67 
                 O 
               
               
                 ATOM 
                 274 
                 CB 
                 TRP 
                 A 
                 36 
                 8.209 
                 31.632 
                 24.541 
                 1.00 
                 19.58 
                 C 
               
               
                 ATOM 
                 275 
                 CG 
                 TRP 
                 A 
                 36 
                 6.975 
                 31.292 
                 25.283 
                 1.00 
                 20.08 
                 C 
               
               
                 ATOM 
                 276 
                 CD1 
                 TRP 
                 A 
                 36 
                 6.239 
                 30.125 
                 25.181 
                 1.00 
                 17.81 
                 C 
               
               
                 ATOM 
                 277 
                 CD2 
                 TRP 
                 A 
                 36 
                 6.255 
                 32.141 
                 26.182 
                 1.00 
                 19.53 
                 C 
               
               
                 ATOM 
                 278 
                 NE1 
                 TRP 
                 A 
                 36 
                 5.123 
                 30.216 
                 25.975 
                 1.00 
                 17.93 
                 N 
               
               
                 ATOM 
                 279 
                 CE2 
                 TRP 
                 A 
                 36 
                 5.116 
                 31.426 
                 26.619 
                 1.00 
                 20.01 
                 C 
               
               
                 ATOM 
                 280 
                 CE3 
                 TRP 
                 A 
                 36 
                 6.462 
                 33.427 
                 26.678 
                 1.00 
                 20.31 
                 C 
               
               
                 ATOM 
                 281 
                 CZ2 
                 TRP 
                 A 
                 36 
                 4.208 
                 31.954 
                 27.537 
                 1.00 
                 17.18 
                 C 
               
               
                 ATOM 
                 282 
                 CZ3 
                 TRP 
                 A 
                 36 
                 5.576 
                 33.940 
                 27.584 
                 1.00 
                 18.90 
                 C 
               
               
                 ATOM 
                 283 
                 CH2 
                 TRP 
                 A 
                 36 
                 4.447 
                 33.216 
                 27.997 
                 1.00 
                 20.01 
                 C 
               
               
                 ATOM 
                 284 
                 N 
                 TYR 
                 A 
                 37 
                 9.237 
                 34.132 
                 22.568 
                 1.00 
                 19.65 
                 N 
               
               
                 ATOM 
                 285 
                 CA 
                 TYR 
                 A 
                 37 
                 10.324 
                 34.829 
                 21.888 
                 1.00 
                 20.62 
                 C 
               
               
                 ATOM 
                 286 
                 C 
                 TYR 
                 A 
                 37 
                 10.939 
                 35.874 
                 22.815 
                 1.00 
                 20.41 
                 C 
               
               
                 ATOM 
                 287 
                 O 
                 TYR 
                 A 
                 37 
                 10.273 
                 36.379 
                 23.721 
                 1.00 
                 20.08 
                 O 
               
               
                 ATOM 
                 288 
                 CB 
                 TYR 
                 A 
                 37 
                 9.811 
                 35.508 
                 20.613 
                 1.00 
                 20.67 
                 C 
               
               
                 ATOM 
                 289 
                 CG 
                 TYR 
                 A 
                 37 
                 9.135 
                 34.556 
                 19.685 
                 1.00 
                 22.11 
                 C 
               
               
                 ATOM 
                 290 
                 CD1 
                 TYR 
                 A 
                 37 
                 9.860 
                 33.886 
                 18.710 
                 1.00 
                 21.85 
                 C 
               
               
                 ATOM 
                 291 
                 CD2 
                 TYR 
                 A 
                 37 
                 7.775 
                 34.281 
                 19.815 
                 1.00 
                 22.28 
                 C 
               
               
                 ATOM 
                 292 
                 CE1 
                 TYR 
                 A 
                 37 
                 9.244 
                 33.001 
                 17.853 
                 1.00 
                 23.13 
                 C 
               
               
                 ATOM 
                 293 
                 CE2 
                 TYR 
                 A 
                 37 
                 7.146 
                 33.390 
                 18.974 
                 1.00 
                 24.22 
                 C 
               
               
                 ATOM 
                 294 
                 CZ 
                 TYR 
                 A 
                 37 
                 7.887 
                 32.746 
                 17.999 
                 1.00 
                 25.26 
                 C 
               
               
                 ATOM 
                 295 
                 OH 
                 TYR 
                 A 
                 37 
                 7.279 
                 31.839 
                 17.172 
                 1.00 
                 28.45 
                 O 
               
               
                 ATOM 
                 296 
                 N 
                 ARG 
                 A 
                 38 
                 12.213 
                 36.178 
                 22.589 
                 1.00 
                 20.59 
                 N 
               
               
                 ATOM 
                 297 
                 CA 
                 ARG 
                 A 
                 38 
                 12.916 
                 37.187 
                 23.372 
                 1.00 
                 21.53 
                 C 
               
               
                 ATOM 
                 298 
                 C 
                 ARG 
                 A 
                 38 
                 13.924 
                 37.949 
                 22.522 
                 1.00 
                 20.82 
                 C 
               
               
                 ATOM 
                 299 
                 O 
                 ARG 
                 A 
                 38 
                 14.625 
                 37.360 
                 21.684 
                 1.00 
                 20.22 
                 O 
               
               
                 ATOM 
                 300 
                 CB 
                 ARG 
                 A 
                 38 
                 13.675 
                 36.540 
                 24.541 
                 1.00 
                 22.61 
                 C 
               
               
                 ATOM 
                 301 
                 CG 
                 ARG 
                 A 
                 38 
                 14.457 
                 35.317 
                 24.149 
                 1.00 
                 25.21 
                 C 
               
               
                 ATOM 
                 302 
                 CD 
                 ARG 
                 A 
                 38 
                 15.896 
                 35.288 
                 24.635 
                 1.00 
                 30.36 
                 C 
               
               
                 ATOM 
                 303 
                 NE 
                 ARG 
                 A 
                 38 
                 15.951 
                 35.051 
                 26.073 
                 1.00 
                 32.29 
                 N 
               
               
                 ATOM 
                 304 
                 CZ 
                 ARG 
                 A 
                 38 
                 16.900 
                 34.374 
                 26.707 
                 1.00 
                 33.39 
                 C 
               
               
                 ATOM 
                 305 
                 NH1 
                 ARG 
                 A 
                 38 
                 17.920 
                 33.843 
                 26.048 
                 1.00 
                 35.30 
                 N 
               
               
                 ATOM 
                 306 
                 NH2 
                 ARG 
                 A 
                 38 
                 16.828 
                 34.232 
                 28.028 
                 1.00 
                 33.42 
                 N 
               
               
                 ATOM 
                 307 
                 N 
                 THR 
                 A 
                 39 
                 13.986 
                 39.259 
                 22.742 
                 1.00 
                 20.17 
                 N 
               
               
                 ATOM 
                 308 
                 CA 
                 THR 
                 A 
                 39 
                 15.114 
                 40.050 
                 22.319 
                 1.00 
                 19.76 
                 C 
               
               
                 ATOM 
                 309 
                 C 
                 THR 
                 A 
                 39 
                 15.921 
                 40.363 
                 23.569 
                 1.00 
                 19.85 
                 C 
               
               
                 ATOM 
                 310 
                 O 
                 THR 
                 A 
                 39 
                 15.501 
                 41.152 
                 24.420 
                 1.00 
                 19.60 
                 O 
               
               
                 ATOM 
                 311 
                 CB 
                 THR 
                 A 
                 39 
                 14.645 
                 41.323 
                 21.624 
                 1.00 
                 19.79 
                 C 
               
               
                 ATOM 
                 312 
                 OG1 
                 THR 
                 A 
                 39 
                 13.894 
                 40.983 
                 20.455 
                 1.00 
                 19.66 
                 O 
               
               
                 ATOM 
                 313 
                 CG2 
                 THR 
                 A 
                 39 
                 15.814 
                 42.101 
                 21.084 
                 1.00 
                 18.73 
                 C 
               
               
                 ATOM 
                 314 
                 N 
                 LYS 
                 A 
                 40 
                 17.092 
                 39.752 
                 23.676 
                 1.00 
                 19.48 
                 N 
               
               
                 ATOM 
                 315 
                 CA 
                 LYS 
                 A 
                 40 
                 17.911 
                 39.924 
                 24.867 
                 1.00 
                 19.94 
                 C 
               
               
                 ATOM 
                 316 
                 C 
                 LYS 
                 A 
                 40 
                 18.632 
                 41.250 
                 24.878 
                 1.00 
                 18.92 
                 C 
               
               
                 ATOM 
                 317 
                 O 
                 LYS 
                 A 
                 40 
                 18.852 
                 41.865 
                 23.831 
                 1.00 
                 18.69 
                 O 
               
               
                 ATOM 
                 318 
                 CB 
                 LYS 
                 A 
                 40 
                 18.892 
                 38.759 
                 25.026 
                 1.00 
                 20.70 
                 C 
               
               
                 ATOM 
                 319 
                 CG 
                 LYS 
                 A 
                 40 
                 19.989 
                 38.670 
                 24.006 
                 1.00 
                 23.62 
                 C 
               
               
                 ATOM 
                 320 
                 CD 
                 LYS 
                 A 
                 40 
                 20.384 
                 37.199 
                 23.759 
                 1.00 
                 29.14 
                 C 
               
               
                 ATOM 
                 321 
                 CE 
                 LYS 
                 A 
                 40 
                 20.713 
                 36.432 
                 25.055 
                 1.00 
                 31.07 
                 C 
               
               
                 ATOM 
                 322 
                 NZ 
                 LYS 
                 A 
                 40 
                 19.484 
                 35.955 
                 25.759 
                 1.00 
                 31.81 
                 N 
               
               
                 ATOM 
                 323 
                 N 
                 LEU 
                 A 
                 41 
                 18.963 
                 41.696 
                 26.084 
                 1.00 
                 18.33 
                 N 
               
               
                 ATOM 
                 324 
                 CA 
                 LEU 
                 A 
                 41 
                 19.757 
                 42.899 
                 26.296 
                 1.00 
                 18.50 
                 C 
               
               
                 ATOM 
                 325 
                 C 
                 LEU 
                 A 
                 41 
                 20.999 
                 42.826 
                 25.425 
                 1.00 
                 18.22 
                 C 
               
               
                 ATOM 
                 326 
                 O 
                 LEU 
                 A 
                 41 
                 21.609 
                 41.761 
                 25.309 
                 1.00 
                 17.78 
                 O 
               
               
                 ATOM 
                 327 
                 CB 
                 LEU 
                 A 
                 41 
                 20.141 
                 42.998 
                 27.781 
                 1.00 
                 18.70 
                 C 
               
               
                 ATOM 
                 328 
                 CG 
                 LEU 
                 A 
                 41 
                 21.006 
                 44.117 
                 28.359 
                 1.00 
                 18.56 
                 C 
               
               
                 ATOM 
                 329 
                 CD1 
                 LEU 
                 A 
                 41 
                 22.449 
                 43.720 
                 28.319 
                 1.00 
                 20.25 
                 C 
               
               
                 ATOM 
                 330 
                 CD2 
                 LEU 
                 A 
                 41 
                 20.799 
                 45.471 
                 27.673 
                 1.00 
                 18.34 
                 C 
               
               
                 ATOM 
                 331 
                 N 
                 GLY 
                 A 
                 42 
                 21.348 
                 43.954 
                 24.804 
                 1.00 
                 18.35 
                 N 
               
               
                 ATOM 
                 332 
                 CA 
                 GLY 
                 A 
                 42 
                 22.512 
                 44.066 
                 23.938 
                 1.00 
                 18.25 
                 C 
               
               
                 ATOM 
                 333 
                 C 
                 GLY 
                 A 
                 42 
                 22.285 
                 43.684 
                 22.478 
                 1.00 
                 18.60 
                 C 
               
               
                 ATOM 
                 334 
                 O 
                 GLY 
                 A 
                 42 
                 23.143 
                 43.927 
                 21.632 
                 1.00 
                 18.22 
                 O 
               
               
                 ATOM 
                 335 
                 N 
                 SER 
                 A 
                 43 
                 21.130 
                 43.103 
                 22.176 
                 1.00 
                 19.23 
                 N 
               
               
                 ATOM 
                 336 
                 CA 
                 SER 
                 A 
                 43 
                 20.856 
                 42.563 
                 20.852 
                 1.00 
                 19.97 
                 C 
               
               
                 ATOM 
                 337 
                 C 
                 SER 
                 A 
                 43 
                 19.564 
                 43.140 
                 20.264 
                 1.00 
                 20.80 
                 C 
               
               
                 ATOM 
                 338 
                 O 
                 SER 
                 A 
                 43 
                 18.597 
                 43.416 
                 20.987 
                 1.00 
                 19.75 
                 O 
               
               
                 ATOM 
                 339 
                 CB 
                 SER 
                 A 
                 43 
                 20.752 
                 41.031 
                 20.944 
                 1.00 
                 20.21 
                 C 
               
               
                 ATOM 
                 340 
                 OG 
                 SER 
                 A 
                 43 
                 19.979 
                 40.482 
                 19.895 
                 1.00 
                 20.83 
                 O 
               
               
                 ATOM 
                 341 
                 N 
                 THR 
                 A 
                 44 
                 19.564 
                 43.282 
                 18.941 
                 1.00 
                 21.88 
                 N 
               
               
                 ATOM 
                 342 
                 CA 
                 THR 
                 A 
                 44 
                 18.399 
                 43.715 
                 18.172 
                 1.00 
                 23.21 
                 C 
               
               
                 ATOM 
                 343 
                 C 
                 THR 
                 A 
                 44 
                 17.589 
                 42.547 
                 17.573 
                 1.00 
                 24.06 
                 C 
               
               
                 ATOM 
                 344 
                 O 
                 THR 
                 A 
                 44 
                 16.511 
                 42.760 
                 17.035 
                 1.00 
                 24.67 
                 O 
               
               
                 ATOM 
                 345 
                 CB 
                 THR 
                 A 
                 44 
                 18.869 
                 44.658 
                 17.033 
                 1.00 
                 23.62 
                 C 
               
               
                 ATOM 
                 346 
                 OG1 
                 THR 
                 A 
                 44 
                 19.802 
                 45.624 
                 17.536 
                 1.00 
                 23.82 
                 O 
               
               
                 ATOM 
                 347 
                 CG2 
                 THR 
                 A 
                 44 
                 17.752 
                 45.508 
                 16.559 
                 1.00 
                 24.67 
                 C 
               
               
                 ATOM 
                 348 
                 N 
                 ASN 
                 A 
                 45 
                 18.097 
                 41.320 
                 17.681 
                 1.00 
                 24.92 
                 N 
               
               
                 ATOM 
                 349 
                 CA 
                 ASN 
                 A 
                 45 
                 17.466 
                 40.137 
                 17.080 
                 1.00 
                 25.63 
                 C 
               
               
                 ATOM 
                 350 
                 C 
                 ASN 
                 A 
                 45 
                 16.523 
                 39.406 
                 18.032 
                 1.00 
                 25.35 
                 C 
               
               
                 ATOM 
                 351 
                 O 
                 ASN 
                 A 
                 45 
                 16.956 
                 38.938 
                 19.087 
                 1.00 
                 25.12 
                 O 
               
               
                 ATOM 
                 352 
                 CB 
                 ASN 
                 A 
                 45 
                 18.566 
                 39.159 
                 16.607 
                 1.00 
                 26.48 
                 C 
               
               
                 ATOM 
                 353 
                 CG 
                 ASN 
                 A 
                 45 
                 18.127 
                 38.290 
                 15.422 
                 1.00 
                 28.96 
                 C 
               
               
                 ATOM 
                 354 
                 OD1 
                 ASN 
                 A 
                 45 
                 17.167 
                 37.517 
                 15.520 
                 1.00 
                 34.50 
                 O 
               
               
                 ATOM 
                 355 
                 ND2 
                 ASN 
                 A 
                 45 
                 18.834 
                 38.420 
                 14.295 
                 1.00 
                 33.05 
                 N 
               
               
                 ATOM 
                 356 
                 N 
                 GLU 
                 A 
                 46 
                 15.243 
                 39.310 
                 17.656 
                 1.00 
                 25.20 
                 N 
               
               
                 ATOM 
                 357 
                 CA 
                 GLU 
                 A 
                 46 
                 14.277 
                 38.489 
                 18.385 
                 1.00 
                 25.43 
                 C 
               
               
                 ATOM 
                 358 
                 C 
                 GLU 
                 A 
                 46 
                 14.524 
                 37.037 
                 18.050 
                 1.00 
                 25.11 
                 C 
               
               
                 ATOM 
                 359 
                 O 
                 GLU 
                 A 
                 46 
                 14.639 
                 36.680 
                 16.882 
                 1.00 
                 25.36 
                 O 
               
               
                 ATOM 
                 360 
                 CB 
                 GLU 
                 A 
                 46 
                 12.818 
                 38.836 
                 18.045 
                 1.00 
                 25.34 
                 C 
               
               
                 ATOM 
                 361 
                 CG 
                 GLU 
                 A 
                 46 
                 11.826 
                 38.236 
                 19.042 
                 1.00 
                 27.16 
                 C 
               
               
                 ATOM 
                 362 
                 CD 
                 GLU 
                 A 
                 46 
                 10.364 
                 38.576 
                 18.756 
                 1.00 
                 29.67 
                 C 
               
               
                 ATOM 
                 363 
                 OE1 
                 GLU 
                 A 
                 46 
                 9.873 
                 38.238 
                 17.667 
                 1.00 
                 32.34 
                 O 
               
               
                 ATOM 
                 364 
                 OE2 
                 GLU 
                 A 
                 46 
                 9.686 
                 39.166 
                 19.619 
                 1.00 
                 30.61 
                 O 
               
               
                 ATOM 
                 365 
                 N 
                 GLN 
                 A 
                 47 
                 14.614 
                 36.202 
                 19.070 
                 1.00 
                 24.89 
                 N 
               
               
                 ATOM 
                 366 
                 CA 
                 GLN 
                 A 
                 47 
                 14.818 
                 34.783 
                 18.845 
                 1.00 
                 25.04 
                 C 
               
               
                 ATOM 
                 367 
                 C 
                 GLN 
                 A 
                 47 
                 13.840 
                 33.922 
                 19.634 
                 1.00 
                 24.11 
                 C 
               
               
                 ATOM 
                 368 
                 O 
                 GLN 
                 A 
                 47 
                 13.292 
                 34.332 
                 20.649 
                 1.00 
                 23.89 
                 O 
               
               
                 ATOM 
                 369 
                 CB 
                 GLN 
                 A 
                 47 
                 16.266 
                 34.404 
                 19.128 
                 1.00 
                 25.75 
                 C 
               
               
                 ATOM 
                 370 
                 CG 
                 GLN 
                 A 
                 47 
                 16.667 
                 34.505 
                 20.582 
                 1.00 
                 28.80 
                 C 
               
               
                 ATOM 
                 371 
                 CD 
                 GLN 
                 A 
                 47 
                 18.162 
                 34.706 
                 20.766 
                 1.00 
                 31.99 
                 C 
               
               
                 ATOM 
                 372 
                 OE1 
                 GLN 
                 A 
                 47 
                 18.579 
                 35.306 
                 21.755 
                 1.00 
                 35.39 
                 O 
               
               
                 ATOM 
                 373 
                 NE2 
                 GLN 
                 A 
                 47 
                 18.968 
                 34.198 
                 19.830 
                 1.00 
                 33.93 
                 N 
               
               
                 ATOM 
                 374 
                 N 
                 SER 
                 A 
                 48 
                 13.580 
                 32.743 
                 19.098 
                 1.00 
                 23.33 
                 N 
               
               
                 ATOM 
                 375 
                 CA 
                 SER 
                 A 
                 48 
                 12.753 
                 31.745 
                 19.742 
                 1.00 
                 23.09 
                 C 
               
               
                 ATOM 
                 376 
                 C 
                 SER 
                 A 
                 48 
                 13.408 
                 31.195 
                 21.015 
                 1.00 
                 22.17 
                 C 
               
               
                 ATOM 
                 377 
                 O 
                 SER 
                 A 
                 48 
                 14.630 
                 31.025 
                 21.088 
                 1.00 
                 22.12 
                 O 
               
               
                 ATOM 
                 378 
                 CB 
                 SER 
                 A 
                 48 
                 12.523 
                 30.588 
                 18.758 
                 1.00 
                 23.69 
                 C 
               
               
                 ATOM 
                 379 
                 OG 
                 SER 
                 A 
                 48 
                 11.687 
                 29.601 
                 19.332 
                 1.00 
                 25.84 
                 O 
               
               
                 ATOM 
                 380 
                 N 
                 ILE 
                 A 
                 49 
                 12.577 
                 30.889 
                 21.998 
                 1.00 
                 21.60 
                 N 
               
               
                 ATOM 
                 381 
                 CA 
                 ILE 
                 A 
                 49 
                 13.000 
                 30.234 
                 23.233 
                 1.00 
                 21.35 
                 C 
               
               
                 ATOM 
                 382 
                 C 
                 ILE 
                 A 
                 49 
                 12.617 
                 28.772 
                 23.125 
                 1.00 
                 21.11 
                 C 
               
               
                 ATOM 
                 383 
                 O 
                 ILE 
                 A 
                 49 
                 11.453 
                 28.458 
                 22.908 
                 1.00 
                 20.72 
                 O 
               
               
                 ATOM 
                 384 
                 CB 
                 ILE 
                 A 
                 49 
                 12.262 
                 30.865 
                 24.434 
                 1.00 
                 21.53 
                 C 
               
               
                 ATOM 
                 385 
                 CG1 
                 ILE 
                 A 
                 49 
                 12.625 
                 32.331 
                 24.552 
                 1.00 
                 22.11 
                 C 
               
               
                 ATOM 
                 386 
                 CG2 
                 ILE 
                 A 
                 49 
                 12.620 
                 30.170 
                 25.733 
                 1.00 
                 21.54 
                 C 
               
               
                 ATOM 
                 387 
                 CD1 
                 ILE 
                 A 
                 49 
                 11.854 
                 33.061 
                 25.590 
                 1.00 
                 22.85 
                 C 
               
               
                 ATOM 
                 388 
                 N 
                 SER 
                 A 
                 50 
                 13.582 
                 27.875 
                 23.268 
                 1.00 
                 21.72 
                 N 
               
               
                 ATOM 
                 389 
                 CA 
                 SER 
                 A 
                 50 
                 13.290 
                 26.445 
                 23.322 
                 1.00 
                 22.28 
                 C 
               
               
                 ATOM 
                 390 
                 C 
                 SER 
                 A 
                 50 
                 12.803 
                 26.065 
                 24.704 
                 1.00 
                 22.38 
                 C 
               
               
                 ATOM 
                 391 
                 O 
                 SER 
                 A 
                 50 
                 13.495 
                 26.313 
                 25.680 
                 1.00 
                 22.36 
                 O 
               
               
                 ATOM 
                 392 
                 CB 
                 SER 
                 A 
                 50 
                 14.540 
                 25.641 
                 23.014 
                 1.00 
                 22.55 
                 C 
               
               
                 ATOM 
                 393 
                 OG 
                 SER 
                 A 
                 50 
                 15.092 
                 26.052 
                 21.776 
                 1.00 
                 25.68 
                 O 
               
               
                 ATOM 
                 394 
                 N 
                 ILE 
                 A 
                 51 
                 11.609 
                 25.477 
                 24.791 
                 1.00 
                 22.85 
                 N 
               
               
                 ATOM 
                 395 
                 CA 
                 ILE 
                 A 
                 51 
                 11.048 
                 25.047 
                 26.074 
                 1.00 
                 22.89 
                 C 
               
               
                 ATOM 
                 396 
                 C 
                 ILE 
                 A 
                 51 
                 11.789 
                 23.819 
                 26.591 
                 1.00 
                 22.70 
                 C 
               
               
                 ATOM 
                 397 
                 O 
                 ILE 
                 A 
                 51 
                 11.923 
                 22.838 
                 25.879 
                 1.00 
                 22.61 
                 O 
               
               
                 ATOM 
                 398 
                 CB 
                 ILE 
                 A 
                 51 
                 9.531 
                 24.744 
                 25.960 
                 1.00 
                 22.93 
                 C 
               
               
                 ATOM 
                 399 
                 CG1 
                 ILE 
                 A 
                 51 
                 8.776 
                 25.963 
                 25.434 
                 1.00 
                 22.33 
                 C 
               
               
                 ATOM 
                 400 
                 CG2 
                 ILE 
                 A 
                 51 
                 8.960 
                 24.349 
                 27.321 
                 1.00 
                 22.98 
                 C 
               
               
                 ATOM 
                 401 
                 CD1 
                 ILE 
                 A 
                 51 
                 9.133 
                 27.260 
                 26.103 
                 1.00 
                 22.64 
                 C 
               
               
                 ATOM 
                 402 
                 N 
                 GLY 
                 A 
                 52 
                 12.264 
                 23.912 
                 27.838 
                 1.00 
                 22.98 
                 N 
               
               
                 ATOM 
                 403 
                 CA 
                 GLY 
                 A 
                 52 
                 13.061 
                 22.887 
                 28.488 
                 1.00 
                 22.87 
                 C 
               
               
                 ATOM 
                 404 
                 C 
                 GLY 
                 A 
                 52 
                 14.047 
                 23.530 
                 29.461 
                 1.00 
                 23.19 
                 C 
               
               
                 ATOM 
                 405 
                 O 
                 GLY 
                 A 
                 52 
                 14.408 
                 24.718 
                 29.301 
                 1.00 
                 22.95 
                 O 
               
               
                 ATOM 
                 406 
                 N 
                 GLY 
                 A 
                 53 
                 14.453 
                 22.760 
                 30.477 
                 1.00 
                 22.92 
                 N 
               
               
                 ATOM 
                 407 
                 CA 
                 GLY 
                 A 
                 53 
                 15.429 
                 23.194 
                 31.470 
                 1.00 
                 23.02 
                 C 
               
               
                 ATOM 
                 408 
                 C 
                 GLY 
                 A 
                 53 
                 14.970 
                 24.311 
                 32.405 
                 1.00 
                 23.04 
                 C 
               
               
                 ATOM 
                 409 
                 O 
                 GLY 
                 A 
                 53 
                 14.065 
                 24.133 
                 33.226 
                 1.00 
                 22.84 
                 O 
               
               
                 ATOM 
                 410 
                 N 
                 ARG 
                 A 
                 54 
                 15.626 
                 25.463 
                 32.294 
                 1.00 
                 23.35 
                 N 
               
               
                 ATOM 
                 411 
                 CA 
                 ARG 
                 A 
                 54 
                 15.251 
                 26.664 
                 33.053 
                 1.00 
                 23.76 
                 C 
               
               
                 ATOM 
                 412 
                 C 
                 ARG 
                 A 
                 54 
                 13.909 
                 27.234 
                 32.576 
                 1.00 
                 23.14 
                 C 
               
               
                 ATOM 
                 413 
                 O 
                 ARG 
                 A 
                 54 
                 13.253 
                 27.954 
                 33.310 
                 1.00 
                 23.45 
                 O 
               
               
                 ATOM 
                 414 
                 CB 
                 ARG 
                 A 
                 54 
                 16.336 
                 27.749 
                 32.923 
                 1.00 
                 23.80 
                 C 
               
               
                 ATOM 
                 415 
                 CG 
                 ARG 
                 A 
                 54 
                 17.649 
                 27.414 
                 33.591 
                 1.00 
                 25.73 
                 C 
               
               
                 ATOM 
                 416 
                 CD 
                 ARG 
                 A 
                 54 
                 18.552 
                 28.632 
                 33.876 
                 1.00 
                 27.25 
                 C 
               
               
                 ATOM 
                 417 
                 NE 
                 ARG 
                 A 
                 54 
                 18.898 
                 29.355 
                 32.648 
                 1.00 
                 28.42 
                 N 
               
               
                 ATOM 
                 418 
                 CZ 
                 ARG 
                 A 
                 54 
                 18.492 
                 30.588 
                 32.323 
                 1.00 
                 29.63 
                 C 
               
               
                 ATOM 
                 419 
                 NH1 
                 ARG 
                 A 
                 54 
                 17.700 
                 31.296 
                 33.130 
                 1.00 
                 30.29 
                 N 
               
               
                 ATOM 
                 420 
                 NH2 
                 ARG 
                 A 
                 54 
                 18.888 
                 31.118 
                 31.169 
                 1.00 
                 29.15 
                 N 
               
               
                 ATOM 
                 421 
                 N 
                 TYR 
                 A 
                 55 
                 13.524 
                 26.908 
                 31.341 
                 1.00 
                 22.88 
                 N 
               
               
                 ATOM 
                 422 
                 CA 
                 TYR 
                 A 
                 55 
                 12.314 
                 27.425 
                 30.687 
                 1.00 
                 22.07 
                 C 
               
               
                 ATOM 
                 423 
                 C 
                 TYR 
                 A 
                 55 
                 11.188 
                 26.385 
                 30.719 
                 1.00 
                 21.17 
                 C 
               
               
                 ATOM 
                 424 
                 O 
                 TYR 
                 A 
                 55 
                 11.243 
                 25.395 
                 30.009 
                 1.00 
                 22.31 
                 O 
               
               
                 ATOM 
                 425 
                 CB 
                 TYR 
                 A 
                 55 
                 12.623 
                 27.784 
                 29.234 
                 1.00 
                 21.88 
                 C 
               
               
                 ATOM 
                 426 
                 CG 
                 TYR 
                 A 
                 55 
                 13.801 
                 28.715 
                 29.070 
                 1.00 
                 23.92 
                 C 
               
               
                 ATOM 
                 427 
                 CD1 
                 TYR 
                 A 
                 55 
                 15.055 
                 28.228 
                 28.712 
                 1.00 
                 26.80 
                 C 
               
               
                 ATOM 
                 428 
                 CD2 
                 TYR 
                 A 
                 55 
                 13.667 
                 30.090 
                 29.282 
                 1.00 
                 26.62 
                 C 
               
               
                 ATOM 
                 429 
                 CE1 
                 TYR 
                 A 
                 55 
                 16.154 
                 29.090 
                 28.557 
                 1.00 
                 28.70 
                 C 
               
               
                 ATOM 
                 430 
                 CE2 
                 TYR 
                 A 
                 55 
                 14.745 
                 30.954 
                 29.134 
                 1.00 
                 28.10 
                 C 
               
               
                 ATOM 
                 431 
                 CZ 
                 TYR 
                 A 
                 55 
                 15.989 
                 30.448 
                 28.769 
                 1.00 
                 29.67 
                 C 
               
               
                 ATOM 
                 432 
                 OH 
                 TYR 
                 A 
                 55 
                 17.071 
                 31.294 
                 28.629 
                 1.00 
                 33.06 
                 O 
               
               
                 ATOM 
                 433 
                 N 
                 VAL 
                 A 
                 56 
                 10.185 
                 26.610 
                 31.559 
                 1.00 
                 20.05 
                 N 
               
               
                 ATOM 
                 434 
                 CA 
                 VAL 
                 A 
                 56 
                 9.087 
                 25.671 
                 31.779 
                 1.00 
                 19.16 
                 C 
               
               
                 ATOM 
                 435 
                 C 
                 VAL 
                 A 
                 56 
                 7.774 
                 26.317 
                 31.360 
                 1.00 
                 18.52 
                 C 
               
               
                 ATOM 
                 436 
                 O 
                 VAL 
                 A 
                 56 
                 7.357 
                 27.357 
                 31.901 
                 1.00 
                 18.12 
                 O 
               
               
                 ATOM 
                 437 
                 CB 
                 VAL 
                 A 
                 56 
                 9.010 
                 25.219 
                 33.252 
                 1.00 
                 19.07 
                 C 
               
               
                 ATOM 
                 438 
                 CG1 
                 VAL 
                 A 
                 56 
                 7.790 
                 24.279 
                 33.487 
                 1.00 
                 19.53 
                 C 
               
               
                 ATOM 
                 439 
                 CG2 
                 VAL 
                 A 
                 56 
                 10.320 
                 24.501 
                 33.664 
                 1.00 
                 19.48 
                 C 
               
               
                 ATOM 
                 440 
                 N 
                 GLU 
                 A 
                 57 
                 7.147 
                 25.747 
                 30.344 
                 1.00 
                 18.03 
                 N 
               
               
                 ATOM 
                 441 
                 CA 
                 GLU 
                 A 
                 57 
                 5.850 
                 26.236 
                 29.904 
                 1.00 
                 17.33 
                 C 
               
               
                 ATOM 
                 442 
                 C 
                 GLU 
                 A 
                 57 
                 4.703 
                 25.360 
                 30.398 
                 1.00 
                 17.50 
                 C 
               
               
                 ATOM 
                 443 
                 O 
                 GLU 
                 A 
                 57 
                 4.778 
                 24.125 
                 30.351 
                 1.00 
                 18.48 
                 O 
               
               
                 ATOM 
                 444 
                 CB 
                 GLU 
                 A 
                 57 
                 5.820 
                 26.327 
                 28.381 
                 1.00 
                 17.47 
                 C 
               
               
                 ATOM 
                 445 
                 CG 
                 GLU 
                 A 
                 57 
                 4.663 
                 27.191 
                 27.861 
                 1.00 
                 15.92 
                 C 
               
               
                 ATOM 
                 446 
                 CD 
                 GLU 
                 A 
                 57 
                 4.299 
                 26.942 
                 26.395 
                 1.00 
                 16.52 
                 C 
               
               
                 ATOM 
                 447 
                 OE1 
                 GLU 
                 A 
                 57 
                 4.605 
                 25.850 
                 25.893 
                 1.00 
                 14.24 
                 O 
               
               
                 ATOM 
                 448 
                 OE2 
                 GLU 
                 A 
                 57 
                 3.678 
                 27.830 
                 25.749 
                 1.00 
                 14.65 
                 O 
               
               
                 ATOM 
                 449 
                 N 
                 THR 
                 A 
                 58 
                 3.633 
                 26.008 
                 30.835 
                 1.00 
                 17.44 
                 N 
               
               
                 ATOM 
                 450 
                 CA 
                 THR 
                 A 
                 58 
                 2.374 
                 25.364 
                 31.168 
                 1.00 
                 17.09 
                 C 
               
               
                 ATOM 
                 451 
                 C 
                 THR 
                 A 
                 58 
                 1.245 
                 25.931 
                 30.325 
                 1.00 
                 17.31 
                 C 
               
               
                 ATOM 
                 452 
                 O 
                 THR 
                 A 
                 58 
                 1.010 
                 27.153 
                 30.328 
                 1.00 
                 17.84 
                 O 
               
               
                 ATOM 
                 453 
                 CB 
                 THR 
                 A 
                 58 
                 2.063 
                 25.622 
                 32.638 
                 1.00 
                 17.50 
                 C 
               
               
                 ATOM 
                 454 
                 OG1 
                 THR 
                 A 
                 58 
                 3.208 
                 25.265 
                 33.412 
                 1.00 
                 17.51 
                 O 
               
               
                 ATOM 
                 455 
                 CG2 
                 THR 
                 A 
                 58 
                 0.965 
                 24.689 
                 33.140 
                 1.00 
                 18.00 
                 C 
               
               
                 ATOM 
                 456 
                 N 
                 VAL 
                 A 
                 59 
                 0.545 
                 25.045 
                 29.625 
                 1.00 
                 16.46 
                 N 
               
               
                 ATOM 
                 457 
                 CA 
                 VAL 
                 A 
                 59 
                 −0.542 
                 25.426 
                 28.736 
                 1.00 
                 16.43 
                 C 
               
               
                 ATOM 
                 458 
                 C 
                 VAL 
                 A 
                 59 
                 −1.832 
                 24.740 
                 29.183 
                 1.00 
                 15.86 
                 C 
               
               
                 ATOM 
                 459 
                 O 
                 VAL 
                 A 
                 59 
                 −1.883 
                 23.513 
                 29.342 
                 1.00 
                 14.34 
                 O 
               
               
                 ATOM 
                 460 
                 CB 
                 VAL 
                 A 
                 59 
                 −0.251 
                 25.040 
                 27.252 
                 1.00 
                 16.37 
                 C 
               
               
                 ATOM 
                 461 
                 CG1 
                 VAL 
                 A 
                 59 
                 −1.433 
                 25.440 
                 26.343 
                 1.00 
                 16.25 
                 C 
               
               
                 ATOM 
                 462 
                 CG2 
                 VAL 
                 A 
                 59 
                 1.054 
                 25.676 
                 26.743 
                 1.00 
                 16.91 
                 C 
               
               
                 ATOM 
                 463 
                 N 
                 ASN 
                 A 
                 60 
                 −2.863 
                 25.554 
                 29.391 
                 1.00 
                 16.01 
                 N 
               
               
                 ATOM 
                 464 
                 CA 
                 ASN 
                 A 
                 60 
                 −4.224 
                 25.100 
                 29.657 
                 1.00 
                 16.49 
                 C 
               
               
                 ATOM 
                 465 
                 C 
                 ASN 
                 A 
                 60 
                 −5.142 
                 25.565 
                 28.542 
                 1.00 
                 16.38 
                 C 
               
               
                 ATOM 
                 466 
                 O 
                 ASN 
                 A 
                 60 
                 −5.575 
                 26.728 
                 28.538 
                 1.00 
                 15.18 
                 O 
               
               
                 ATOM 
                 467 
                 CB 
                 ASN 
                 A 
                 60 
                 −4.673 
                 25.660 
                 30.994 
                 1.00 
                 17.22 
                 C 
               
               
                 ATOM 
                 468 
                 CG 
                 ASN 
                 A 
                 60 
                 −3.700 
                 25.309 
                 32.116 
                 1.00 
                 21.86 
                 C 
               
               
                 ATOM 
                 469 
                 OD1 
                 ASN 
                 A 
                 60 
                 −2.920 
                 26.170 
                 32.564 
                 1.00 
                 31.74 
                 O 
               
               
                 ATOM 
                 470 
                 ND2 
                 ASN 
                 A 
                 60 
                 −3.708 
                 24.035 
                 32.552 
                 1.00 
                 22.53 
                 N 
               
               
                 ATOM 
                 471 
                 N 
                 LYS 
                 A 
                 61 
                 −5.435 
                 24.678 
                 27.592 
                 1.00 
                 16.48 
                 N 
               
               
                 ATOM 
                 472 
                 CA 
                 LYS 
                 A 
                 61 
                 −6.109 
                 25.081 
                 26.351 
                 1.00 
                 18.49 
                 C 
               
               
                 ATOM 
                 473 
                 C 
                 LYS 
                 A 
                 61 
                 −7.533 
                 25.551 
                 26.650 
                 1.00 
                 19.11 
                 C 
               
               
                 ATOM 
                 474 
                 O 
                 LYS 
                 A 
                 61 
                 −8.031 
                 26.453 
                 26.006 
                 1.00 
                 19.85 
                 O 
               
               
                 ATOM 
                 475 
                 CB 
                 LYS 
                 A 
                 61 
                 −6.143 
                 23.937 
                 25.319 
                 1.00 
                 19.58 
                 C 
               
               
                 ATOM 
                 476 
                 CG 
                 LYS 
                 A 
                 61 
                 −5.129 
                 24.036 
                 24.136 
                 1.00 
                 21.70 
                 C 
               
               
                 ATOM 
                 477 
                 CD 
                 LYS 
                 A 
                 61 
                 −5.345 
                 22.853 
                 23.081 
                 1.00 
                 23.52 
                 C 
               
               
                 ATOM 
                 478 
                 CE 
                 LYS 
                 A 
                 61 
                 −4.572 
                 21.530 
                 23.383 
                 1.00 
                 23.96 
                 C 
               
               
                 ATOM 
                 479 
                 NZ 
                 LYS 
                 A 
                 61 
                 −5.373 
                 20.217 
                 23.361 
                 1.00 
                 22.11 
                 N 
               
               
                 ATOM 
                 480 
                 N 
                 GLY 
                 A 
                 62 
                 −8.165 
                 24.952 
                 27.657 
                 1.00 
                 19.79 
                 N 
               
               
                 ATOM 
                 481 
                 CA 
                 GLY 
                 A 
                 62 
                 −9.545 
                 25.256 
                 28.002 
                 1.00 
                 20.12 
                 C 
               
               
                 ATOM 
                 482 
                 C 
                 GLY 
                 A 
                 62 
                 −9.743 
                 26.668 
                 28.515 
                 1.00 
                 20.10 
                 C 
               
               
                 ATOM 
                 483 
                 O 
                 GLY 
                 A 
                 62 
                 −10.726 
                 27.305 
                 28.206 
                 1.00 
                 20.62 
                 O 
               
               
                 ATOM 
                 484 
                 N 
                 SER 
                 A 
                 63 
                 −8.790 
                 27.159 
                 29.286 
                 1.00 
                 20.78 
                 N 
               
               
                 ATOM 
                 485 
                 CA 
                 SER 
                 A 
                 63 
                 −8.812 
                 28.532 
                 29.772 
                 1.00 
                 21.23 
                 C 
               
               
                 ATOM 
                 486 
                 C 
                 SER 
                 A 
                 63 
                 −8.030 
                 29.506 
                 28.874 
                 1.00 
                 21.06 
                 C 
               
               
                 ATOM 
                 487 
                 O 
                 SER 
                 A 
                 63 
                 −7.870 
                 30.670 
                 29.206 
                 1.00 
                 21.02 
                 O 
               
               
                 ATOM 
                 488 
                 CB 
                 SER 
                 A 
                 63 
                 −8.252 
                 28.543 
                 31.171 
                 1.00 
                 21.10 
                 C 
               
               
                 ATOM 
                 489 
                 OG 
                 SER 
                 A 
                 63 
                 −6.856 
                 28.412 
                 31.117 
                 1.00 
                 23.25 
                 O 
               
               
                 ATOM 
                 490 
                 N 
                 LYS 
                 A 
                 64 
                 −7.545 
                 29.008 
                 27.742 
                 1.00 
                 21.07 
                 N 
               
               
                 ATOM 
                 491 
                 CA 
                 LYS 
                 A 
                 64 
                 −6.786 
                 29.774 
                 26.765 
                 1.00 
                 21.34 
                 C 
               
               
                 ATOM 
                 492 
                 C 
                 LYS 
                 A 
                 64 
                 −5.552 
                 30.450 
                 27.383 
                 1.00 
                 20.91 
                 C 
               
               
                 ATOM 
                 493 
                 O 
                 LYS 
                 A 
                 64 
                 −5.128 
                 31.527 
                 26.953 
                 1.00 
                 19.71 
                 O 
               
               
                 ATOM 
                 494 
                 CB 
                 LYS 
                 A 
                 64 
                 −7.716 
                 30.743 
                 26.029 
                 1.00 
                 22.29 
                 C 
               
               
                 ATOM 
                 495 
                 CG 
                 LYS 
                 A 
                 64 
                 −8.976 
                 30.047 
                 25.476 
                 1.00 
                 25.28 
                 C 
               
               
                 ATOM 
                 496 
                 CD 
                 LYS 
                 A 
                 64 
                 −10.033 
                 31.046 
                 25.074 
                 1.00 
                 30.88 
                 C 
               
               
                 ATOM 
                 497 
                 CE 
                 LYS 
                 A 
                 64 
                 −11.210 
                 30.411 
                 24.334 
                 1.00 
                 32.43 
                 C 
               
               
                 ATOM 
                 498 
                 NZ 
                 LYS 
                 A 
                 64 
                 −11.472 
                 28.992 
                 24.760 
                 1.00 
                 35.69 
                 N 
               
               
                 ATOM 
                 499 
                 N 
                 SER 
                 A 
                 65 
                 −4.962 
                 29.765 
                 28.363 
                 1.00 
                 19.94 
                 N 
               
               
                 ATOM 
                 500 
                 CA 
                 SER 
                 A 
                 65 
                 −3.825 
                 30.267 
                 29.102 
                 1.00 
                 20.67 
                 C 
               
               
                 ATOM 
                 501 
                 C 
                 SER 
                 A 
                 65 
                 −2.559 
                 29.472 
                 28.830 
                 1.00 
                 19.83 
                 C 
               
               
                 ATOM 
                 502 
                 O 
                 SER 
                 A 
                 65 
                 −2.584 
                 28.250 
                 28.720 
                 1.00 
                 18.60 
                 O 
               
               
                 ATOM 
                 503 
                 CB 
                 SER 
                 A 
                 65 
                 −4.121 
                 30.218 
                 30.600 
                 1.00 
                 20.77 
                 C 
               
               
                 ATOM 
                 504 
                 OG 
                 SER 
                 A 
                 65 
                 −5.350 
                 30.878 
                 30.850 
                 1.00 
                 25.20 
                 O 
               
               
                 ATOM 
                 505 
                 N 
                 PHE 
                 A 
                 66 
                 −1.460 
                 30.205 
                 28.769 
                 1.00 
                 19.55 
                 N 
               
               
                 ATOM 
                 506 
                 CA 
                 PHE 
                 A 
                 66 
                 −0.136 
                 29.672 
                 28.581 
                 1.00 
                 19.48 
                 C 
               
               
                 ATOM 
                 507 
                 C 
                 PHE 
                 A 
                 66 
                 0.856 
                 30.619 
                 29.278 
                 1.00 
                 20.09 
                 C 
               
               
                 ATOM 
                 508 
                 O 
                 PHE 
                 A 
                 66 
                 0.790 
                 31.851 
                 29.113 
                 1.00 
                 20.75 
                 O 
               
               
                 ATOM 
                 509 
                 CB 
                 PHE 
                 A 
                 66 
                 0.208 
                 29.430 
                 27.091 
                 1.00 
                 18.76 
                 C 
               
               
                 ATOM 
                 510 
                 CG 
                 PHE 
                 A 
                 66 
                 −0.156 
                 30.556 
                 26.151 
                 1.00 
                 20.98 
                 C 
               
               
                 ATOM 
                 511 
                 CD1 
                 PHE 
                 A 
                 66 
                 −1.490 
                 30.838 
                 25.849 
                 1.00 
                 21.10 
                 C 
               
               
                 ATOM 
                 512 
                 CD2 
                 PHE 
                 A 
                 66 
                 0.838 
                 31.279 
                 25.494 
                 1.00 
                 22.63 
                 C 
               
               
                 ATOM 
                 513 
                 CE1 
                 PHE 
                 A 
                 66 
                 −1.827 
                 31.847 
                 24.961 
                 1.00 
                 21.88 
                 C 
               
               
                 ATOM 
                 514 
                 CE2 
                 PHE 
                 A 
                 66 
                 0.506 
                 32.282 
                 24.577 
                 1.00 
                 22.52 
                 C 
               
               
                 ATOM 
                 515 
                 CZ 
                 PHE 
                 A 
                 66 
                 −0.837 
                 32.573 
                 24.329 
                 1.00 
                 23.43 
                 C 
               
               
                 ATOM 
                 516 
                 N 
                 SER 
                 A 
                 67 
                 1.743 
                 30.001 
                 30.062 
                 1.00 
                 20.70 
                 N 
               
               
                 ATOM 
                 517 
                 CA 
                 SER 
                 A 
                 67 
                 2.698 
                 30.632 
                 30.961 
                 1.00 
                 21.27 
                 C 
               
               
                 ATOM 
                 518 
                 C 
                 SER 
                 A 
                 67 
                 4.087 
                 30.068 
                 30.777 
                 1.00 
                 20.65 
                 C 
               
               
                 ATOM 
                 519 
                 O 
                 SER 
                 A 
                 67 
                 4.261 
                 28.874 
                 30.548 
                 1.00 
                 21.14 
                 O 
               
               
                 ATOM 
                 520 
                 CB 
                 SER 
                 A 
                 67 
                 2.356 
                 30.312 
                 32.415 
                 1.00 
                 21.31 
                 C 
               
               
                 ATOM 
                 521 
                 OG 
                 SER 
                 A 
                 67 
                 1.311 
                 31.136 
                 32.822 
                 1.00 
                 27.23 
                 O 
               
               
                 ATOM 
                 522 
                 N 
                 LEU 
                 A 
                 68 
                 5.074 
                 30.929 
                 30.947 
                 1.00 
                 20.50 
                 N 
               
               
                 ATOM 
                 523 
                 CA 
                 LEU 
                 A 
                 68 
                 6.469 
                 30.538 
                 30.937 
                 1.00 
                 20.82 
                 C 
               
               
                 ATOM 
                 524 
                 C 
                 LEU 
                 A 
                 68 
                 7.013 
                 30.914 
                 32.298 
                 1.00 
                 20.84 
                 C 
               
               
                 ATOM 
                 525 
                 O 
                 LEU 
                 A 
                 68 
                 6.866 
                 32.052 
                 32.706 
                 1.00 
                 19.92 
                 O 
               
               
                 ATOM 
                 526 
                 CB 
                 LEU 
                 A 
                 68 
                 7.181 
                 31.344 
                 29.878 
                 1.00 
                 20.70 
                 C 
               
               
                 ATOM 
                 527 
                 CG 
                 LEU 
                 A 
                 68 
                 8.317 
                 30.832 
                 29.005 
                 1.00 
                 23.40 
                 C 
               
               
                 ATOM 
                 528 
                 CD1 
                 LEU 
                 A 
                 68 
                 9.303 
                 31.968 
                 28.773 
                 1.00 
                 22.63 
                 C 
               
               
                 ATOM 
                 529 
                 CD2 
                 LEU 
                 A 
                 68 
                 8.988 
                 29.587 
                 29.503 
                 1.00 
                 23.71 
                 C 
               
               
                 ATOM 
                 530 
                 N 
                 ARG 
                 A 
                 69 
                 7.647 
                 29.974 
                 32.980 
                 1.00 
                 20.92 
                 N 
               
               
                 ATOM 
                 531 
                 CA 
                 ARG 
                 A 
                 69 
                 8.411 
                 30.263 
                 34.187 
                 1.00 
                 21.67 
                 C 
               
               
                 ATOM 
                 532 
                 C 
                 ARG 
                 A 
                 69 
                 9.892 
                 30.041 
                 33.895 
                 1.00 
                 21.75 
                 C 
               
               
                 ATOM 
                 533 
                 O 
                 ARG 
                 A 
                 69 
                 10.296 
                 28.963 
                 33.478 
                 1.00 
                 21.02 
                 O 
               
               
                 ATOM 
                 534 
                 CB 
                 ARG 
                 A 
                 69 
                 7.980 
                 29.371 
                 35.335 
                 1.00 
                 21.50 
                 C 
               
               
                 ATOM 
                 535 
                 CG 
                 ARG 
                 A 
                 69 
                 8.705 
                 29.694 
                 36.648 
                 1.00 
                 23.03 
                 C 
               
               
                 ATOM 
                 536 
                 CD 
                 ARG 
                 A 
                 69 
                 8.145 
                 28.935 
                 37.842 
                 1.00 
                 23.71 
                 C 
               
               
                 ATOM 
                 537 
                 NE 
                 ARG 
                 A 
                 69 
                 8.827 
                 29.247 
                 39.101 
                 1.00 
                 26.51 
                 N 
               
               
                 ATOM 
                 538 
                 CZ 
                 ARG 
                 A 
                 69 
                 9.899 
                 28.610 
                 39.592 
                 1.00 
                 29.47 
                 C 
               
               
                 ATOM 
                 539 
                 NH1 
                 ARG 
                 A 
                 69 
                 10.481 
                 27.609 
                 38.932 
                 1.00 
                 31.37 
                 N 
               
               
                 ATOM 
                 540 
                 NH2 
                 ARG 
                 A 
                 69 
                 10.411 
                 28.986 
                 40.762 
                 1.00 
                 30.68 
                 N 
               
               
                 ATOM 
                 541 
                 N 
                 ILE 
                 A 
                 70 
                 10.680 
                 31.082 
                 34.107 
                 1.00 
                 22.33 
                 N 
               
               
                 ATOM 
                 542 
                 CA 
                 ILE 
                 A 
                 70 
                 12.120 
                 31.054 
                 33.892 
                 1.00 
                 22.69 
                 C 
               
               
                 ATOM 
                 543 
                 C 
                 ILE 
                 A 
                 70 
                 12.770 
                 31.073 
                 35.263 
                 1.00 
                 22.58 
                 C 
               
               
                 ATOM 
                 544 
                 O 
                 ILE 
                 A 
                 70 
                 12.595 
                 32.017 
                 36.011 
                 1.00 
                 22.40 
                 O 
               
               
                 ATOM 
                 545 
                 CB 
                 ILE 
                 A 
                 70 
                 12.552 
                 32.275 
                 33.064 
                 1.00 
                 22.65 
                 C 
               
               
                 ATOM 
                 546 
                 CG1 
                 ILE 
                 A 
                 70 
                 11.665 
                 32.389 
                 31.835 
                 1.00 
                 23.48 
                 C 
               
               
                 ATOM 
                 547 
                 CG2 
                 ILE 
                 A 
                 70 
                 14.039 
                 32.178 
                 32.641 
                 1.00 
                 22.68 
                 C 
               
               
                 ATOM 
                 548 
                 CD1 
                 ILE 
                 A 
                 70 
                 11.910 
                 33.600 
                 31.053 
                 1.00 
                 26.54 
                 C 
               
               
                 ATOM 
                 549 
                 N 
                 SER 
                 A 
                 71 
                 13.495 
                 30.006 
                 35.585 
                 1.00 
                 23.04 
                 N 
               
               
                 ATOM 
                 550 
                 CA 
                 SER 
                 A 
                 71 
                 14.143 
                 29.844 
                 36.878 
                 1.00 
                 23.02 
                 C 
               
               
                 ATOM 
                 551 
                 C 
                 SER 
                 A 
                 71 
                 15.597 
                 30.286 
                 36.806 
                 1.00 
                 22.90 
                 C 
               
               
                 ATOM 
                 552 
                 O 
                 SER 
                 A 
                 71 
                 16.154 
                 30.394 
                 35.719 
                 1.00 
                 22.88 
                 O 
               
               
                 ATOM 
                 553 
                 CB 
                 SER 
                 A 
                 71 
                 14.080 
                 28.367 
                 37.301 
                 1.00 
                 23.74 
                 C 
               
               
                 ATOM 
                 554 
                 OG 
                 SER 
                 A 
                 71 
                 14.571 
                 27.509 
                 36.275 
                 1.00 
                 23.76 
                 O 
               
               
                 ATOM 
                 555 
                 N 
                 ASP 
                 A 
                 72 
                 16.199 
                 30.550 
                 37.968 
                 1.00 
                 22.96 
                 N 
               
               
                 ATOM 
                 556 
                 CA 
                 ASP 
                 A 
                 72 
                 17.634 
                 30.801 
                 38.076 
                 1.00 
                 23.04 
                 C 
               
               
                 ATOM 
                 557 
                 C 
                 ASP 
                 A 
                 72 
                 18.076 
                 31.853 
                 37.083 
                 1.00 
                 22.39 
                 C 
               
               
                 ATOM 
                 558 
                 O 
                 ASP 
                 A 
                 72 
                 18.929 
                 31.604 
                 36.236 
                 1.00 
                 22.72 
                 O 
               
               
                 ATOM 
                 559 
                 CB 
                 ASP 
                 A 
                 72 
                 18.431 
                 29.498 
                 37.862 
                 1.00 
                 23.38 
                 C 
               
               
                 ATOM 
                 560 
                 CG 
                 ASP 
                 A 
                 72 
                 19.932 
                 29.668 
                 38.126 
                 1.00 
                 24.56 
                 C 
               
               
                 ATOM 
                 561 
                 OD1 
                 ASP 
                 A 
                 72 
                 20.305 
                 30.618 
                 38.854 
                 1.00 
                 24.85 
                 O 
               
               
                 ATOM 
                 562 
                 OD2 
                 ASP 
                 A 
                 72 
                 20.800 
                 28.892 
                 37.649 
                 1.00 
                 25.90 
                 O 
               
               
                 ATOM 
                 563 
                 N 
                 LEU 
                 A 
                 73 
                 17.494 
                 33.038 
                 37.200 
                 1.00 
                 22.00 
                 N 
               
               
                 ATOM 
                 564 
                 CA 
                 LEU 
                 A 
                 73 
                 17.729 
                 34.078 
                 36.216 
                 1.00 
                 21.94 
                 C 
               
               
                 ATOM 
                 565 
                 C 
                 LEU 
                 A 
                 73 
                 19.143 
                 34.619 
                 36.349 
                 1.00 
                 21.62 
                 C 
               
               
                 ATOM 
                 566 
                 O 
                 LEU 
                 A 
                 73 
                 19.704 
                 34.654 
                 37.434 
                 1.00 
                 20.95 
                 O 
               
               
                 ATOM 
                 567 
                 CB 
                 LEU 
                 A 
                 73 
                 16.724 
                 35.217 
                 36.361 
                 1.00 
                 21.83 
                 C 
               
               
                 ATOM 
                 568 
                 CG 
                 LEU 
                 A 
                 73 
                 15.270 
                 34.871 
                 36.009 
                 1.00 
                 21.51 
                 C 
               
               
                 ATOM 
                 569 
                 CD1 
                 LEU 
                 A 
                 73 
                 14.329 
                 35.768 
                 36.771 
                 1.00 
                 20.80 
                 C 
               
               
                 ATOM 
                 570 
                 CD2 
                 LEU 
                 A 
                 73 
                 14.991 
                 34.947 
                 34.493 
                 1.00 
                 22.55 
                 C 
               
               
                 ATOM 
                 571 
                 N 
                 ARG 
                 A 
                 74 
                 19.709 
                 35.011 
                 35.217 
                 1.00 
                 21.85 
                 N 
               
               
                 ATOM 
                 572 
                 CA 
                 ARG 
                 A 
                 74 
                 20.977 
                 35.727 
                 35.179 
                 1.00 
                 22.48 
                 C 
               
               
                 ATOM 
                 573 
                 C 
                 ARG 
                 A 
                 74 
                 20.777 
                 37.032 
                 34.419 
                 1.00 
                 21.94 
                 C 
               
               
                 ATOM 
                 574 
                 O 
                 ARG 
                 A 
                 74 
                 19.741 
                 37.232 
                 33.786 
                 1.00 
                 21.58 
                 O 
               
               
                 ATOM 
                 575 
                 CB 
                 ARG 
                 A 
                 74 
                 22.103 
                 34.885 
                 34.564 
                 1.00 
                 23.01 
                 C 
               
               
                 ATOM 
                 576 
                 CG 
                 ARG 
                 A 
                 74 
                 21.719 
                 33.699 
                 33.687 
                 1.00 
                 25.24 
                 C 
               
               
                 ATOM 
                 577 
                 CD 
                 ARG 
                 A 
                 74 
                 21.299 
                 32.418 
                 34.444 
                 1.00 
                 28.74 
                 C 
               
               
                 ATOM 
                 578 
                 NE 
                 ARG 
                 A 
                 74 
                 21.739 
                 31.104 
                 33.907 
                 1.00 
                 31.12 
                 N 
               
               
                 ATOM 
                 579 
                 CZ 
                 ARG 
                 A 
                 74 
                 21.911 
                 30.754 
                 32.613 
                 1.00 
                 33.00 
                 C 
               
               
                 ATOM 
                 580 
                 NH1 
                 ARG 
                 A 
                 74 
                 21.730 
                 31.606 
                 31.607 
                 1.00 
                 35.30 
                 N 
               
               
                 ATOM 
                 581 
                 NH2 
                 ARG 
                 A 
                 74 
                 22.299 
                 29.513 
                 32.319 
                 1.00 
                 33.69 
                 N 
               
               
                 ATOM 
                 582 
                 N 
                 VAL 
                 A 
                 75 
                 21.752 
                 37.932 
                 34.489 
                 1.00 
                 21.59 
                 N 
               
               
                 ATOM 
                 583 
                 CA 
                 VAL 
                 A 
                 75 
                 21.531 
                 39.275 
                 33.970 
                 1.00 
                 21.69 
                 C 
               
               
                 ATOM 
                 584 
                 C 
                 VAL 
                 A 
                 75 
                 21.395 
                 39.261 
                 32.443 
                 1.00 
                 21.72 
                 C 
               
               
                 ATOM 
                 585 
                 O 
                 VAL 
                 A 
                 75 
                 20.763 
                 40.147 
                 31.881 
                 1.00 
                 21.66 
                 O 
               
               
                 ATOM 
                 586 
                 CB 
                 VAL 
                 A 
                 75 
                 22.578 
                 40.354 
                 34.481 
                 1.00 
                 21.62 
                 C 
               
               
                 ATOM 
                 587 
                 CG1 
                 VAL 
                 A 
                 75 
                 23.363 
                 39.870 
                 35.698 
                 1.00 
                 20.91 
                 C 
               
               
                 ATOM 
                 588 
                 CG2 
                 VAL 
                 A 
                 75 
                 23.488 
                 40.839 
                 33.373 
                 1.00 
                 21.89 
                 C 
               
               
                 ATOM 
                 589 
                 N 
                 GLU 
                 A 
                 76 
                 21.975 
                 38.263 
                 31.778 
                 1.00 
                 21.76 
                 N 
               
               
                 ATOM 
                 590 
                 CA 
                 GLU 
                 A 
                 76 
                 21.853 
                 38.163 
                 30.319 
                 1.00 
                 21.87 
                 C 
               
               
                 ATOM 
                 591 
                 C 
                 GLU 
                 A 
                 76 
                 20.441 
                 37.747 
                 29.866 
                 1.00 
                 21.85 
                 C 
               
               
                 ATOM 
                 592 
                 O 
                 GLU 
                 A 
                 76 
                 20.088 
                 37.963 
                 28.709 
                 1.00 
                 22.39 
                 O 
               
               
                 ATOM 
                 593 
                 CB 
                 GLU 
                 A 
                 76 
                 22.916 
                 37.233 
                 29.714 
                 1.00 
                 21.99 
                 C 
               
               
                 ATOM 
                 594 
                 CG 
                 GLU 
                 A 
                 76 
                 22.876 
                 35.791 
                 30.199 
                 1.00 
                 22.56 
                 C 
               
               
                 ATOM 
                 595 
                 CD 
                 GLU 
                 A 
                 76 
                 24.002 
                 35.449 
                 31.160 
                 1.00 
                 24.12 
                 C 
               
               
                 ATOM 
                 596 
                 OE1 
                 GLU 
                 A 
                 76 
                 24.518 
                 36.377 
                 31.853 
                 1.00 
                 22.56 
                 O 
               
               
                 ATOM 
                 597 
                 OE2 
                 GLU 
                 A 
                 76 
                 24.360 
                 34.245 
                 31.225 
                 1.00 
                 24.41 
                 O 
               
               
                 ATOM 
                 598 
                 N 
                 ASP 
                 A 
                 77 
                 19.654 
                 37.159 
                 30.773 
                 1.00 
                 21.45 
                 N 
               
               
                 ATOM 
                 599 
                 CA 
                 ASP 
                 A 
                 77 
                 18.227 
                 36.896 
                 30.540 
                 1.00 
                 21.34 
                 C 
               
               
                 ATOM 
                 600 
                 C 
                 ASP 
                 A 
                 77 
                 17.391 
                 38.163 
                 30.461 
                 1.00 
                 21.15 
                 C 
               
               
                 ATOM 
                 601 
                 O 
                 ASP 
                 A 
                 77 
                 16.243 
                 38.119 
                 30.018 
                 1.00 
                 21.28 
                 O 
               
               
                 ATOM 
                 602 
                 CB 
                 ASP 
                 A 
                 77 
                 17.626 
                 36.043 
                 31.662 
                 1.00 
                 21.32 
                 C 
               
               
                 ATOM 
                 603 
                 CG 
                 ASP 
                 A 
                 77 
                 18.151 
                 34.641 
                 31.670 
                 1.00 
                 21.44 
                 C 
               
               
                 ATOM 
                 604 
                 OD1 
                 ASP 
                 A 
                 77 
                 18.584 
                 34.160 
                 30.603 
                 1.00 
                 22.02 
                 O 
               
               
                 ATOM 
                 605 
                 OD2 
                 ASP 
                 A 
                 77 
                 18.164 
                 33.948 
                 32.698 
                 1.00 
                 21.47 
                 O 
               
               
                 ATOM 
                 606 
                 N 
                 SER 
                 A 
                 78 
                 17.929 
                 39.278 
                 30.934 
                 1.00 
                 20.42 
                 N 
               
               
                 ATOM 
                 607 
                 CA 
                 SER 
                 A 
                 78 
                 17.203 
                 40.533 
                 30.829 
                 1.00 
                 20.88 
                 C 
               
               
                 ATOM 
                 608 
                 C 
                 SER 
                 A 
                 78 
                 16.915 
                 40.804 
                 29.334 
                 1.00 
                 20.27 
                 C 
               
               
                 ATOM 
                 609 
                 O 
                 SER 
                 A 
                 78 
                 17.656 
                 40.373 
                 28.469 
                 1.00 
                 20.38 
                 O 
               
               
                 ATOM 
                 610 
                 CB 
                 SER 
                 A 
                 78 
                 17.976 
                 41.658 
                 31.542 
                 1.00 
                 21.09 
                 C 
               
               
                 ATOM 
                 611 
                 OG 
                 SER 
                 A 
                 78 
                 18.806 
                 42.351 
                 30.650 
                 1.00 
                 23.22 
                 O 
               
               
                 ATOM 
                 612 
                 N 
                 GLY 
                 A 
                 79 
                 15.793 
                 41.444 
                 29.039 
                 1.00 
                 20.44 
                 N 
               
               
                 ATOM 
                 613 
                 CA 
                 GLY 
                 A 
                 79 
                 15.346 
                 41.653 
                 27.669 
                 1.00 
                 20.21 
                 C 
               
               
                 ATOM 
                 614 
                 C 
                 GLY 
                 A 
                 79 
                 13.831 
                 41.698 
                 27.595 
                 1.00 
                 20.09 
                 C 
               
               
                 ATOM 
                 615 
                 O 
                 GLY 
                 A 
                 79 
                 13.160 
                 41.737 
                 28.627 
                 1.00 
                 20.37 
                 O 
               
               
                 ATOM 
                 616 
                 N 
                 THR 
                 A 
                 80 
                 13.287 
                 41.710 
                 26.381 
                 1.00 
                 19.79 
                 N 
               
               
                 ATOM 
                 617 
                 CA 
                 THR 
                 A 
                 80 
                 11.837 
                 41.728 
                 26.191 
                 1.00 
                 20.31 
                 C 
               
               
                 ATOM 
                 618 
                 C 
                 THR 
                 A 
                 80 
                 11.367 
                 40.356 
                 25.727 
                 1.00 
                 19.48 
                 C 
               
               
                 ATOM 
                 619 
                 O 
                 THR 
                 A 
                 80 
                 11.904 
                 39.818 
                 24.781 
                 1.00 
                 20.27 
                 O 
               
               
                 ATOM 
                 620 
                 CB 
                 THR 
                 A 
                 80 
                 11.436 
                 42.804 
                 25.173 
                 1.00 
                 20.39 
                 C 
               
               
                 ATOM 
                 621 
                 OG1 
                 THR 
                 A 
                 80 
                 11.688 
                 44.111 
                 25.721 
                 1.00 
                 23.13 
                 O 
               
               
                 ATOM 
                 622 
                 CG2 
                 THR 
                 A 
                 80 
                 9.906 
                 42.787 
                 24.943 
                 1.00 
                 22.27 
                 C 
               
               
                 ATOM 
                 623 
                 N 
                 TYR 
                 A 
                 81 
                 10.379 
                 39.809 
                 26.415 
                 1.00 
                 19.45 
                 N 
               
               
                 ATOM 
                 624 
                 CA 
                 TYR 
                 A 
                 81 
                 9.814 
                 38.487 
                 26.146 
                 1.00 
                 18.67 
                 C 
               
               
                 ATOM 
                 625 
                 C 
                 TYR 
                 A 
                 81 
                 8.393 
                 38.662 
                 25.599 
                 1.00 
                 19.26 
                 C 
               
               
                 ATOM 
                 626 
                 O 
                 TYR 
                 A 
                 81 
                 7.633 
                 39.512 
                 26.075 
                 1.00 
                 18.23 
                 O 
               
               
                 ATOM 
                 627 
                 CB 
                 TYR 
                 A 
                 81 
                 9.761 
                 37.660 
                 27.429 
                 1.00 
                 18.65 
                 C 
               
               
                 ATOM 
                 628 
                 CG 
                 TYR 
                 A 
                 81 
                 11.112 
                 37.287 
                 27.977 
                 1.00 
                 15.74 
                 C 
               
               
                 ATOM 
                 629 
                 CD1 
                 TYR 
                 A 
                 81 
                 11.549 
                 35.980 
                 27.944 
                 1.00 
                 18.49 
                 C 
               
               
                 ATOM 
                 630 
                 CD2 
                 TYR 
                 A 
                 81 
                 11.952 
                 38.238 
                 28.529 
                 1.00 
                 17.22 
                 C 
               
               
                 ATOM 
                 631 
                 CE1 
                 TYR 
                 A 
                 81 
                 12.817 
                 35.616 
                 28.425 
                 1.00 
                 18.28 
                 C 
               
               
                 ATOM 
                 632 
                 CE2 
                 TYR 
                 A 
                 81 
                 13.225 
                 37.889 
                 29.020 
                 1.00 
                 16.72 
                 C 
               
               
                 ATOM 
                 633 
                 CZ 
                 TYR 
                 A 
                 81 
                 13.644 
                 36.577 
                 28.963 
                 1.00 
                 17.27 
                 C 
               
               
                 ATOM 
                 634 
                 OH 
                 TYR 
                 A 
                 81 
                 14.878 
                 36.206 
                 29.433 
                 1.00 
                 15.49 
                 O 
               
               
                 ATOM 
                 635 
                 N 
                 LYS 
                 A 
                 82 
                 8.051 
                 37.877 
                 24.586 
                 1.00 
                 19.68 
                 N 
               
               
                 ATOM 
                 636 
                 CA 
                 LYS 
                 A 
                 82 
                 6.726 
                 37.899 
                 23.982 
                 1.00 
                 19.85 
                 C 
               
               
                 ATOM 
                 637 
                 C 
                 LYS 
                 A 
                 82 
                 6.238 
                 36.470 
                 23.773 
                 1.00 
                 19.88 
                 C 
               
               
                 ATOM 
                 638 
                 O 
                 LYS 
                 A 
                 82 
                 7.005 
                 35.613 
                 23.348 
                 1.00 
                 20.39 
                 O 
               
               
                 ATOM 
                 639 
                 CB 
                 LYS 
                 A 
                 82 
                 6.802 
                 38.639 
                 22.652 
                 1.00 
                 20.14 
                 C 
               
               
                 ATOM 
                 640 
                 CG 
                 LYS 
                 A 
                 82 
                 6.918 
                 40.185 
                 22.820 
                 1.00 
                 21.90 
                 C 
               
               
                 ATOM 
                 641 
                 CD 
                 LYS 
                 A 
                 82 
                 6.840 
                 40.903 
                 21.446 
                 1.00 
                 23.26 
                 C 
               
               
                 ATOM 
                 642 
                 CE 
                 LYS 
                 A 
                 82 
                 6.806 
                 42.409 
                 21.625 
                 1.00 
                 24.18 
                 C 
               
               
                 ATOM 
                 643 
                 NZ 
                 LYS 
                 A 
                 82 
                 6.979 
                 43.197 
                 20.363 
                 1.00 
                 24.03 
                 N 
               
               
                 ATOM 
                 644 
                 N 
                 CYS 
                 A 
                 83 
                 4.966 
                 36.214 
                 24.064 
                 1.00 
                 19.38 
                 N 
               
               
                 ATOM 
                 645 
                 CA 
                 CYS 
                 A 
                 83 
                 4.326 
                 34.925 
                 23.758 
                 1.00 
                 19.54 
                 C 
               
               
                 ATOM 
                 646 
                 C 
                 CYS 
                 A 
                 83 
                 3.495 
                 35.063 
                 22.498 
                 1.00 
                 19.13 
                 C 
               
               
                 ATOM 
                 647 
                 O 
                 CYS 
                 A 
                 83 
                 3.115 
                 36.166 
                 22.140 
                 1.00 
                 20.12 
                 O 
               
               
                 ATOM 
                 648 
                 CB 
                 CYS 
                 A 
                 83 
                 3.383 
                 34.516 
                 24.881 
                 1.00 
                 18.81 
                 C 
               
               
                 ATOM 
                 649 
                 SG 
                 CYS 
                 A 
                 83 
                 2.064 
                 35.745 
                 25.124 
                 1.00 
                 19.61 
                 S 
               
               
                 ATOM 
                 650 
                 N 
                 GLN 
                 A 
                 84 
                 3.155 
                 33.940 
                 21.873 
                 1.00 
                 19.01 
                 N 
               
               
                 ATOM 
                 651 
                 CA 
                 GLN 
                 A 
                 84 
                 2.386 
                 33.949 
                 20.620 
                 1.00 
                 18.39 
                 C 
               
               
                 ATOM 
                 652 
                 C 
                 GLN 
                 A 
                 84 
                 1.471 
                 32.748 
                 20.533 
                 1.00 
                 17.66 
                 C 
               
               
                 ATOM 
                 653 
                 O 
                 GLN 
                 A 
                 84 
                 1.878 
                 31.646 
                 20.855 
                 1.00 
                 17.08 
                 O 
               
               
                 ATOM 
                 654 
                 CB 
                 GLN 
                 A 
                 84 
                 3.302 
                 33.945 
                 19.400 
                 1.00 
                 18.68 
                 C 
               
               
                 ATOM 
                 655 
                 CG 
                 GLN 
                 A 
                 84 
                 2.520 
                 34.082 
                 18.069 
                 1.00 
                 20.36 
                 C 
               
               
                 ATOM 
                 656 
                 CD 
                 GLN 
                 A 
                 84 
                 3.286 
                 34.805 
                 16.985 
                 1.00 
                 22.07 
                 C 
               
               
                 ATOM 
                 657 
                 OE1 
                 GLN 
                 A 
                 84 
                 2.702 
                 35.549 
                 16.177 
                 1.00 
                 25.82 
                 O 
               
               
                 ATOM 
                 658 
                 NE2 
                 GLN 
                 A 
                 84 
                 4.580 
                 34.620 
                 16.970 
                 1.00 
                 22.45 
                 N 
               
               
                 ATOM 
                 659 
                 N 
                 ALA 
                 A 
                 85 
                 0.227 
                 32.986 
                 20.120 
                 1.00 
                 17.06 
                 N 
               
               
                 ATOM 
                 660 
                 CA 
                 ALA 
                 A 
                 85 
                 −0.752 
                 31.946 
                 19.883 
                 1.00 
                 17.04 
                 C 
               
               
                 ATOM 
                 661 
                 C 
                 ALA 
                 A 
                 85 
                 −0.578 
                 31.510 
                 18.439 
                 1.00 
                 17.40 
                 C 
               
               
                 ATOM 
                 662 
                 O 
                 ALA 
                 A 
                 85 
                 −0.174 
                 32.300 
                 17.593 
                 1.00 
                 17.89 
                 O 
               
               
                 ATOM 
                 663 
                 CB 
                 ALA 
                 A 
                 85 
                 −2.189 
                 32.477 
                 20.111 
                 1.00 
                 16.15 
                 C 
               
               
                 ATOM 
                 664 
                 N 
                 PHE 
                 A 
                 86 
                 −0.882 
                 30.249 
                 18.186 
                 1.00 
                 17.84 
                 N 
               
               
                 ATOM 
                 665 
                 CA 
                 PHE 
                 A 
                 86 
                 −0.926 
                 29.674 
                 16.839 
                 1.00 
                 18.83 
                 C 
               
               
                 ATOM 
                 666 
                 C 
                 PHE 
                 A 
                 86 
                 −2.239 
                 28.934 
                 16.677 
                 1.00 
                 18.76 
                 C 
               
               
                 ATOM 
                 667 
                 O 
                 PHE 
                 A 
                 86 
                 −2.756 
                 28.351 
                 17.623 
                 1.00 
                 19.07 
                 O 
               
               
                 ATOM 
                 668 
                 CB 
                 PHE 
                 A 
                 86 
                 0.206 
                 28.670 
                 16.608 
                 1.00 
                 19.07 
                 C 
               
               
                 ATOM 
                 669 
                 CG 
                 PHE 
                 A 
                 86 
                 1.557 
                 29.293 
                 16.556 
                 1.00 
                 20.07 
                 C 
               
               
                 ATOM 
                 670 
                 CD1 
                 PHE 
                 A 
                 86 
                 2.196 
                 29.652 
                 17.710 
                 1.00 
                 21.17 
                 C 
               
               
                 ATOM 
                 671 
                 CD2 
                 PHE 
                 A 
                 86 
                 2.192 
                 29.507 
                 15.341 
                 1.00 
                 22.69 
                 C 
               
               
                 ATOM 
                 672 
                 CE1 
                 PHE 
                 A 
                 86 
                 3.454 
                 30.230 
                 17.671 
                 1.00 
                 24.31 
                 C 
               
               
                 ATOM 
                 673 
                 CE2 
                 PHE 
                 A 
                 86 
                 3.446 
                 30.106 
                 15.289 
                 1.00 
                 24.05 
                 C 
               
               
                 ATOM 
                 674 
                 CZ 
                 PHE 
                 A 
                 86 
                 4.086 
                 30.451 
                 16.456 
                 1.00 
                 23.58 
                 C 
               
               
                 ATOM 
                 675 
                 N 
                 TYR 
                 A 
                 87 
                 −2.747 
                 28.949 
                 15.455 
                 1.00 
                 19.72 
                 N 
               
               
                 ATOM 
                 676 
                 CA 
                 TYR 
                 A 
                 87 
                 −4.017 
                 28.334 
                 15.122 
                 1.00 
                 19.98 
                 C 
               
               
                 ATOM 
                 677 
                 C 
                 TYR 
                 A 
                 87 
                 −3.833 
                 27.437 
                 13.920 
                 1.00 
                 20.47 
                 C 
               
               
                 ATOM 
                 678 
                 O 
                 TYR 
                 A 
                 87 
                 −2.759 
                 27.389 
                 13.340 
                 1.00 
                 20.29 
                 O 
               
               
                 ATOM 
                 679 
                 CB 
                 TYR 
                 A 
                 87 
                 −5.023 
                 29.428 
                 14.726 
                 1.00 
                 19.55 
                 C 
               
               
                 ATOM 
                 680 
                 CG 
                 TYR 
                 A 
                 87 
                 −5.267 
                 30.538 
                 15.730 
                 1.00 
                 18.80 
                 C 
               
               
                 ATOM 
                 681 
                 CD1 
                 TYR 
                 A 
                 87 
                 −5.009 
                 31.865 
                 15.394 
                 1.00 
                 17.12 
                 C 
               
               
                 ATOM 
                 682 
                 CD2 
                 TYR 
                 A 
                 87 
                 −5.834 
                 30.275 
                 16.967 
                 1.00 
                 19.29 
                 C 
               
               
                 ATOM 
                 683 
                 CE1 
                 TYR 
                 A 
                 87 
                 −5.264 
                 32.881 
                 16.260 
                 1.00 
                 18.87 
                 C 
               
               
                 ATOM 
                 684 
                 CE2 
                 TYR 
                 A 
                 87 
                 −6.096 
                 31.298 
                 17.859 
                 1.00 
                 19.95 
                 C 
               
               
                 ATOM 
                 685 
                 CZ 
                 TYR 
                 A 
                 87 
                 −5.817 
                 32.608 
                 17.489 
                 1.00 
                 19.14 
                 C 
               
               
                 ATOM 
                 686 
                 OH 
                 TYR 
                 A 
                 87 
                 −6.068 
                 33.645 
                 18.340 
                 1.00 
                 20.15 
                 O 
               
               
                 ATOM 
                 687 
                 N 
                 SER 
                 A 
                 88 
                 −4.898 
                 26.764 
                 13.512 
                 1.00 
                 21.28 
                 N 
               
               
                 ATOM 
                 688 
                 CA 
                 SER 
                 A 
                 88 
                 −4.836 
                 25.962 
                 12.295 
                 1.00 
                 23.13 
                 C 
               
               
                 ATOM 
                 689 
                 C 
                 SER 
                 A 
                 88 
                 −6.079 
                 26.121 
                 11.419 
                 1.00 
                 23.96 
                 C 
               
               
                 ATOM 
                 690 
                 O 
                 SER 
                 A 
                 88 
                 −7.179 
                 26.346 
                 11.918 
                 1.00 
                 23.81 
                 O 
               
               
                 ATOM 
                 691 
                 CB 
                 SER 
                 A 
                 88 
                 −4.625 
                 24.475 
                 12.629 
                 1.00 
                 22.85 
                 C 
               
               
                 ATOM 
                 692 
                 OG 
                 SER 
                 A 
                 88 
                 −5.821 
                 23.903 
                 13.115 
                 1.00 
                 22.43 
                 O 
               
               
                 ATOM 
                 693 
                 N 
                 LEU 
                 A 
                 89 
                 −5.880 
                 26.008 
                 10.110 
                 1.00 
                 25.98 
                 N 
               
               
                 ATOM 
                 694 
                 CA 
                 LEU 
                 A 
                 89 
                 −6.990 
                 25.886 
                 9.165 
                 1.00 
                 27.25 
                 C 
               
               
                 ATOM 
                 695 
                 C 
                 LEU 
                 A 
                 89 
                 −7.002 
                 24.483 
                 8.576 
                 1.00 
                 28.06 
                 C 
               
               
                 ATOM 
                 696 
                 O 
                 LEU 
                 A 
                 89 
                 −5.951 
                 23.950 
                 8.222 
                 1.00 
                 27.98 
                 O 
               
               
                 ATOM 
                 697 
                 CB 
                 LEU 
                 A 
                 89 
                 −6.866 
                 26.932 
                 8.058 
                 1.00 
                 27.52 
                 C 
               
               
                 ATOM 
                 698 
                 CG 
                 LEU 
                 A 
                 89 
                 −7.803 
                 28.155 
                 8.114 
                 1.00 
                 29.73 
                 C 
               
               
                 ATOM 
                 699 
                 CD1 
                 LEU 
                 A 
                 89 
                 −8.235 
                 28.564 
                 9.533 
                 1.00 
                 30.33 
                 C 
               
               
                 ATOM 
                 700 
                 CD2 
                 LEU 
                 A 
                 89 
                 −7.145 
                 29.358 
                 7.411 
                 1.00 
                 31.16 
                 C 
               
               
                 ATOM 
                 701 
                 N 
                 PRO 
                 A 
                 90 
                 −8.187 
                 23.883 
                 8.443 
                 1.00 
                 29.63 
                 N 
               
               
                 ATOM 
                 702 
                 CA 
                 PRO 
                 A 
                 90 
                 −8.283 
                 22.530 
                 7.881 
                 1.00 
                 30.44 
                 C 
               
               
                 ATOM 
                 703 
                 C 
                 PRO 
                 A 
                 90 
                 −7.902 
                 22.525 
                 6.417 
                 1.00 
                 31.06 
                 C 
               
               
                 ATOM 
                 704 
                 O 
                 PRO 
                 A 
                 90 
                 −7.949 
                 23.559 
                 5.752 
                 1.00 
                 31.55 
                 O 
               
               
                 ATOM 
                 705 
                 CB 
                 PRO 
                 A 
                 90 
                 −9.768 
                 22.177 
                 8.033 
                 1.00 
                 30.50 
                 C 
               
               
                 ATOM 
                 706 
                 CG 
                 PRO 
                 A 
                 90 
                 −10.464 
                 23.490 
                 8.063 
                 1.00 
                 30.55 
                 C 
               
               
                 ATOM 
                 707 
                 CD 
                 PRO 
                 A 
                 90 
                 −9.519 
                 24.431 
                 8.766 
                 1.00 
                 29.62 
                 C 
               
               
                 ATOM 
                 708 
                 N 
                 LEU 
                 A 
                 91 
                 −7.497 
                 21.360 
                 5.944 
                 1.00 
                 31.85 
                 N 
               
               
                 ATOM 
                 709 
                 CA 
                 LEU 
                 A 
                 91 
                 −7.196 
                 21.143 
                 4.538 
                 1.00 
                 32.49 
                 C 
               
               
                 ATOM 
                 710 
                 C 
                 LEU 
                 A 
                 91 
                 −7.932 
                 19.896 
                 4.069 
                 1.00 
                 32.76 
                 C 
               
               
                 ATOM 
                 711 
                 O 
                 LEU 
                 A 
                 91 
                 −8.475 
                 19.142 
                 4.882 
                 1.00 
                 32.71 
                 O 
               
               
                 ATOM 
                 712 
                 CB 
                 LEU 
                 A 
                 91 
                 −5.689 
                 20.983 
                 4.341 
                 1.00 
                 32.58 
                 C 
               
               
                 ATOM 
                 713 
                 CG 
                 LEU 
                 A 
                 91 
                 −4.854 
                 22.143 
                 4.890 
                 1.00 
                 32.68 
                 C 
               
               
                 ATOM 
                 714 
                 CD1 
                 LEU 
                 A 
                 91 
                 −3.396 
                 21.736 
                 5.042 
                 1.00 
                 32.35 
                 C 
               
               
                 ATOM 
                 715 
                 CD2 
                 LEU 
                 A 
                 91 
                 −5.001 
                 23.362 
                 3.984 
                 1.00 
                 33.25 
                 C 
               
               
                 ATOM 
                 716 
                 N 
                 GLY 
                 A 
                 92 
                 −7.967 
                 19.694 
                 2.756 
                 1.00 
                 33.35 
                 N 
               
               
                 ATOM 
                 717 
                 CA 
                 GLY 
                 A 
                 92 
                 −8.603 
                 18.519 
                 2.186 
                 1.00 
                 33.87 
                 C 
               
               
                 ATOM 
                 718 
                 C 
                 GLY 
                 A 
                 92 
                 −7.625 
                 17.370 
                 2.018 
                 1.00 
                 34.24 
                 C 
               
               
                 ATOM 
                 719 
                 O 
                 GLY 
                 A 
                 92 
                 −7.469 
                 16.853 
                 0.909 
                 1.00 
                 34.70 
                 O 
               
               
                 ATOM 
                 720 
                 N 
                 ASP 
                 A 
                 93 
                 −6.982 
                 16.962 
                 3.114 
                 1.00 
                 34.68 
                 N 
               
               
                 ATOM 
                 721 
                 CA 
                 ASP 
                 A 
                 93 
                 −5.910 
                 15.961 
                 3.084 
                 1.00 
                 34.86 
                 C 
               
               
                 ATOM 
                 722 
                 C 
                 ASP 
                 A 
                 93 
                 −5.524 
                 15.542 
                 4.505 
                 1.00 
                 34.75 
                 C 
               
               
                 ATOM 
                 723 
                 O 
                 ASP 
                 A 
                 93 
                 −5.313 
                 16.404 
                 5.367 
                 1.00 
                 34.57 
                 O 
               
               
                 ATOM 
                 724 
                 CB 
                 ASP 
                 A 
                 93 
                 −4.674 
                 16.526 
                 2.365 
                 1.00 
                 35.11 
                 C 
               
               
                 ATOM 
                 725 
                 CG 
                 ASP 
                 A 
                 93 
                 −3.673 
                 15.447 
                 1.968 
                 1.00 
                 35.84 
                 C 
               
               
                 ATOM 
                 726 
                 OD1 
                 ASP 
                 A 
                 93 
                 −2.481 
                 15.594 
                 2.311 
                 1.00 
                 37.57 
                 O 
               
               
                 ATOM 
                 727 
                 OD2 
                 ASP 
                 A 
                 93 
                 −3.972 
                 14.429 
                 1.305 
                 1.00 
                 36.48 
                 O 
               
               
                 ATOM 
                 728 
                 N 
                 TYR 
                 A 
                 94 
                 −5.444 
                 14.227 
                 4.736 
                 1.00 
                 34.54 
                 N 
               
               
                 ATOM 
                 729 
                 CA 
                 TYR 
                 A 
                 94 
                 −4.999 
                 13.649 
                 6.018 
                 1.00 
                 34.59 
                 C 
               
               
                 ATOM 
                 730 
                 C 
                 TYR 
                 A 
                 94 
                 −5.877 
                 14.239 
                 7.177 
                 1.00 
                 34.53 
                 C 
               
               
                 ATOM 
                 731 
                 O 
                 TYR 
                 A 
                 94 
                 −7.063 
                 14.418 
                 6.898 
                 1.00 
                 34.76 
                 O 
               
               
                 ATOM 
                 732 
                 CB 
                 TYR 
                 A 
                 94 
                 −3.469 
                 13.756 
                 6.099 
                 1.00 
                 34.48 
                 C 
               
               
                 ATOM 
                 733 
                 CG 
                 TYR 
                 A 
                 94 
                 −2.755 
                 12.615 
                 5.379 
                 1.00 
                 35.44 
                 C 
               
               
                 ATOM 
                 734 
                 CD1 
                 TYR 
                 A 
                 94 
                 −2.816 
                 12.498 
                 3.990 
                 1.00 
                 35.43 
                 C 
               
               
                 ATOM 
                 735 
                 CD2 
                 TYR 
                 A 
                 94 
                 −2.027 
                 11.650 
                 6.084 
                 1.00 
                 35.46 
                 C 
               
               
                 ATOM 
                 736 
                 CE1 
                 TYR 
                 A 
                 94 
                 −2.168 
                 11.471 
                 3.326 
                 1.00 
                 35.92 
                 C 
               
               
                 ATOM 
                 737 
                 CE2 
                 TYR 
                 A 
                 94 
                 −1.372 
                 10.614 
                 5.424 
                 1.00 
                 35.24 
                 C 
               
               
                 ATOM 
                 738 
                 CZ 
                 TYR 
                 A 
                 94 
                 −1.447 
                 10.526 
                 4.044 
                 1.00 
                 36.16 
                 C 
               
               
                 ATOM 
                 739 
                 OH 
                 TYR 
                 A 
                 94 
                 −0.812 
                 9.494 
                 3.371 
                 1.00 
                 35.86 
                 O 
               
               
                 ATOM 
                 740 
                 N 
                 ASN 
                 A 
                 95 
                 −5.475 
                 14.527 
                 8.433 
                 1.00 
                 34.45 
                 N 
               
               
                 ATOM 
                 741 
                 CA 
                 ASN 
                 A 
                 95 
                 −4.201 
                 14.291 
                 9.157 
                 1.00 
                 34.25 
                 C 
               
               
                 ATOM 
                 742 
                 C 
                 ASN 
                 A 
                 95 
                 −3.022 
                 15.236 
                 8.862 
                 1.00 
                 33.88 
                 C 
               
               
                 ATOM 
                 743 
                 O 
                 ASN 
                 A 
                 95 
                 −2.011 
                 15.209 
                 9.573 
                 1.00 
                 33.88 
                 O 
               
               
                 ATOM 
                 744 
                 CB 
                 ASN 
                 A 
                 95 
                 −3.787 
                 12.810 
                 9.182 
                 1.00 
                 34.55 
                 C 
               
               
                 ATOM 
                 745 
                 CG 
                 ASN 
                 A 
                 95 
                 −4.911 
                 11.887 
                 9.652 
                 1.00 
                 35.37 
                 C 
               
               
                 ATOM 
                 746 
                 OD1 
                 ASN 
                 A 
                 95 
                 −5.961 
                 12.340 
                 10.123 
                 1.00 
                 36.86 
                 O 
               
               
                 ATOM 
                 747 
                 ND2 
                 ASN 
                 A 
                 95 
                 −4.684 
                 10.586 
                 9.535 
                 1.00 
                 34.95 
                 N 
               
               
                 ATOM 
                 748 
                 N 
                 TYR 
                 A 
                 96 
                 −3.181 
                 16.096 
                 7.854 
                 1.00 
                 33.16 
                 N 
               
               
                 ATOM 
                 749 
                 CA 
                 TYR 
                 A 
                 96 
                 −2.272 
                 17.219 
                 7.616 
                 1.00 
                 32.52 
                 C 
               
               
                 ATOM 
                 750 
                 C 
                 TYR 
                 A 
                 96 
                 −3.106 
                 18.492 
                 7.595 
                 1.00 
                 31.59 
                 C 
               
               
                 ATOM 
                 751 
                 O 
                 TYR 
                 A 
                 96 
                 −3.950 
                 18.681 
                 6.719 
                 1.00 
                 31.58 
                 O 
               
               
                 ATOM 
                 752 
                 CB 
                 TYR 
                 A 
                 96 
                 −1.505 
                 17.067 
                 6.293 
                 1.00 
                 32.50 
                 C 
               
               
                 ATOM 
                 753 
                 CG 
                 TYR 
                 A 
                 96 
                 −0.684 
                 15.793 
                 6.168 
                 1.00 
                 32.98 
                 C 
               
               
                 ATOM 
                 754 
                 CD1 
                 TYR 
                 A 
                 96 
                 −0.589 
                 15.124 
                 4.953 
                 1.00 
                 32.82 
                 C 
               
               
                 ATOM 
                 755 
                 CD2 
                 TYR 
                 A 
                 96 
                 0.004 
                 15.261 
                 7.257 
                 1.00 
                 33.53 
                 C 
               
               
                 ATOM 
                 756 
                 CE1 
                 TYR 
                 A 
                 96 
                 0.163 
                 13.958 
                 4.829 
                 1.00 
                 33.77 
                 C 
               
               
                 ATOM 
                 757 
                 CE2 
                 TYR 
                 A 
                 96 
                 0.754 
                 14.078 
                 7.145 
                 1.00 
                 33.88 
                 C 
               
               
                 ATOM 
                 758 
                 CZ 
                 TYR 
                 A 
                 96 
                 0.833 
                 13.438 
                 5.928 
                 1.00 
                 34.01 
                 C 
               
               
                 ATOM 
                 759 
                 OH 
                 TYR 
                 A 
                 96 
                 1.573 
                 12.273 
                 5.796 
                 1.00 
                 36.25 
                 O 
               
               
                 ATOM 
                 760 
                 N 
                 SER 
                 A 
                 97 
                 −2.880 
                 19.346 
                 8.581 
                 1.00 
                 30.72 
                 N 
               
               
                 ATOM 
                 761 
                 CA 
                 SER 
                 A 
                 97 
                 −3.553 
                 20.627 
                 8.672 
                 1.00 
                 30.02 
                 C 
               
               
                 ATOM 
                 762 
                 C 
                 SER 
                 A 
                 97 
                 −2.541 
                 21.733 
                 8.385 
                 1.00 
                 29.28 
                 C 
               
               
                 ATOM 
                 763 
                 O 
                 SER 
                 A 
                 97 
                 −1.330 
                 21.466 
                 8.090 
                 1.00 
                 29.12 
                 O 
               
               
                 ATOM 
                 764 
                 CB 
                 SER 
                 A 
                 97 
                 −4.171 
                 20.793 
                 10.073 
                 1.00 
                 30.20 
                 C 
               
               
                 ATOM 
                 765 
                 OG 
                 SER 
                 A 
                 97 
                 −5.560 
                 21.058 
                 9.980 
                 1.00 
                 30.59 
                 O 
               
               
                 ATOM 
                 766 
                 N 
                 LEU 
                 A 
                 98 
                 −3.053 
                 22.970 
                 8.500 
                 1.00 
                 28.61 
                 N 
               
               
                 ATOM 
                 767 
                 CA 
                 LEU 
                 A 
                 98 
                 −2.294 
                 24.187 
                 8.237 
                 1.00 
                 28.32 
                 C 
               
               
                 ATOM 
                 768 
                 C 
                 LEU 
                 A 
                 98 
                 −2.146 
                 25.042 
                 9.499 
                 1.00 
                 27.54 
                 C 
               
               
                 ATOM 
                 769 
                 O 
                 LEU 
                 A 
                 98 
                 −3.081 
                 25.719 
                 9.893 
                 1.00 
                 27.36 
                 O 
               
               
                 ATOM 
                 770 
                 CB 
                 LEU 
                 A 
                 98 
                 −3.022 
                 24.990 
                 7.154 
                 1.00 
                 28.70 
                 C 
               
               
                 ATOM 
                 771 
                 CG 
                 LEU 
                 A 
                 98 
                 −2.230 
                 26.112 
                 6.484 
                 1.00 
                 29.45 
                 C 
               
               
                 ATOM 
                 772 
                 CD1 
                 LEU 
                 A 
                 98 
                 −2.319 
                 25.982 
                 4.986 
                 1.00 
                 30.13 
                 C 
               
               
                 ATOM 
                 773 
                 CD2 
                 LEU 
                 A 
                 98 
                 −2.737 
                 27.483 
                 6.936 
                 1.00 
                 30.42 
                 C 
               
               
                 ATOM 
                 774 
                 N 
                 LEU 
                 A 
                 99 
                 −0.966 
                 24.999 
                 10.113 
                 1.00 
                 27.09 
                 N 
               
               
                 ATOM 
                 775 
                 CA 
                 LEU 
                 A 
                 99 
                 −0.634 
                 25.803 
                 11.291 
                 1.00 
                 26.86 
                 C 
               
               
                 ATOM 
                 776 
                 C 
                 LEU 
                 A 
                 99 
                 −0.334 
                 27.232 
                 10.848 
                 1.00 
                 26.50 
                 C 
               
               
                 ATOM 
                 777 
                 O 
                 LEU 
                 A 
                 99 
                 0.386 
                 27.430 
                 9.882 
                 1.00 
                 26.79 
                 O 
               
               
                 ATOM 
                 778 
                 CB 
                 LEU 
                 A 
                 99 
                 0.620 
                 25.241 
                 11.987 
                 1.00 
                 27.12 
                 C 
               
               
                 ATOM 
                 779 
                 CG 
                 LEU 
                 A 
                 99 
                 0.716 
                 24.913 
                 13.491 
                 1.00 
                 27.84 
                 C 
               
               
                 ATOM 
                 780 
                 CD1 
                 LEU 
                 A 
                 99 
                 2.068 
                 25.380 
                 14.026 
                 1.00 
                 28.72 
                 C 
               
               
                 ATOM 
                 781 
                 CD2 
                 LEU 
                 A 
                 99 
                 −0.407 
                 25.463 
                 14.359 
                 1.00 
                 27.90 
                 C 
               
               
                 ATOM 
                 782 
                 N 
                 PHE 
                 A 
                 100 
                 −0.873 
                 28.225 
                 11.539 
                 1.00 
                 25.62 
                 N 
               
               
                 ATOM 
                 783 
                 CA 
                 PHE 
                 A 
                 100 
                 −0.539 
                 29.617 
                 11.225 
                 1.00 
                 25.27 
                 C 
               
               
                 ATOM 
                 784 
                 C 
                 PHE 
                 A 
                 100 
                 −0.417 
                 30.504 
                 12.463 
                 1.00 
                 24.37 
                 C 
               
               
                 ATOM 
                 785 
                 O 
                 PHE 
                 A 
                 100 
                 −1.028 
                 30.246 
                 13.492 
                 1.00 
                 23.75 
                 O 
               
               
                 ATOM 
                 786 
                 CB 
                 PHE 
                 A 
                 100 
                 −1.508 
                 30.206 
                 10.188 
                 1.00 
                 25.37 
                 C 
               
               
                 ATOM 
                 787 
                 CG 
                 PHE 
                 A 
                 100 
                 −2.881 
                 30.528 
                 10.719 
                 1.00 
                 25.83 
                 C 
               
               
                 ATOM 
                 788 
                 CD1 
                 PHE 
                 A 
                 100 
                 −3.156 
                 31.790 
                 11.251 
                 1.00 
                 25.42 
                 C 
               
               
                 ATOM 
                 789 
                 CD2 
                 PHE 
                 A 
                 100 
                 −3.911 
                 29.597 
                 10.632 
                 1.00 
                 25.10 
                 C 
               
               
                 ATOM 
                 790 
                 CE1 
                 PHE 
                 A 
                 100 
                 −4.427 
                 32.096 
                 11.733 
                 1.00 
                 25.81 
                 C 
               
               
                 ATOM 
                 791 
                 CE2 
                 PHE 
                 A 
                 100 
                 −5.193 
                 29.899 
                 11.100 
                 1.00 
                 25.01 
                 C 
               
               
                 ATOM 
                 792 
                 CZ 
                 PHE 
                 A 
                 100 
                 −5.458 
                 31.150 
                 11.643 
                 1.00 
                 25.23 
                 C 
               
               
                 ATOM 
                 793 
                 N 
                 ARG 
                 A 
                 101 
                 0.432 
                 31.518 
                 12.337 
                 1.00 
                 24.07 
                 N 
               
               
                 ATOM 
                 794 
                 CA 
                 ARG 
                 A 
                 101 
                 0.744 
                 32.458 
                 13.403 
                 1.00 
                 24.11 
                 C 
               
               
                 ATOM 
                 795 
                 C 
                 ARG 
                 A 
                 101 
                 −0.453 
                 33.293 
                 13.822 
                 1.00 
                 22.64 
                 C 
               
               
                 ATOM 
                 796 
                 O 
                 ARG 
                 A 
                 101 
                 −1.103 
                 33.900 
                 12.999 
                 1.00 
                 21.90 
                 O 
               
               
                 ATOM 
                 797 
                 CB 
                 ARG 
                 A 
                 101 
                 1.836 
                 33.417 
                 12.943 
                 1.00 
                 25.10 
                 C 
               
               
                 ATOM 
                 798 
                 CG 
                 ARG 
                 A 
                 101 
                 3.199 
                 33.076 
                 13.483 
                 1.00 
                 28.74 
                 C 
               
               
                 ATOM 
                 799 
                 CD 
                 ARG 
                 A 
                 101 
                 4.328 
                 33.811 
                 12.806 
                 1.00 
                 31.82 
                 C 
               
               
                 ATOM 
                 800 
                 NE 
                 ARG 
                 A 
                 101 
                 5.487 
                 32.933 
                 12.696 
                 1.00 
                 36.92 
                 N 
               
               
                 ATOM 
                 801 
                 CZ 
                 ARG 
                 A 
                 101 
                 6.334 
                 32.670 
                 13.693 
                 1.00 
                 40.20 
                 C 
               
               
                 ATOM 
                 802 
                 NH1 
                 ARG 
                 A 
                 101 
                 7.359 
                 31.849 
                 13.489 
                 1.00 
                 42.57 
                 N 
               
               
                 ATOM 
                 803 
                 NH2 
                 ARG 
                 A 
                 101 
                 6.172 
                 33.215 
                 14.891 
                 1.00 
                 40.80 
                 N 
               
               
                 ATOM 
                 804 
                 N 
                 GLY 
                 A 
                 102 
                 −0.713 
                 33.331 
                 15.121 
                 1.00 
                 21.51 
                 N 
               
               
                 ATOM 
                 805 
                 CA 
                 GLY 
                 A 
                 102 
                 −1.791 
                 34.111 
                 15.670 
                 1.00 
                 20.54 
                 C 
               
               
                 ATOM 
                 806 
                 C 
                 GLY 
                 A 
                 102 
                 −1.254 
                 35.330 
                 16.398 
                 1.00 
                 20.64 
                 C 
               
               
                 ATOM 
                 807 
                 O 
                 GLY 
                 A 
                 102 
                 −0.148 
                 35.845 
                 16.108 
                 1.00 
                 20.15 
                 O 
               
               
                 ATOM 
                 808 
                 N 
                 GLU 
                 A 
                 103 
                 −2.040 
                 35.777 
                 17.366 
                 1.00 
                 20.11 
                 N 
               
               
                 ATOM 
                 809 
                 CA 
                 GLU 
                 A 
                 103 
                 −1.764 
                 37.023 
                 18.082 
                 1.00 
                 20.21 
                 C 
               
               
                 ATOM 
                 810 
                 C 
                 GLU 
                 A 
                 103 
                 −0.595 
                 36.863 
                 19.039 
                 1.00 
                 19.74 
                 C 
               
               
                 ATOM 
                 811 
                 O 
                 GLU 
                 A 
                 103 
                 −0.319 
                 35.778 
                 19.539 
                 1.00 
                 19.27 
                 O 
               
               
                 ATOM 
                 812 
                 CB 
                 GLU 
                 A 
                 103 
                 −3.005 
                 37.520 
                 18.834 
                 1.00 
                 20.37 
                 C 
               
               
                 ATOM 
                 813 
                 CG 
                 GLU 
                 A 
                 103 
                 −4.122 
                 38.017 
                 17.910 
                 1.00 
                 19.56 
                 C 
               
               
                 ATOM 
                 814 
                 CD 
                 GLU 
                 A 
                 103 
                 −4.997 
                 36.877 
                 17.407 
                 1.00 
                 20.62 
                 C 
               
               
                 ATOM 
                 815 
                 OE1 
                 GLU 
                 A 
                 103 
                 −5.788 
                 37.120 
                 16.497 
                 1.00 
                 18.31 
                 O 
               
               
                 ATOM 
                 816 
                 OE2 
                 GLU 
                 A 
                 103 
                 −4.887 
                 35.735 
                 17.938 
                 1.00 
                 19.67 
                 O 
               
               
                 ATOM 
                 817 
                 N 
                 LYS 
                 A 
                 104 
                 0.105 
                 37.962 
                 19.236 
                 1.00 
                 19.97 
                 N 
               
               
                 ATOM 
                 818 
                 CA 
                 LYS 
                 A 
                 104 
                 1.308 
                 38.022 
                 20.041 
                 1.00 
                 21.39 
                 C 
               
               
                 ATOM 
                 819 
                 C 
                 LYS 
                 A 
                 104 
                 1.005 
                 38.882 
                 21.252 
                 1.00 
                 21.45 
                 C 
               
               
                 ATOM 
                 820 
                 O 
                 LYS 
                 A 
                 104 
                 0.296 
                 39.882 
                 21.145 
                 1.00 
                 21.44 
                 O 
               
               
                 ATOM 
                 821 
                 CB 
                 LYS 
                 A 
                 104 
                 2.446 
                 38.656 
                 19.216 
                 1.00 
                 22.22 
                 C 
               
               
                 ATOM 
                 822 
                 CG 
                 LYS 
                 A 
                 104 
                 3.791 
                 37.935 
                 19.294 
                 1.00 
                 23.77 
                 C 
               
               
                 ATOM 
                 823 
                 CD 
                 LYS 
                 A 
                 104 
                 4.795 
                 38.501 
                 18.284 
                 1.00 
                 25.29 
                 C 
               
               
                 ATOM 
                 824 
                 CE 
                 LYS 
                 A 
                 104 
                 6.247 
                 38.271 
                 18.753 
                 1.00 
                 25.29 
                 C 
               
               
                 ATOM 
                 825 
                 NZ 
                 LYS 
                 A 
                 104 
                 7.244 
                 38.247 
                 17.638 
                 1.00 
                 24.86 
                 N 
               
               
                 ATOM 
                 826 
                 N 
                 GLY 
                 A 
                 105 
                 1.549 
                 38.506 
                 22.406 
                 1.00 
                 21.96 
                 N 
               
               
                 ATOM 
                 827 
                 CA 
                 GLY 
                 A 
                 105 
                 1.483 
                 39.357 
                 23.578 
                 1.00 
                 21.61 
                 C 
               
               
                 ATOM 
                 828 
                 C 
                 GLY 
                 A 
                 105 
                 2.263 
                 40.654 
                 23.371 
                 1.00 
                 21.52 
                 C 
               
               
                 ATOM 
                 829 
                 O 
                 GLY 
                 A 
                 105 
                 3.169 
                 40.740 
                 22.540 
                 1.00 
                 20.89 
                 O 
               
               
                 ATOM 
                 830 
                 N 
                 ALA 
                 A 
                 106 
                 1.939 
                 41.650 
                 24.176 
                 1.00 
                 21.15 
                 N 
               
               
                 ATOM 
                 831 
                 CA 
                 ALA 
                 A 
                 106 
                 2.552 
                 42.977 
                 24.030 
                 1.00 
                 21.77 
                 C 
               
               
                 ATOM 
                 832 
                 C 
                 ALA 
                 A 
                 106 
                 3.948 
                 43.018 
                 24.648 
                 1.00 
                 21.64 
                 C 
               
               
                 ATOM 
                 833 
                 O 
                 ALA 
                 A 
                 106 
                 4.659 
                 43.974 
                 24.461 
                 1.00 
                 22.09 
                 O 
               
               
                 ATOM 
                 834 
                 CB 
                 ALA 
                 A 
                 106 
                 1.664 
                 44.046 
                 24.659 
                 1.00 
                 21.61 
                 C 
               
               
                 ATOM 
                 835 
                 N 
                 GLY 
                 A 
                 107 
                 4.325 
                 41.984 
                 25.395 
                 1.00 
                 21.27 
                 N 
               
               
                 ATOM 
                 836 
                 CA 
                 GLY 
                 A 
                 107 
                 5.678 
                 41.876 
                 25.896 
                 1.00 
                 20.82 
                 C 
               
               
                 ATOM 
                 837 
                 C 
                 GLY 
                 A 
                 107 
                 5.816 
                 42.112 
                 27.392 
                 1.00 
                 20.64 
                 C 
               
               
                 ATOM 
                 838 
                 O 
                 GLY 
                 A 
                 107 
                 4.971 
                 42.748 
                 28.029 
                 1.00 
                 20.50 
                 O 
               
               
                 ATOM 
                 839 
                 N 
                 THR 
                 A 
                 108 
                 6.896 
                 41.549 
                 27.927 
                 1.00 
                 19.91 
                 N 
               
               
                 ATOM 
                 840 
                 CA 
                 THR 
                 A 
                 108 
                 7.362 
                 41.715 
                 29.291 
                 1.00 
                 19.05 
                 C 
               
               
                 ATOM 
                 841 
                 C 
                 THR 
                 A 
                 108 
                 8.815 
                 42.207 
                 29.235 
                 1.00 
                 18.80 
                 C 
               
               
                 ATOM 
                 842 
                 O 
                 THR 
                 A 
                 108 
                 9.673 
                 41.495 
                 28.703 
                 1.00 
                 18.74 
                 O 
               
               
                 ATOM 
                 843 
                 CB 
                 THR 
                 A 
                 108 
                 7.367 
                 40.355 
                 30.019 
                 1.00 
                 18.67 
                 C 
               
               
                 ATOM 
                 844 
                 OG1 
                 THR 
                 A 
                 108 
                 6.026 
                 39.840 
                 30.183 
                 1.00 
                 19.42 
                 O 
               
               
                 ATOM 
                 845 
                 CG2 
                 THR 
                 A 
                 108 
                 7.954 
                 40.510 
                 31.435 
                 1.00 
                 18.69 
                 C 
               
               
                 ATOM 
                 846 
                 N 
                 ALA 
                 A 
                 109 
                 9.096 
                 43.390 
                 29.783 
                 1.00 
                 18.07 
                 N 
               
               
                 ATOM 
                 847 
                 CA 
                 ALA 
                 A 
                 109 
                 10.460 
                 43.927 
                 29.825 
                 1.00 
                 17.50 
                 C 
               
               
                 ATOM 
                 848 
                 C 
                 ALA 
                 A 
                 109 
                 11.078 
                 43.528 
                 31.144 
                 1.00 
                 17.58 
                 C 
               
               
                 ATOM 
                 849 
                 O 
                 ALA 
                 A 
                 109 
                 10.755 
                 44.091 
                 32.198 
                 1.00 
                 17.14 
                 O 
               
               
                 ATOM 
                 850 
                 CB 
                 ALA 
                 A 
                 109 
                 10.461 
                 45.464 
                 29.673 
                 1.00 
                 17.07 
                 C 
               
               
                 ATOM 
                 851 
                 N 
                 LEU 
                 A 
                 110 
                 11.951 
                 42.536 
                 31.080 
                 1.00 
                 17.82 
                 N 
               
               
                 ATOM 
                 852 
                 CA 
                 LEU 
                 A 
                 110 
                 12.601 
                 42.003 
                 32.265 
                 1.00 
                 17.96 
                 C 
               
               
                 ATOM 
                 853 
                 C 
                 LEU 
                 A 
                 110 
                 13.973 
                 42.624 
                 32.467 
                 1.00 
                 18.14 
                 C 
               
               
                 ATOM 
                 854 
                 O 
                 LEU 
                 A 
                 110 
                 14.762 
                 42.710 
                 31.550 
                 1.00 
                 17.77 
                 O 
               
               
                 ATOM 
                 855 
                 CB 
                 LEU 
                 A 
                 110 
                 12.714 
                 40.481 
                 32.146 
                 1.00 
                 17.52 
                 C 
               
               
                 ATOM 
                 856 
                 CG 
                 LEU 
                 A 
                 110 
                 13.640 
                 39.772 
                 33.158 
                 1.00 
                 17.20 
                 C 
               
               
                 ATOM 
                 857 
                 CD1 
                 LEU 
                 A 
                 110 
                 13.102 
                 39.836 
                 34.603 
                 1.00 
                 16.63 
                 C 
               
               
                 ATOM 
                 858 
                 CD2 
                 LEU 
                 A 
                 110 
                 13.878 
                 38.331 
                 32.704 
                 1.00 
                 16.47 
                 C 
               
               
                 ATOM 
                 859 
                 N 
                 THR 
                 A 
                 111 
                 14.245 
                 43.003 
                 33.709 
                 1.00 
                 18.82 
                 N 
               
               
                 ATOM 
                 860 
                 CA 
                 THR 
                 A 
                 111 
                 15.523 
                 43.520 
                 34.138 
                 1.00 
                 19.38 
                 C 
               
               
                 ATOM 
                 861 
                 C 
                 THR 
                 A 
                 111 
                 16.042 
                 42.609 
                 35.241 
                 1.00 
                 19.63 
                 C 
               
               
                 ATOM 
                 862 
                 O 
                 THR 
                 A 
                 111 
                 15.412 
                 42.494 
                 36.289 
                 1.00 
                 19.13 
                 O 
               
               
                 ATOM 
                 863 
                 CB 
                 THR 
                 A 
                 111 
                 15.319 
                 44.941 
                 34.690 
                 1.00 
                 19.40 
                 C 
               
               
                 ATOM 
                 864 
                 OG1 
                 THR 
                 A 
                 111 
                 15.061 
                 45.835 
                 33.604 
                 1.00 
                 19.72 
                 O 
               
               
                 ATOM 
                 865 
                 CG2 
                 THR 
                 A 
                 111 
                 16.575 
                 45.478 
                 35.381 
                 1.00 
                 19.59 
                 C 
               
               
                 ATOM 
                 866 
                 N 
                 VAL 
                 A 
                 112 
                 17.194 
                 41.977 
                 35.006 
                 1.00 
                 20.01 
                 N 
               
               
                 ATOM 
                 867 
                 CA 
                 VAL 
                 A 
                 112 
                 17.834 
                 41.153 
                 36.012 
                 1.00 
                 20.08 
                 C 
               
               
                 ATOM 
                 868 
                 C 
                 VAL 
                 A 
                 112 
                 19.158 
                 41.763 
                 36.479 
                 1.00 
                 21.01 
                 C 
               
               
                 ATOM 
                 869 
                 O 
                 VAL 
                 A 
                 112 
                 20.018 
                 42.101 
                 35.663 
                 1.00 
                 20.26 
                 O 
               
               
                 ATOM 
                 870 
                 CB 
                 VAL 
                 A 
                 112 
                 18.107 
                 39.732 
                 35.497 
                 1.00 
                 20.00 
                 C 
               
               
                 ATOM 
                 871 
                 CG1 
                 VAL 
                 A 
                 112 
                 18.756 
                 38.892 
                 36.586 
                 1.00 
                 19.88 
                 C 
               
               
                 ATOM 
                 872 
                 CG2 
                 VAL 
                 A 
                 112 
                 16.812 
                 39.060 
                 34.991 
                 1.00 
                 20.28 
                 C 
               
               
                 ATOM 
                 873 
                 N 
                 LYS 
                 A 
                 113 
                 19.268 
                 41.953 
                 37.792 
                 1.00 
                 21.94 
                 N 
               
               
                 ATOM 
                 874 
                 CA 
                 LYS 
                 A 
                 113 
                 20.551 
                 41.895 
                 38.508 
                 1.00 
                 23.25 
                 C 
               
               
                 ATOM 
                 875 
                 C 
                 LYS 
                 A 
                 113 
                 20.351 
                 41.882 
                 40.024 
                 1.00 
                 23.33 
                 C 
               
               
                 ATOM 
                 876 
                 O 
                 LYS 
                 A 
                 113 
                 20.719 
                 40.909 
                 40.703 
                 1.00 
                 23.34 
                 O 
               
               
                 ATOM 
                 877 
                 CB 
                 LYS 
                 A 
                 113 
                 21.503 
                 43.027 
                 38.130 
                 1.00 
                 23.42 
                 C 
               
               
                 ATOM 
                 878 
                 CG 
                 LYS 
                 A 
                 113 
                 22.819 
                 43.037 
                 38.937 
                 1.00 
                 25.55 
                 C 
               
               
                 ATOM 
                 879 
                 CD 
                 LYS 
                 A 
                 113 
                 23.597 
                 41.700 
                 38.876 
                 1.00 
                 27.66 
                 C 
               
               
                 ATOM 
                 880 
                 CE 
                 LYS 
                 A 
                 113 
                 24.257 
                 41.325 
                 40.233 
                 1.00 
                 27.87 
                 C 
               
               
                 ATOM 
                 881 
                 NZ 
                 LYS 
                 A 
                 113 
                 23.252 
                 40.985 
                 41.318 
                 1.00 
                 27.98 
                 N 
               
               
                 TER 
                 882 
                   
                 LYS 
                 A 
                 113 
               
               
                 ATOM 
                 883 
                 N 
                 ALA 
                 B 
                 1 
                 −5.294 
                 52.838 
                 33.861 
                 1.00 
                 15.59 
                 N 
               
               
                 ATOM 
                 884 
                 CA 
                 ALA 
                 B 
                 1 
                 −6.196 
                 51.900 
                 34.558 
                 1.00 
                 14.51 
                 C 
               
               
                 ATOM 
                 885 
                 C 
                 ALA 
                 B 
                 1 
                 −7.435 
                 51.573 
                 33.721 
                 1.00 
                 14.54 
                 C 
               
               
                 ATOM 
                 886 
                 O 
                 ALA 
                 B 
                 1 
                 −8.023 
                 52.453 
                 33.056 
                 1.00 
                 13.96 
                 O 
               
               
                 ATOM 
                 887 
                 CB 
                 ALA 
                 B 
                 1 
                 −6.596 
                 52.455 
                 35.882 
                 1.00 
                 15.29 
                 C 
               
               
                 ATOM 
                 888 
                 N 
                 TRP 
                 B 
                 2 
                 −7.792 
                 50.292 
                 33.747 
                 1.00 
                 13.89 
                 N 
               
               
                 ATOM 
                 889 
                 CA 
                 TRP 
                 B 
                 2 
                 −8.997 
                 49.798 
                 33.142 
                 1.00 
                 14.26 
                 C 
               
               
                 ATOM 
                 890 
                 C 
                 TRP 
                 B 
                 2 
                 −9.652 
                 48.680 
                 33.968 
                 1.00 
                 15.11 
                 C 
               
               
                 ATOM 
                 891 
                 O 
                 TRP 
                 B 
                 2 
                 −9.016 
                 48.015 
                 34.809 
                 1.00 
                 16.01 
                 O 
               
               
                 ATOM 
                 892 
                 CB 
                 TRP 
                 B 
                 2 
                 −8.729 
                 49.330 
                 31.723 
                 1.00 
                 14.66 
                 C 
               
               
                 ATOM 
                 893 
                 CG 
                 TRP 
                 B 
                 2 
                 −7.843 
                 48.087 
                 31.565 
                 1.00 
                 14.26 
                 C 
               
               
                 ATOM 
                 894 
                 CD1 
                 TRP 
                 B 
                 2 
                 −6.506 
                 47.993 
                 31.797 
                 1.00 
                 14.52 
                 C 
               
               
                 ATOM 
                 895 
                 CD2 
                 TRP 
                 B 
                 2 
                 −8.254 
                 46.803 
                 31.086 
                 1.00 
                 13.13 
                 C 
               
               
                 ATOM 
                 896 
                 NE1 
                 TRP 
                 B 
                 2 
                 −6.056 
                 46.727 
                 31.499 
                 1.00 
                 15.51 
                 N 
               
               
                 ATOM 
                 897 
                 CE2 
                 TRP 
                 B 
                 2 
                 −7.106 
                 45.978 
                 31.045 
                 1.00 
                 13.67 
                 C 
               
               
                 ATOM 
                 898 
                 CE3 
                 TRP 
                 B 
                 2 
                 −9.473 
                 46.271 
                 30.660 
                 1.00 
                 12.74 
                 C 
               
               
                 ATOM 
                 899 
                 CZ2 
                 TRP 
                 B 
                 2 
                 −7.144 
                 44.653 
                 30.609 
                 1.00 
                 14.07 
                 C 
               
               
                 ATOM 
                 900 
                 CZ3 
                 TRP 
                 B 
                 2 
                 −9.515 
                 44.948 
                 30.232 
                 1.00 
                 14.11 
                 C 
               
               
                 ATOM 
                 901 
                 CH2 
                 TRP 
                 B 
                 2 
                 −8.361 
                 44.152 
                 30.218 
                 1.00 
                 14.28 
                 C 
               
               
                 ATOM 
                 902 
                 N 
                 VAL 
                 B 
                 3 
                 −10.946 
                 48.523 
                 33.743 
                 1.00 
                 14.74 
                 N 
               
               
                 ATOM 
                 903 
                 CA 
                 VAL 
                 B 
                 3 
                 −11.725 
                 47.514 
                 34.399 
                 1.00 
                 14.76 
                 C 
               
               
                 ATOM 
                 904 
                 C 
                 VAL 
                 B 
                 3 
                 −11.983 
                 46.417 
                 33.410 
                 1.00 
                 14.88 
                 C 
               
               
                 ATOM 
                 905 
                 O 
                 VAL 
                 B 
                 3 
                 −12.581 
                 46.644 
                 32.364 
                 1.00 
                 14.62 
                 O 
               
               
                 ATOM 
                 906 
                 CB 
                 VAL 
                 B 
                 3 
                 −13.048 
                 48.039 
                 34.946 
                 1.00 
                 14.64 
                 C 
               
               
                 ATOM 
                 907 
                 CG1 
                 VAL 
                 B 
                 3 
                 −13.891 
                 46.849 
                 35.486 
                 1.00 
                 15.90 
                 C 
               
               
                 ATOM 
                 908 
                 CG2 
                 VAL 
                 B 
                 3 
                 −12.788 
                 49.051 
                 36.036 
                 1.00 
                 12.79 
                 C 
               
               
                 ATOM 
                 909 
                 N 
                 ASP 
                 B 
                 4 
                 −11.493 
                 45.224 
                 33.765 
                 1.00 
                 14.91 
                 N 
               
               
                 ATOM 
                 910 
                 CA 
                 ASP 
                 B 
                 4 
                 −11.605 
                 44.027 
                 32.955 
                 1.00 
                 15.16 
                 C 
               
               
                 ATOM 
                 911 
                 C 
                 ASP 
                 B 
                 4 
                 −12.829 
                 43.217 
                 33.403 
                 1.00 
                 15.05 
                 C 
               
               
                 ATOM 
                 912 
                 O 
                 ASP 
                 B 
                 4 
                 −12.789 
                 42.529 
                 34.422 
                 1.00 
                 15.65 
                 O 
               
               
                 ATOM 
                 913 
                 CB 
                 ASP 
                 B 
                 4 
                 −10.314 
                 43.231 
                 33.119 
                 1.00 
                 14.69 
                 C 
               
               
                 ATOM 
                 914 
                 CG 
                 ASP 
                 B 
                 4 
                 −10.240 
                 42.019 
                 32.220 
                 1.00 
                 15.63 
                 C 
               
               
                 ATOM 
                 915 
                 OD1 
                 ASP 
                 B 
                 4 
                 −11.195 
                 41.730 
                 31.457 
                 1.00 
                 13.74 
                 O 
               
               
                 ATOM 
                 916 
                 OD2 
                 ASP 
                 B 
                 4 
                 −9.226 
                 41.299 
                 32.226 
                 1.00 
                 14.48 
                 O 
               
               
                 ATOM 
                 917 
                 N 
                 GLN 
                 B 
                 5 
                 −13.917 
                 43.340 
                 32.650 
                 1.00 
                 15.33 
                 N 
               
               
                 ATOM 
                 918 
                 CA 
                 GLN 
                 B 
                 5 
                 −15.213 
                 42.752 
                 33.000 
                 1.00 
                 15.77 
                 C 
               
               
                 ATOM 
                 919 
                 C 
                 GLN 
                 B 
                 5 
                 −15.519 
                 41.512 
                 32.150 
                 1.00 
                 15.63 
                 C 
               
               
                 ATOM 
                 920 
                 O 
                 GLN 
                 B 
                 5 
                 −15.503 
                 41.581 
                 30.946 
                 1.00 
                 15.80 
                 O 
               
               
                 ATOM 
                 921 
                 CB 
                 GLN 
                 B 
                 5 
                 −16.339 
                 43.795 
                 32.845 
                 1.00 
                 15.67 
                 C 
               
               
                 ATOM 
                 922 
                 CG 
                 GLN 
                 B 
                 5 
                 −17.760 
                 43.235 
                 33.121 
                 1.00 
                 16.80 
                 C 
               
               
                 ATOM 
                 923 
                 CD 
                 GLN 
                 B 
                 5 
                 −18.885 
                 44.261 
                 32.983 
                 1.00 
                 17.15 
                 C 
               
               
                 ATOM 
                 924 
                 OE1 
                 GLN 
                 B 
                 5 
                 −18.630 
                 45.443 
                 32.871 
                 1.00 
                 18.07 
                 O 
               
               
                 ATOM 
                 925 
                 NE2 
                 GLN 
                 B 
                 5 
                 −20.132 
                 43.794 
                 33.006 
                 1.00 
                 16.71 
                 N 
               
               
                 ATOM 
                 926 
                 N 
                 THR 
                 B 
                 6 
                 −15.813 
                 40.391 
                 32.802 
                 1.00 
                 15.97 
                 N 
               
               
                 ATOM 
                 927 
                 CA 
                 THR 
                 B 
                 6 
                 −16.163 
                 39.147 
                 32.127 
                 1.00 
                 15.83 
                 C 
               
               
                 ATOM 
                 928 
                 C 
                 THR 
                 B 
                 6 
                 −17.374 
                 38.489 
                 32.805 
                 1.00 
                 16.25 
                 C 
               
               
                 ATOM 
                 929 
                 O 
                 THR 
                 B 
                 6 
                 −17.561 
                 38.649 
                 34.004 
                 1.00 
                 15.50 
                 O 
               
               
                 ATOM 
                 930 
                 CB 
                 THR 
                 B 
                 6 
                 −14.995 
                 38.146 
                 32.194 
                 1.00 
                 16.30 
                 C 
               
               
                 ATOM 
                 931 
                 OG1 
                 THR 
                 B 
                 6 
                 −14.547 
                 38.023 
                 33.550 
                 1.00 
                 15.78 
                 O 
               
               
                 ATOM 
                 932 
                 CG2 
                 THR 
                 B 
                 6 
                 −13.767 
                 38.649 
                 31.413 
                 1.00 
                 16.41 
                 C 
               
               
                 ATOM 
                 933 
                 N 
                 PRO 
                 B 
                 7 
                 −18.176 
                 37.721 
                 32.068 
                 1.00 
                 16.95 
                 N 
               
               
                 ATOM 
                 934 
                 CA 
                 PRO 
                 B 
                 7 
                 −18.021 
                 37.519 
                 30.628 
                 1.00 
                 17.42 
                 C 
               
               
                 ATOM 
                 935 
                 C 
                 PRO 
                 B 
                 7 
                 −18.597 
                 38.687 
                 29.856 
                 1.00 
                 17.85 
                 C 
               
               
                 ATOM 
                 936 
                 O 
                 PRO 
                 B 
                 7 
                 −19.411 
                 39.454 
                 30.375 
                 1.00 
                 17.30 
                 O 
               
               
                 ATOM 
                 937 
                 CB 
                 PRO 
                 B 
                 7 
                 −18.861 
                 36.265 
                 30.365 
                 1.00 
                 17.52 
                 C 
               
               
                 ATOM 
                 938 
                 CG 
                 PRO 
                 B 
                 7 
                 −19.937 
                 36.316 
                 31.380 
                 1.00 
                 17.28 
                 C 
               
               
                 ATOM 
                 939 
                 CD 
                 PRO 
                 B 
                 7 
                 −19.324 
                 36.967 
                 32.593 
                 1.00 
                 17.21 
                 C 
               
               
                 ATOM 
                 940 
                 N 
                 ARG 
                 B 
                 8 
                 −18.184 
                 38.802 
                 28.605 
                 1.00 
                 19.10 
                 N 
               
               
                 ATOM 
                 941 
                 CA 
                 ARG 
                 B 
                 8 
                 −18.717 
                 39.826 
                 27.719 
                 1.00 
                 20.43 
                 C 
               
               
                 ATOM 
                 942 
                 C 
                 ARG 
                 B 
                 8 
                 −20.149 
                 39.521 
                 27.296 
                 1.00 
                 19.68 
                 C 
               
               
                 ATOM 
                 943 
                 O 
                 ARG 
                 B 
                 8 
                 −20.933 
                 40.434 
                 27.059 
                 1.00 
                 19.82 
                 O 
               
               
                 ATOM 
                 944 
                 CB 
                 ARG 
                 B 
                 8 
                 −17.823 
                 39.985 
                 26.483 
                 1.00 
                 21.79 
                 C 
               
               
                 ATOM 
                 945 
                 CG 
                 ARG 
                 B 
                 8 
                 −16.418 
                 40.439 
                 26.812 
                 1.00 
                 25.91 
                 C 
               
               
                 ATOM 
                 946 
                 CD 
                 ARG 
                 B 
                 8 
                 −16.335 
                 41.781 
                 27.546 
                 1.00 
                 31.75 
                 C 
               
               
                 ATOM 
                 947 
                 NE 
                 ARG 
                 B 
                 8 
                 −15.643 
                 42.783 
                 26.732 
                 1.00 
                 37.11 
                 N 
               
               
                 ATOM 
                 948 
                 CZ 
                 ARG 
                 B 
                 8 
                 −16.233 
                 43.675 
                 25.925 
                 1.00 
                 40.95 
                 C 
               
               
                 ATOM 
                 949 
                 NH1 
                 ARG 
                 B 
                 8 
                 −17.563 
                 43.759 
                 25.817 
                 1.00 
                 42.20 
                 N 
               
               
                 ATOM 
                 950 
                 NH2 
                 ARG 
                 B 
                 8 
                 −15.475 
                 44.500 
                 25.209 
                 1.00 
                 42.21 
                 N 
               
               
                 ATOM 
                 951 
                 N 
                 THR 
                 B 
                 9 
                 −20.468 
                 38.243 
                 27.163 
                 1.00 
                 19.30 
                 N 
               
               
                 ATOM 
                 952 
                 CA 
                 THR 
                 B 
                 9 
                 −21.836 
                 37.810 
                 26.904 
                 1.00 
                 19.45 
                 C 
               
               
                 ATOM 
                 953 
                 C 
                 THR 
                 B 
                 9 
                 −22.125 
                 36.529 
                 27.644 
                 1.00 
                 18.89 
                 C 
               
               
                 ATOM 
                 954 
                 O 
                 THR 
                 B 
                 9 
                 −21.230 
                 35.774 
                 28.021 
                 1.00 
                 18.82 
                 O 
               
               
                 ATOM 
                 955 
                 CB 
                 THR 
                 B 
                 9 
                 −22.125 
                 37.537 
                 25.389 
                 1.00 
                 19.83 
                 C 
               
               
                 ATOM 
                 956 
                 OG1 
                 THR 
                 B 
                 9 
                 −21.516 
                 36.311 
                 25.004 
                 1.00 
                 21.08 
                 O 
               
               
                 ATOM 
                 957 
                 CG2 
                 THR 
                 B 
                 9 
                 −21.487 
                 38.550 
                 24.454 
                 1.00 
                 20.14 
                 C 
               
               
                 ATOM 
                 958 
                 N 
                 ALA 
                 B 
                 10 
                 −23.410 
                 36.271 
                 27.810 
                 1.00 
                 18.26 
                 N 
               
               
                 ATOM 
                 959 
                 CA 
                 ALA 
                 B 
                 10 
                 −23.861 
                 35.097 
                 28.512 
                 1.00 
                 17.32 
                 C 
               
               
                 ATOM 
                 960 
                 C 
                 ALA 
                 B 
                 10 
                 −25.289 
                 34.832 
                 28.117 
                 1.00 
                 17.20 
                 C 
               
               
                 ATOM 
                 961 
                 O 
                 ALA 
                 B 
                 10 
                 −26.077 
                 35.749 
                 27.930 
                 1.00 
                 15.99 
                 O 
               
               
                 ATOM 
                 962 
                 CB 
                 ALA 
                 B 
                 10 
                 −23.759 
                 35.304 
                 30.010 
                 1.00 
                 17.04 
                 C 
               
               
                 ATOM 
                 963 
                 N 
                 THR 
                 B 
                 11 
                 −25.595 
                 33.555 
                 27.968 
                 1.00 
                 17.78 
                 N 
               
               
                 ATOM 
                 964 
                 CA 
                 THR 
                 B 
                 11 
                 −26.949 
                 33.102 
                 27.803 
                 1.00 
                 18.49 
                 C 
               
               
                 ATOM 
                 965 
                 C 
                 THR 
                 B 
                 11 
                 −27.249 
                 32.171 
                 28.946 
                 1.00 
                 19.15 
                 C 
               
               
                 ATOM 
                 966 
                 O 
                 THR 
                 B 
                 11 
                 −26.481 
                 31.250 
                 29.230 
                 1.00 
                 19.45 
                 O 
               
               
                 ATOM 
                 967 
                 CB 
                 THR 
                 B 
                 11 
                 −27.096 
                 32.385 
                 26.474 
                 1.00 
                 18.37 
                 C 
               
               
                 ATOM 
                 968 
                 OG1 
                 THR 
                 B 
                 11 
                 −27.013 
                 33.355 
                 25.429 
                 1.00 
                 19.62 
                 O 
               
               
                 ATOM 
                 969 
                 CG2 
                 THR 
                 B 
                 11 
                 −28.487 
                 31.786 
                 26.316 
                 1.00 
                 18.50 
                 C 
               
               
                 ATOM 
                 970 
                 N 
                 LYS 
                 B 
                 12 
                 −28.381 
                 32.425 
                 29.587 
                 1.00 
                 19.79 
                 N 
               
               
                 ATOM 
                 971 
                 CA 
                 LYS 
                 B 
                 12 
                 −28.833 
                 31.655 
                 30.718 
                 1.00 
                 20.44 
                 C 
               
               
                 ATOM 
                 972 
                 C 
                 LYS 
                 B 
                 12 
                 −30.323 
                 31.299 
                 30.553 
                 1.00 
                 20.18 
                 C 
               
               
                 ATOM 
                 973 
                 O 
                 LYS 
                 B 
                 12 
                 −31.035 
                 31.916 
                 29.776 
                 1.00 
                 19.79 
                 O 
               
               
                 ATOM 
                 974 
                 CB 
                 LYS 
                 B 
                 12 
                 −28.588 
                 32.465 
                 31.998 
                 1.00 
                 20.72 
                 C 
               
               
                 ATOM 
                 975 
                 CG 
                 LYS 
                 B 
                 12 
                 −27.432 
                 31.942 
                 32.858 
                 1.00 
                 22.57 
                 C 
               
               
                 ATOM 
                 976 
                 CD 
                 LYS 
                 B 
                 12 
                 −26.102 
                 32.568 
                 32.529 
                 1.00 
                 24.40 
                 C 
               
               
                 ATOM 
                 977 
                 CE 
                 LYS 
                 B 
                 12 
                 −24.953 
                 31.573 
                 32.674 
                 1.00 
                 25.84 
                 C 
               
               
                 ATOM 
                 978 
                 NZ 
                 LYS 
                 B 
                 12 
                 −24.586 
                 31.287 
                 34.076 
                 1.00 
                 26.38 
                 N 
               
               
                 ATOM 
                 979 
                 N 
                 GLU 
                 B 
                 13 
                 −30.763 
                 30.282 
                 31.275 
                 1.00 
                 20.44 
                 N 
               
               
                 ATOM 
                 980 
                 CA 
                 GLU 
                 B 
                 13 
                 −32.173 
                 29.910 
                 31.332 
                 1.00 
                 20.98 
                 C 
               
               
                 ATOM 
                 981 
                 C 
                 GLU 
                 B 
                 13 
                 −32.757 
                 30.643 
                 32.525 
                 1.00 
                 20.99 
                 C 
               
               
                 ATOM 
                 982 
                 O 
                 GLU 
                 B 
                 13 
                 −32.003 
                 31.058 
                 33.409 
                 1.00 
                 20.59 
                 O 
               
               
                 ATOM 
                 983 
                 CB 
                 GLU 
                 B 
                 13 
                 −32.321 
                 28.404 
                 31.536 
                 1.00 
                 21.11 
                 C 
               
               
                 ATOM 
                 984 
                 CG 
                 GLU 
                 B 
                 13 
                 −31.536 
                 27.530 
                 30.561 
                 1.00 
                 22.38 
                 C 
               
               
                 ATOM 
                 985 
                 CD 
                 GLU 
                 B 
                 13 
                 −32.114 
                 27.528 
                 29.159 
                 1.00 
                 22.84 
                 C 
               
               
                 ATOM 
                 986 
                 OE1 
                 GLU 
                 B 
                 13 
                 −33.252 
                 27.051 
                 28.965 
                 1.00 
                 22.94 
                 O 
               
               
                 ATOM 
                 987 
                 OE2 
                 GLU 
                 B 
                 13 
                 −31.422 
                 28.010 
                 28.244 
                 1.00 
                 25.76 
                 O 
               
               
                 ATOM 
                 988 
                 N 
                 THR 
                 B 
                 14 
                 −34.078 
                 30.811 
                 32.582 
                 1.00 
                 21.09 
                 N 
               
               
                 ATOM 
                 989 
                 CA 
                 THR 
                 B 
                 14 
                 −34.654 
                 31.436 
                 33.772 
                 1.00 
                 21.59 
                 C 
               
               
                 ATOM 
                 990 
                 C 
                 THR 
                 B 
                 14 
                 −34.457 
                 30.448 
                 34.910 
                 1.00 
                 22.01 
                 C 
               
               
                 ATOM 
                 991 
                 O 
                 THR 
                 B 
                 14 
                 −34.570 
                 29.236 
                 34.713 
                 1.00 
                 21.49 
                 O 
               
               
                 ATOM 
                 992 
                 CB 
                 THR 
                 B 
                 14 
                 −36.161 
                 31.873 
                 33.652 
                 1.00 
                 21.37 
                 C 
               
               
                 ATOM 
                 993 
                 OG1 
                 THR 
                 B 
                 14 
                 −37.020 
                 30.818 
                 34.079 
                 1.00 
                 21.82 
                 O 
               
               
                 ATOM 
                 994 
                 CG2 
                 THR 
                 B 
                 14 
                 −36.592 
                 32.178 
                 32.225 
                 1.00 
                 21.18 
                 C 
               
               
                 ATOM 
                 995 
                 N 
                 GLY 
                 B 
                 15 
                 −34.098 
                 30.970 
                 36.082 
                 1.00 
                 22.66 
                 N 
               
               
                 ATOM 
                 996 
                 CA 
                 GLY 
                 B 
                 15 
                 −33.883 
                 30.142 
                 37.256 
                 1.00 
                 23.26 
                 C 
               
               
                 ATOM 
                 997 
                 C 
                 GLY 
                 B 
                 15 
                 −32.410 
                 29.995 
                 37.566 
                 1.00 
                 23.45 
                 C 
               
               
                 ATOM 
                 998 
                 O 
                 GLY 
                 B 
                 15 
                 −32.033 
                 29.909 
                 38.729 
                 1.00 
                 23.59 
                 O 
               
               
                 ATOM 
                 999 
                 N 
                 GLU 
                 B 
                 16 
                 −31.582 
                 29.967 
                 36.524 
                 1.00 
                 24.06 
                 N 
               
               
                 ATOM 
                 1000 
                 CA 
                 GLU 
                 B 
                 16 
                 −30.133 
                 29.924 
                 36.681 
                 1.00 
                 24.32 
                 C 
               
               
                 ATOM 
                 1001 
                 C 
                 GLU 
                 B 
                 16 
                 −29.621 
                 31.250 
                 37.214 
                 1.00 
                 24.70 
                 C 
               
               
                 ATOM 
                 1002 
                 O 
                 GLU 
                 B 
                 16 
                 −30.382 
                 32.215 
                 37.327 
                 1.00 
                 25.07 
                 O 
               
               
                 ATOM 
                 1003 
                 CB 
                 GLU 
                 B 
                 16 
                 −29.458 
                 29.604 
                 35.348 
                 1.00 
                 24.49 
                 C 
               
               
                 ATOM 
                 1004 
                 CG 
                 GLU 
                 B 
                 16 
                 −29.883 
                 28.252 
                 34.783 
                 1.00 
                 24.62 
                 C 
               
               
                 ATOM 
                 1005 
                 CD 
                 GLU 
                 B 
                 16 
                 −28.994 
                 27.748 
                 33.659 
                 1.00 
                 25.18 
                 C 
               
               
                 ATOM 
                 1006 
                 OE1 
                 GLU 
                 B 
                 16 
                 −28.404 
                 28.574 
                 32.920 
                 1.00 
                 23.51 
                 O 
               
               
                 ATOM 
                 1007 
                 OE2 
                 GLU 
                 B 
                 16 
                 −28.906 
                 26.505 
                 33.503 
                 1.00 
                 27.51 
                 O 
               
               
                 ATOM 
                 1008 
                 N 
                 SER 
                 B 
                 17 
                 −28.330 
                 31.286 
                 37.538 
                 1.00 
                 24.45 
                 N 
               
               
                 ATOM 
                 1009 
                 CA 
                 SER 
                 B 
                 17 
                 −27.680 
                 32.487 
                 38.013 
                 1.00 
                 24.38 
                 C 
               
               
                 ATOM 
                 1010 
                 C 
                 SER 
                 B 
                 17 
                 −26.524 
                 32.917 
                 37.097 
                 1.00 
                 23.43 
                 C 
               
               
                 ATOM 
                 1011 
                 O 
                 SER 
                 B 
                 17 
                 −26.074 
                 32.161 
                 36.229 
                 1.00 
                 23.02 
                 O 
               
               
                 ATOM 
                 1012 
                 CB 
                 SER 
                 B 
                 17 
                 −27.181 
                 32.267 
                 39.441 
                 1.00 
                 24.82 
                 C 
               
               
                 ATOM 
                 1013 
                 OG 
                 SER 
                 B 
                 17 
                 −26.182 
                 31.263 
                 39.474 
                 1.00 
                 27.20 
                 O 
               
               
                 ATOM 
                 1014 
                 N 
                 LEU 
                 B 
                 18 
                 −26.079 
                 34.153 
                 37.296 
                 1.00 
                 22.87 
                 N 
               
               
                 ATOM 
                 1015 
                 CA 
                 LEU 
                 B 
                 18 
                 −24.952 
                 34.742 
                 36.565 
                 1.00 
                 22.89 
                 C 
               
               
                 ATOM 
                 1016 
                 C 
                 LEU 
                 B 
                 18 
                 −23.964 
                 35.355 
                 37.532 
                 1.00 
                 22.41 
                 C 
               
               
                 ATOM 
                 1017 
                 O 
                 LEU 
                 B 
                 18 
                 −24.365 
                 36.105 
                 38.414 
                 1.00 
                 22.16 
                 O 
               
               
                 ATOM 
                 1018 
                 CB 
                 LEU 
                 B 
                 18 
                 −25.455 
                 35.873 
                 35.654 
                 1.00 
                 22.72 
                 C 
               
               
                 ATOM 
                 1019 
                 CG 
                 LEU 
                 B 
                 18 
                 −24.729 
                 36.314 
                 34.379 
                 1.00 
                 23.50 
                 C 
               
               
                 ATOM 
                 1020 
                 CD1 
                 LEU 
                 B 
                 18 
                 −24.683 
                 37.821 
                 34.299 
                 1.00 
                 22.99 
                 C 
               
               
                 ATOM 
                 1021 
                 CD2 
                 LEU 
                 B 
                 18 
                 −23.348 
                 35.686 
                 34.150 
                 1.00 
                 24.23 
                 C 
               
               
                 ATOM 
                 1022 
                 N 
                 THR 
                 B 
                 19 
                 −22.678 
                 35.065 
                 37.339 
                 1.00 
                 21.68 
                 N 
               
               
                 ATOM 
                 1023 
                 CA 
                 THR 
                 B 
                 19 
                 −21.605 
                 35.809 
                 37.980 
                 1.00 
                 21.02 
                 C 
               
               
                 ATOM 
                 1024 
                 C 
                 THR 
                 B 
                 19 
                 −20.890 
                 36.641 
                 36.923 
                 1.00 
                 19.99 
                 C 
               
               
                 ATOM 
                 1025 
                 O 
                 THR 
                 B 
                 19 
                 −20.510 
                 36.120 
                 35.877 
                 1.00 
                 20.15 
                 O 
               
               
                 ATOM 
                 1026 
                 CB 
                 THR 
                 B 
                 19 
                 −20.597 
                 34.864 
                 38.665 
                 1.00 
                 21.31 
                 C 
               
               
                 ATOM 
                 1027 
                 OG1 
                 THR 
                 B 
                 19 
                 −21.255 
                 34.102 
                 39.683 
                 1.00 
                 20.95 
                 O 
               
               
                 ATOM 
                 1028 
                 CG2 
                 THR 
                 B 
                 19 
                 −19.544 
                 35.654 
                 39.448 
                 1.00 
                 20.49 
                 C 
               
               
                 ATOM 
                 1029 
                 N 
                 ILE 
                 B 
                 20 
                 −20.777 
                 37.941 
                 37.188 
                 1.00 
                 18.82 
                 N 
               
               
                 ATOM 
                 1030 
                 CA 
                 ILE 
                 B 
                 20 
                 −19.940 
                 38.853 
                 36.425 
                 1.00 
                 18.18 
                 C 
               
               
                 ATOM 
                 1031 
                 C 
                 ILE 
                 B 
                 20 
                 −18.750 
                 39.217 
                 37.289 
                 1.00 
                 17.93 
                 C 
               
               
                 ATOM 
                 1032 
                 O 
                 ILE 
                 B 
                 20 
                 −18.909 
                 39.593 
                 38.456 
                 1.00 
                 16.31 
                 O 
               
               
                 ATOM 
                 1033 
                 CB 
                 ILE 
                 B 
                 20 
                 −20.697 
                 40.134 
                 36.059 
                 1.00 
                 18.01 
                 C 
               
               
                 ATOM 
                 1034 
                 CG1 
                 ILE 
                 B 
                 20 
                 −22.010 
                 39.806 
                 35.333 
                 1.00 
                 19.21 
                 C 
               
               
                 ATOM 
                 1035 
                 CG2 
                 ILE 
                 B 
                 20 
                 −19.791 
                 41.077 
                 35.275 
                 1.00 
                 17.59 
                 C 
               
               
                 ATOM 
                 1036 
                 CD1 
                 ILE 
                 B 
                 20 
                 −22.927 
                 41.015 
                 35.129 
                 1.00 
                 18.61 
                 C 
               
               
                 ATOM 
                 1037 
                 N 
                 ASN 
                 B 
                 21 
                 −17.555 
                 39.079 
                 36.717 
                 1.00 
                 18.25 
                 N 
               
               
                 ATOM 
                 1038 
                 CA 
                 ASN 
                 B 
                 21 
                 −16.320 
                 39.372 
                 37.423 
                 1.00 
                 18.53 
                 C 
               
               
                 ATOM 
                 1039 
                 C 
                 ASN 
                 B 
                 21 
                 −15.681 
                 40.625 
                 36.827 
                 1.00 
                 17.94 
                 C 
               
               
                 ATOM 
                 1040 
                 O 
                 ASN 
                 B 
                 21 
                 −15.519 
                 40.729 
                 35.600 
                 1.00 
                 17.76 
                 O 
               
               
                 ATOM 
                 1041 
                 CB 
                 ASN 
                 B 
                 21 
                 −15.371 
                 38.171 
                 37.294 
                 1.00 
                 19.21 
                 C 
               
               
                 ATOM 
                 1042 
                 CG 
                 ASN 
                 B 
                 21 
                 −15.909 
                 36.916 
                 37.998 
                 1.00 
                 20.45 
                 C 
               
               
                 ATOM 
                 1043 
                 OD1 
                 ASN 
                 B 
                 21 
                 −16.162 
                 36.930 
                 39.210 
                 1.00 
                 22.21 
                 O 
               
               
                 ATOM 
                 1044 
                 ND2 
                 ASN 
                 B 
                 21 
                 −16.098 
                 35.841 
                 37.241 
                 1.00 
                 20.12 
                 N 
               
               
                 ATOM 
                 1045 
                 N 
                 CYS 
                 B 
                 22 
                 −15.288 
                 41.537 
                 37.707 
                 1.00 
                 17.20 
                 N 
               
               
                 ATOM 
                 1046 
                 CA 
                 CYS 
                 B 
                 22 
                 −14.600 
                 42.758 
                 37.346 
                 1.00 
                 17.12 
                 C 
               
               
                 ATOM 
                 1047 
                 C 
                 CYS 
                 B 
                 22 
                 −13.282 
                 42.865 
                 38.076 
                 1.00 
                 16.44 
                 C 
               
               
                 ATOM 
                 1048 
                 O 
                 CYS 
                 B 
                 22 
                 −13.205 
                 42.692 
                 39.299 
                 1.00 
                 16.37 
                 O 
               
               
                 ATOM 
                 1049 
                 CB 
                 CYS 
                 B 
                 22 
                 −15.478 
                 43.958 
                 37.653 
                 1.00 
                 17.80 
                 C 
               
               
                 ATOM 
                 1050 
                 SG 
                 CYS 
                 B 
                 22 
                 −16.804 
                 44.155 
                 36.434 
                 1.00 
                 20.00 
                 S 
               
               
                 ATOM 
                 1051 
                 N 
                 VAL 
                 B 
                 23 
                 −12.226 
                 43.149 
                 37.330 
                 1.00 
                 15.88 
                 N 
               
               
                 ATOM 
                 1052 
                 CA 
                 VAL 
                 B 
                 23 
                 −10.920 
                 43.356 
                 37.919 
                 1.00 
                 15.42 
                 C 
               
               
                 ATOM 
                 1053 
                 C 
                 VAL 
                 B 
                 23 
                 −10.391 
                 44.710 
                 37.454 
                 1.00 
                 15.65 
                 C 
               
               
                 ATOM 
                 1054 
                 O 
                 VAL 
                 B 
                 23 
                 −10.316 
                 44.989 
                 36.242 
                 1.00 
                 14.61 
                 O 
               
               
                 ATOM 
                 1055 
                 CB 
                 VAL 
                 B 
                 23 
                 −9.939 
                 42.248 
                 37.497 
                 1.00 
                 15.66 
                 C 
               
               
                 ATOM 
                 1056 
                 CG1 
                 VAL 
                 B 
                 23 
                 −8.606 
                 42.369 
                 38.272 
                 1.00 
                 16.38 
                 C 
               
               
                 ATOM 
                 1057 
                 CG2 
                 VAL 
                 B 
                 23 
                 −10.572 
                 40.871 
                 37.674 
                 1.00 
                 17.32 
                 C 
               
               
                 ATOM 
                 1058 
                 N 
                 LEU 
                 B 
                 24 
                 −9.981 
                 45.525 
                 38.413 
                 1.00 
                 15.75 
                 N 
               
               
                 ATOM 
                 1059 
                 CA 
                 LEU 
                 B 
                 24 
                 −9.359 
                 46.813 
                 38.126 
                 1.00 
                 17.10 
                 C 
               
               
                 ATOM 
                 1060 
                 C 
                 LEU 
                 B 
                 24 
                 −7.861 
                 46.601 
                 37.940 
                 1.00 
                 16.81 
                 C 
               
               
                 ATOM 
                 1061 
                 O 
                 LEU 
                 B 
                 24 
                 −7.173 
                 46.203 
                 38.879 
                 1.00 
                 16.22 
                 O 
               
               
                 ATOM 
                 1062 
                 CB 
                 LEU 
                 B 
                 24 
                 −9.632 
                 47.769 
                 39.287 
                 1.00 
                 17.80 
                 C 
               
               
                 ATOM 
                 1063 
                 CG 
                 LEU 
                 B 
                 24 
                 −9.501 
                 49.301 
                 39.180 
                 1.00 
                 21.15 
                 C 
               
               
                 ATOM 
                 1064 
                 CD1 
                 LEU 
                 B 
                 24 
                 −8.606 
                 49.843 
                 40.273 
                 1.00 
                 22.01 
                 C 
               
               
                 ATOM 
                 1065 
                 CD2 
                 LEU 
                 B 
                 24 
                 −9.090 
                 49.806 
                 37.868 
                 1.00 
                 20.50 
                 C 
               
               
                 ATOM 
                 1066 
                 N 
                 ARG 
                 B 
                 25 
                 −7.380 
                 46.916 
                 36.739 
                 1.00 
                 16.84 
                 N 
               
               
                 ATOM 
                 1067 
                 CA 
                 ARG 
                 B 
                 25 
                 −6.028 
                 46.650 
                 36.300 
                 1.00 
                 17.59 
                 C 
               
               
                 ATOM 
                 1068 
                 C 
                 ARG 
                 B 
                 25 
                 −5.231 
                 47.898 
                 35.946 
                 1.00 
                 18.31 
                 C 
               
               
                 ATOM 
                 1069 
                 O 
                 ARG 
                 B 
                 25 
                 −5.787 
                 48.885 
                 35.476 
                 1.00 
                 17.08 
                 O 
               
               
                 ATOM 
                 1070 
                 CB 
                 ARG 
                 B 
                 25 
                 −6.094 
                 45.782 
                 35.057 
                 1.00 
                 17.34 
                 C 
               
               
                 ATOM 
                 1071 
                 CG 
                 ARG 
                 B 
                 25 
                 −6.879 
                 44.498 
                 35.348 
                 1.00 
                 17.33 
                 C 
               
               
                 ATOM 
                 1072 
                 CD 
                 ARG 
                 B 
                 25 
                 −6.852 
                 43.502 
                 34.297 
                 1.00 
                 13.60 
                 C 
               
               
                 ATOM 
                 1073 
                 NE 
                 ARG 
                 B 
                 25 
                 −5.497 
                 43.263 
                 33.810 
                 1.00 
                 13.84 
                 N 
               
               
                 ATOM 
                 1074 
                 CZ 
                 ARG 
                 B 
                 25 
                 −5.222 
                 42.392 
                 32.860 
                 1.00 
                 11.47 
                 C 
               
               
                 ATOM 
                 1075 
                 NH1 
                 ARG 
                 B 
                 25 
                 −6.199 
                 41.653 
                 32.333 
                 1.00 
                 10.08 
                 N 
               
               
                 ATOM 
                 1076 
                 NH2 
                 ARG 
                 B 
                 25 
                 −3.982 
                 42.241 
                 32.449 
                 1.00 
                 9.16 
                 N 
               
               
                 ATOM 
                 1077 
                 N 
                 ASP 
                 B 
                 26 
                 −3.915 
                 47.804 
                 36.136 
                 1.00 
                 19.61 
                 N 
               
               
                 ATOM 
                 1078 
                 CA 
                 ASP 
                 B 
                 26 
                 −2.985 
                 48.906 
                 35.901 
                 1.00 
                 21.22 
                 C 
               
               
                 ATOM 
                 1079 
                 C 
                 ASP 
                 B 
                 26 
                 −3.494 
                 50.171 
                 36.568 
                 1.00 
                 21.82 
                 C 
               
               
                 ATOM 
                 1080 
                 O 
                 ASP 
                 B 
                 26 
                 −3.598 
                 51.200 
                 35.928 
                 1.00 
                 21.62 
                 O 
               
               
                 ATOM 
                 1081 
                 CB 
                 ASP 
                 B 
                 26 
                 −2.809 
                 49.154 
                 34.403 
                 1.00 
                 21.90 
                 C 
               
               
                 ATOM 
                 1082 
                 CG 
                 ASP 
                 B 
                 26 
                 −2.338 
                 47.932 
                 33.658 
                 1.00 
                 24.84 
                 C 
               
               
                 ATOM 
                 1083 
                 OD1 
                 ASP 
                 B 
                 26 
                 −1.885 
                 46.971 
                 34.333 
                 1.00 
                 28.20 
                 O 
               
               
                 ATOM 
                 1084 
                 OD2 
                 ASP 
                 B 
                 26 
                 −2.362 
                 47.846 
                 32.398 
                 1.00 
                 27.28 
                 O 
               
               
                 ATOM 
                 1085 
                 N 
                 ALA 
                 B 
                 27 
                 −3.843 
                 50.068 
                 37.847 
                 1.00 
                 22.97 
                 N 
               
               
                 ATOM 
                 1086 
                 CA 
                 ALA 
                 B 
                 27 
                 −4.447 
                 51.166 
                 38.590 
                 1.00 
                 23.99 
                 C 
               
               
                 ATOM 
                 1087 
                 C 
                 ALA 
                 B 
                 27 
                 −3.441 
                 51.917 
                 39.438 
                 1.00 
                 24.59 
                 C 
               
               
                 ATOM 
                 1088 
                 O 
                 ALA 
                 B 
                 27 
                 −2.510 
                 51.332 
                 39.989 
                 1.00 
                 25.39 
                 O 
               
               
                 ATOM 
                 1089 
                 CB 
                 ALA 
                 B 
                 27 
                 −5.545 
                 50.662 
                 39.473 
                 1.00 
                 24.37 
                 C 
               
               
                 ATOM 
                 1090 
                 N 
                 SER 
                 B 
                 28 
                 −3.656 
                 53.223 
                 39.532 
                 1.00 
                 24.85 
                 N 
               
               
                 ATOM 
                 1091 
                 CA 
                 SER 
                 B 
                 28 
                 −2.864 
                 54.109 
                 40.385 
                 1.00 
                 25.14 
                 C 
               
               
                 ATOM 
                 1092 
                 C 
                 SER 
                 B 
                 28 
                 −3.564 
                 54.234 
                 41.736 
                 1.00 
                 25.22 
                 C 
               
               
                 ATOM 
                 1093 
                 O 
                 SER 
                 B 
                 28 
                 −2.930 
                 54.167 
                 42.789 
                 1.00 
                 25.75 
                 O 
               
               
                 ATOM 
                 1094 
                 CB 
                 SER 
                 B 
                 28 
                 −2.719 
                 55.492 
                 39.742 
                 1.00 
                 24.69 
                 C 
               
               
                 ATOM 
                 1095 
                 OG 
                 SER 
                 B 
                 28 
                 −3.158 
                 55.481 
                 38.395 
                 1.00 
                 23.71 
                 O 
               
               
                 ATOM 
                 1096 
                 N 
                 PHE 
                 B 
                 29 
                 −4.881 
                 54.398 
                 41.687 
                 1.00 
                 25.03 
                 N 
               
               
                 ATOM 
                 1097 
                 CA 
                 PHE 
                 B 
                 29 
                 −5.667 
                 54.683 
                 42.872 
                 1.00 
                 24.87 
                 C 
               
               
                 ATOM 
                 1098 
                 C 
                 PHE 
                 B 
                 29 
                 −6.194 
                 53.393 
                 43.483 
                 1.00 
                 25.13 
                 C 
               
               
                 ATOM 
                 1099 
                 O 
                 PHE 
                 B 
                 29 
                 −6.483 
                 52.430 
                 42.776 
                 1.00 
                 25.12 
                 O 
               
               
                 ATOM 
                 1100 
                 CB 
                 PHE 
                 B 
                 29 
                 −6.813 
                 55.629 
                 42.510 
                 1.00 
                 24.68 
                 C 
               
               
                 ATOM 
                 1101 
                 CG 
                 PHE 
                 B 
                 29 
                 −6.347 
                 56.966 
                 41.964 
                 1.00 
                 24.08 
                 C 
               
               
                 ATOM 
                 1102 
                 CD1 
                 PHE 
                 B 
                 29 
                 −5.477 
                 57.755 
                 42.688 
                 1.00 
                 23.02 
                 C 
               
               
                 ATOM 
                 1103 
                 CD2 
                 PHE 
                 B 
                 29 
                 −6.780 
                 57.423 
                 40.732 
                 1.00 
                 22.29 
                 C 
               
               
                 ATOM 
                 1104 
                 CE1 
                 PHE 
                 B 
                 29 
                 −5.045 
                 58.957 
                 42.188 
                 1.00 
                 22.75 
                 C 
               
               
                 ATOM 
                 1105 
                 CE2 
                 PHE 
                 B 
                 29 
                 −6.349 
                 58.641 
                 40.235 
                 1.00 
                 21.38 
                 C 
               
               
                 ATOM 
                 1106 
                 CZ 
                 PHE 
                 B 
                 29 
                 −5.492 
                 59.402 
                 40.960 
                 1.00 
                 21.68 
                 C 
               
               
                 ATOM 
                 1107 
                 N 
                 GLU 
                 B 
                 30 
                 −6.303 
                 53.397 
                 44.806 
                 1.00 
                 25.15 
                 N 
               
               
                 ATOM 
                 1108 
                 CA 
                 GLU 
                 B 
                 30 
                 −6.873 
                 52.294 
                 45.554 
                 1.00 
                 25.25 
                 C 
               
               
                 ATOM 
                 1109 
                 C 
                 GLU 
                 B 
                 30 
                 −8.365 
                 52.275 
                 45.326 
                 1.00 
                 24.28 
                 C 
               
               
                 ATOM 
                 1110 
                 O 
                 GLU 
                 B 
                 30 
                 −9.011 
                 53.315 
                 45.373 
                 1.00 
                 23.91 
                 O 
               
               
                 ATOM 
                 1111 
                 CB 
                 GLU 
                 B 
                 30 
                 −6.626 
                 52.465 
                 47.062 
                 1.00 
                 25.56 
                 C 
               
               
                 ATOM 
                 1112 
                 CG 
                 GLU 
                 B 
                 30 
                 −5.300 
                 51.916 
                 47.562 
                 1.00 
                 28.36 
                 C 
               
               
                 ATOM 
                 1113 
                 CD 
                 GLU 
                 B 
                 30 
                 −5.210 
                 51.924 
                 49.090 
                 1.00 
                 31.12 
                 C 
               
               
                 ATOM 
                 1114 
                 OE1 
                 GLU 
                 B 
                 30 
                 −4.192 
                 52.404 
                 49.626 
                 1.00 
                 33.68 
                 O 
               
               
                 ATOM 
                 1115 
                 OE2 
                 GLU 
                 B 
                 30 
                 −6.167 
                 51.464 
                 49.765 
                 1.00 
                 33.34 
                 O 
               
               
                 ATOM 
                 1116 
                 N 
                 LEU 
                 B 
                 31 
                 −8.902 
                 51.083 
                 45.105 
                 1.00 
                 23.64 
                 N 
               
               
                 ATOM 
                 1117 
                 CA 
                 LEU 
                 B 
                 31 
                 −10.335 
                 50.901 
                 44.925 
                 1.00 
                 23.41 
                 C 
               
               
                 ATOM 
                 1118 
                 C 
                 LEU 
                 B 
                 31 
                 −11.025 
                 51.255 
                 46.232 
                 1.00 
                 23.46 
                 C 
               
               
                 ATOM 
                 1119 
                 O 
                 LEU 
                 B 
                 31 
                 −10.698 
                 50.690 
                 47.260 
                 1.00 
                 22.93 
                 O 
               
               
                 ATOM 
                 1120 
                 CB 
                 LEU 
                 B 
                 31 
                 −10.628 
                 49.446 
                 44.530 
                 1.00 
                 23.08 
                 C 
               
               
                 ATOM 
                 1121 
                 CG 
                 LEU 
                 B 
                 31 
                 −12.086 
                 49.084 
                 44.216 
                 1.00 
                 22.85 
                 C 
               
               
                 ATOM 
                 1122 
                 CD1 
                 LEU 
                 B 
                 31 
                 −12.580 
                 49.784 
                 42.952 
                 1.00 
                 22.62 
                 C 
               
               
                 ATOM 
                 1123 
                 CD2 
                 LEU 
                 B 
                 31 
                 −12.209 
                 47.591 
                 44.057 
                 1.00 
                 21.60 
                 C 
               
               
                 ATOM 
                 1124 
                 N 
                 LYS 
                 B 
                 32 
                 −11.931 
                 52.229 
                 46.195 
                 1.00 
                 23.73 
                 N 
               
               
                 ATOM 
                 1125 
                 CA 
                 LYS 
                 B 
                 32 
                 −12.700 
                 52.604 
                 47.367 
                 1.00 
                 23.85 
                 C 
               
               
                 ATOM 
                 1126 
                 C 
                 LYS 
                 B 
                 32 
                 −14.096 
                 51.978 
                 47.350 
                 1.00 
                 24.25 
                 C 
               
               
                 ATOM 
                 1127 
                 O 
                 LYS 
                 B 
                 32 
                 −14.432 
                 51.229 
                 48.255 
                 1.00 
                 26.21 
                 O 
               
               
                 ATOM 
                 1128 
                 CB 
                 LYS 
                 B 
                 32 
                 −12.803 
                 54.124 
                 47.507 
                 1.00 
                 24.04 
                 C 
               
               
                 ATOM 
                 1129 
                 CG 
                 LYS 
                 B 
                 32 
                 −11.473 
                 54.841 
                 47.853 
                 1.00 
                 24.78 
                 C 
               
               
                 ATOM 
                 1130 
                 CD 
                 LYS 
                 B 
                 32 
                 −10.603 
                 54.086 
                 48.865 
                 1.00 
                 25.77 
                 C 
               
               
                 ATOM 
                 1131 
                 CE 
                 LYS 
                 B 
                 32 
                 −9.387 
                 54.910 
                 49.284 
                 1.00 
                 27.06 
                 C 
               
               
                 ATOM 
                 1132 
                 NZ 
                 LYS 
                 B 
                 32 
                 −9.419 
                 55.331 
                 50.735 
                 1.00 
                 29.57 
                 N 
               
               
                 ATOM 
                 1133 
                 N 
                 ASP 
                 B 
                 33 
                 −14.904 
                 52.294 
                 46.345 
                 1.00 
                 23.49 
                 N 
               
               
                 ATOM 
                 1134 
                 CA 
                 ASP 
                 B 
                 33 
                 −16.296 
                 51.860 
                 46.288 
                 1.00 
                 22.67 
                 C 
               
               
                 ATOM 
                 1135 
                 C 
                 ASP 
                 B 
                 33 
                 −16.550 
                 51.276 
                 44.893 
                 1.00 
                 21.88 
                 C 
               
               
                 ATOM 
                 1136 
                 O 
                 ASP 
                 B 
                 33 
                 −15.689 
                 51.354 
                 44.023 
                 1.00 
                 21.30 
                 O 
               
               
                 ATOM 
                 1137 
                 CB 
                 ASP 
                 B 
                 33 
                 −17.205 
                 53.064 
                 46.591 
                 1.00 
                 22.52 
                 C 
               
               
                 ATOM 
                 1138 
                 CG 
                 ASP 
                 B 
                 33 
                 −18.693 
                 52.694 
                 46.790 
                 1.00 
                 23.90 
                 C 
               
               
                 ATOM 
                 1139 
                 OD1 
                 ASP 
                 B 
                 33 
                 −19.082 
                 51.493 
                 46.850 
                 1.00 
                 20.86 
                 O 
               
               
                 ATOM 
                 1140 
                 OD2 
                 ASP 
                 B 
                 33 
                 −19.560 
                 53.589 
                 46.897 
                 1.00 
                 26.09 
                 O 
               
               
                 ATOM 
                 1141 
                 N 
                 THR 
                 B 
                 34 
                 −17.693 
                 50.631 
                 44.712 
                 1.00 
                 20.74 
                 N 
               
               
                 ATOM 
                 1142 
                 CA 
                 THR 
                 B 
                 34 
                 −18.077 
                 50.071 
                 43.436 
                 1.00 
                 20.55 
                 C 
               
               
                 ATOM 
                 1143 
                 C 
                 THR 
                 B 
                 34 
                 −19.533 
                 50.336 
                 43.181 
                 1.00 
                 20.18 
                 C 
               
               
                 ATOM 
                 1144 
                 O 
                 THR 
                 B 
                 34 
                 −20.303 
                 50.579 
                 44.099 
                 1.00 
                 19.74 
                 O 
               
               
                 ATOM 
                 1145 
                 CB 
                 THR 
                 B 
                 34 
                 −17.904 
                 48.557 
                 43.451 
                 1.00 
                 20.76 
                 C 
               
               
                 ATOM 
                 1146 
                 OG1 
                 THR 
                 B 
                 34 
                 −18.595 
                 48.017 
                 44.592 
                 1.00 
                 19.54 
                 O 
               
               
                 ATOM 
                 1147 
                 CG2 
                 THR 
                 B 
                 34 
                 −16.445 
                 48.157 
                 43.635 
                 1.00 
                 20.79 
                 C 
               
               
                 ATOM 
                 1148 
                 N 
                 GLY 
                 B 
                 35 
                 −19.911 
                 50.250 
                 41.914 
                 1.00 
                 19.65 
                 N 
               
               
                 ATOM 
                 1149 
                 CA 
                 GLY 
                 B 
                 35 
                 −21.296 
                 50.368 
                 41.521 
                 1.00 
                 19.23 
                 C 
               
               
                 ATOM 
                 1150 
                 C 
                 GLY 
                 B 
                 35 
                 −21.562 
                 49.486 
                 40.318 
                 1.00 
                 18.79 
                 C 
               
               
                 ATOM 
                 1151 
                 O 
                 GLY 
                 B 
                 35 
                 −20.674 
                 49.157 
                 39.555 
                 1.00 
                 18.14 
                 O 
               
               
                 ATOM 
                 1152 
                 N 
                 TRP 
                 B 
                 36 
                 −22.815 
                 49.103 
                 40.182 
                 1.00 
                 18.24 
                 N 
               
               
                 ATOM 
                 1153 
                 CA 
                 TRP 
                 B 
                 36 
                 −23.269 
                 48.213 
                 39.155 
                 1.00 
                 18.12 
                 C 
               
               
                 ATOM 
                 1154 
                 C 
                 TRP 
                 B 
                 36 
                 −24.497 
                 48.867 
                 38.514 
                 1.00 
                 18.61 
                 C 
               
               
                 ATOM 
                 1155 
                 O 
                 TRP 
                 B 
                 36 
                 −25.295 
                 49.496 
                 39.202 
                 1.00 
                 17.92 
                 O 
               
               
                 ATOM 
                 1156 
                 CB 
                 TRP 
                 B 
                 36 
                 −23.589 
                 46.867 
                 39.787 
                 1.00 
                 17.76 
                 C 
               
               
                 ATOM 
                 1157 
                 CG 
                 TRP 
                 B 
                 36 
                 −22.365 
                 46.120 
                 40.219 
                 1.00 
                 16.23 
                 C 
               
               
                 ATOM 
                 1158 
                 CD1 
                 TRP 
                 B 
                 36 
                 −21.729 
                 46.213 
                 41.421 
                 1.00 
                 15.56 
                 C 
               
               
                 ATOM 
                 1159 
                 CD2 
                 TRP 
                 B 
                 36 
                 −21.621 
                 45.167 
                 39.445 
                 1.00 
                 16.02 
                 C 
               
               
                 ATOM 
                 1160 
                 NE1 
                 TRP 
                 B 
                 36 
                 −20.642 
                 45.372 
                 41.451 
                 1.00 
                 15.36 
                 N 
               
               
                 ATOM 
                 1161 
                 CE2 
                 TRP 
                 B 
                 36 
                 −20.540 
                 44.728 
                 40.247 
                 1.00 
                 16.32 
                 C 
               
               
                 ATOM 
                 1162 
                 CE3 
                 TRP 
                 B 
                 36 
                 −21.749 
                 44.644 
                 38.148 
                 1.00 
                 15.74 
                 C 
               
               
                 ATOM 
                 1163 
                 CZ2 
                 TRP 
                 B 
                 36 
                 −19.612 
                 43.786 
                 39.808 
                 1.00 
                 14.00 
                 C 
               
               
                 ATOM 
                 1164 
                 CZ3 
                 TRP 
                 B 
                 36 
                 −20.836 
                 43.705 
                 37.711 
                 1.00 
                 15.81 
                 C 
               
               
                 ATOM 
                 1165 
                 CH2 
                 TRP 
                 B 
                 36 
                 −19.770 
                 43.290 
                 38.537 
                 1.00 
                 15.63 
                 C 
               
               
                 ATOM 
                 1166 
                 N 
                 TYR 
                 B 
                 37 
                 −24.595 
                 48.738 
                 37.190 
                 1.00 
                 19.18 
                 N 
               
               
                 ATOM 
                 1167 
                 CA 
                 TYR 
                 B 
                 37 
                 −25.576 
                 49.446 
                 36.347 
                 1.00 
                 19.61 
                 C 
               
               
                 ATOM 
                 1168 
                 C 
                 TYR 
                 B 
                 37 
                 −26.075 
                 48.525 
                 35.243 
                 1.00 
                 19.35 
                 C 
               
               
                 ATOM 
                 1169 
                 O 
                 TYR 
                 B 
                 37 
                 −25.336 
                 47.676 
                 34.777 
                 1.00 
                 18.84 
                 O 
               
               
                 ATOM 
                 1170 
                 CB 
                 TYR 
                 B 
                 37 
                 −24.921 
                 50.647 
                 35.653 
                 1.00 
                 19.72 
                 C 
               
               
                 ATOM 
                 1171 
                 CG 
                 TYR 
                 B 
                 37 
                 −24.347 
                 51.638 
                 36.617 
                 1.00 
                 21.51 
                 C 
               
               
                 ATOM 
                 1172 
                 CD1 
                 TYR 
                 B 
                 37 
                 −25.145 
                 52.640 
                 37.160 
                 1.00 
                 24.75 
                 C 
               
               
                 ATOM 
                 1173 
                 CD2 
                 TYR 
                 B 
                 37 
                 −23.021 
                 51.554 
                 37.023 
                 1.00 
                 22.63 
                 C 
               
               
                 ATOM 
                 1174 
                 CE1 
                 TYR 
                 B 
                 37 
                 −24.633 
                 53.547 
                 38.079 
                 1.00 
                 25.58 
                 C 
               
               
                 ATOM 
                 1175 
                 CE2 
                 TYR 
                 B 
                 37 
                 −22.503 
                 52.444 
                 37.945 
                 1.00 
                 24.41 
                 C 
               
               
                 ATOM 
                 1176 
                 CZ 
                 TYR 
                 B 
                 37 
                 −23.312 
                 53.443 
                 38.460 
                 1.00 
                 26.84 
                 C 
               
               
                 ATOM 
                 1177 
                 OH 
                 TYR 
                 B 
                 37 
                 −22.810 
                 54.333 
                 39.372 
                 1.00 
                 30.18 
                 O 
               
               
                 ATOM 
                 1178 
                 N 
                 ARG 
                 B 
                 38 
                 −27.312 
                 48.713 
                 34.802 
                 1.00 
                 19.09 
                 N 
               
               
                 ATOM 
                 1179 
                 CA 
                 ARG 
                 B 
                 38 
                 −27.809 
                 47.989 
                 33.639 
                 1.00 
                 19.55 
                 C 
               
               
                 ATOM 
                 1180 
                 C 
                 ARG 
                 B 
                 38 
                 −28.798 
                 48.765 
                 32.791 
                 1.00 
                 18.49 
                 C 
               
               
                 ATOM 
                 1181 
                 O 
                 ARG 
                 B 
                 38 
                 −29.565 
                 49.591 
                 33.287 
                 1.00 
                 18.38 
                 O 
               
               
                 ATOM 
                 1182 
                 CB 
                 ARG 
                 B 
                 38 
                 −28.469 
                 46.674 
                 34.044 
                 1.00 
                 19.81 
                 C 
               
               
                 ATOM 
                 1183 
                 CG 
                 ARG 
                 B 
                 38 
                 −29.525 
                 46.843 
                 35.070 
                 1.00 
                 22.46 
                 C 
               
               
                 ATOM 
                 1184 
                 CD 
                 ARG 
                 B 
                 38 
                 −30.798 
                 46.162 
                 34.774 
                 1.00 
                 25.60 
                 C 
               
               
                 ATOM 
                 1185 
                 NE 
                 ARG 
                 B 
                 38 
                 −30.898 
                 44.895 
                 35.479 
                 1.00 
                 27.28 
                 N 
               
               
                 ATOM 
                 1186 
                 CZ 
                 ARG 
                 B 
                 38 
                 −32.035 
                 44.353 
                 35.887 
                 1.00 
                 27.55 
                 C 
               
               
                 ATOM 
                 1187 
                 NH1 
                 ARG 
                 B 
                 38 
                 −33.193 
                 44.976 
                 35.690 
                 1.00 
                 29.81 
                 N 
               
               
                 ATOM 
                 1188 
                 NH2 
                 ARG 
                 B 
                 38 
                 −32.016 
                 43.184 
                 36.506 
                 1.00 
                 26.89 
                 N 
               
               
                 ATOM 
                 1189 
                 N 
                 THR 
                 B 
                 39 
                 −28.749 
                 48.467 
                 31.501 
                 1.00 
                 17.65 
                 N 
               
               
                 ATOM 
                 1190 
                 CA 
                 THR 
                 B 
                 39 
                 −29.814 
                 48.769 
                 30.572 
                 1.00 
                 17.38 
                 C 
               
               
                 ATOM 
                 1191 
                 C 
                 THR 
                 B 
                 39 
                 −30.609 
                 47.483 
                 30.339 
                 1.00 
                 16.90 
                 C 
               
               
                 ATOM 
                 1192 
                 O 
                 THR 
                 B 
                 39 
                 −30.148 
                 46.579 
                 29.661 
                 1.00 
                 16.35 
                 O 
               
               
                 ATOM 
                 1193 
                 CB 
                 THR 
                 B 
                 39 
                 −29.211 
                 49.268 
                 29.255 
                 1.00 
                 17.27 
                 C 
               
               
                 ATOM 
                 1194 
                 OG1 
                 THR 
                 B 
                 39 
                 −28.274 
                 50.310 
                 29.534 
                 1.00 
                 17.58 
                 O 
               
               
                 ATOM 
                 1195 
                 CG2 
                 THR 
                 B 
                 39 
                 −30.287 
                 49.925 
                 28.355 
                 1.00 
                 17.17 
                 C 
               
               
                 ATOM 
                 1196 
                 N 
                 LYS 
                 B 
                 40 
                 −31.803 
                 47.394 
                 30.906 
                 1.00 
                 16.71 
                 N 
               
               
                 ATOM 
                 1197 
                 CA 
                 LYS 
                 B 
                 40 
                 −32.592 
                 46.182 
                 30.757 
                 1.00 
                 16.42 
                 C 
               
               
                 ATOM 
                 1198 
                 C 
                 LYS 
                 B 
                 40 
                 −33.348 
                 46.177 
                 29.428 
                 1.00 
                 16.17 
                 C 
               
               
                 ATOM 
                 1199 
                 O 
                 LYS 
                 B 
                 40 
                 −33.530 
                 47.215 
                 28.787 
                 1.00 
                 15.22 
                 O 
               
               
                 ATOM 
                 1200 
                 CB 
                 LYS 
                 B 
                 40 
                 −33.525 
                 45.964 
                 31.949 
                 1.00 
                 16.51 
                 C 
               
               
                 ATOM 
                 1201 
                 CG 
                 LYS 
                 B 
                 40 
                 −34.574 
                 47.016 
                 32.136 
                 1.00 
                 18.21 
                 C 
               
               
                 ATOM 
                 1202 
                 CD 
                 LYS 
                 B 
                 40 
                 −35.245 
                 46.898 
                 33.506 
                 1.00 
                 19.27 
                 C 
               
               
                 ATOM 
                 1203 
                 CE 
                 LYS 
                 B 
                 40 
                 −36.626 
                 47.526 
                 33.477 
                 1.00 
                 20.69 
                 C 
               
               
                 ATOM 
                 1204 
                 NZ 
                 LYS 
                 B 
                 40 
                 −37.393 
                 47.282 
                 34.746 
                 1.00 
                 22.98 
                 N 
               
               
                 ATOM 
                 1205 
                 N 
                 LEU 
                 B 
                 41 
                 −33.754 
                 44.978 
                 29.023 
                 1.00 
                 16.05 
                 N 
               
               
                 ATOM 
                 1206 
                 CA 
                 LEU 
                 B 
                 41 
                 −34.419 
                 44.741 
                 27.754 
                 1.00 
                 16.04 
                 C 
               
               
                 ATOM 
                 1207 
                 C 
                 LEU 
                 B 
                 41 
                 −35.694 
                 45.576 
                 27.639 
                 1.00 
                 16.59 
                 C 
               
               
                 ATOM 
                 1208 
                 O 
                 LEU 
                 B 
                 41 
                 −36.414 
                 45.783 
                 28.619 
                 1.00 
                 16.92 
                 O 
               
               
                 ATOM 
                 1209 
                 CB 
                 LEU 
                 B 
                 41 
                 −34.746 
                 43.248 
                 27.628 
                 1.00 
                 15.95 
                 C 
               
               
                 ATOM 
                 1210 
                 CG 
                 LEU 
                 B 
                 41 
                 −35.555 
                 42.752 
                 26.427 
                 1.00 
                 16.05 
                 C 
               
               
                 ATOM 
                 1211 
                 CD1 
                 LEU 
                 B 
                 41 
                 −34.641 
                 42.434 
                 25.239 
                 1.00 
                 15.75 
                 C 
               
               
                 ATOM 
                 1212 
                 CD2 
                 LEU 
                 B 
                 41 
                 −36.408 
                 41.535 
                 26.800 
                 1.00 
                 15.80 
                 C 
               
               
                 ATOM 
                 1213 
                 N 
                 GLY 
                 B 
                 42 
                 −35.967 
                 46.055 
                 26.430 
                 1.00 
                 16.75 
                 N 
               
               
                 ATOM 
                 1214 
                 CA 
                 GLY 
                 B 
                 42 
                 −37.081 
                 46.951 
                 26.185 
                 1.00 
                 16.88 
                 C 
               
               
                 ATOM 
                 1215 
                 C 
                 GLY 
                 B 
                 42 
                 −36.866 
                 48.376 
                 26.664 
                 1.00 
                 17.13 
                 C 
               
               
                 ATOM 
                 1216 
                 O 
                 GLY 
                 B 
                 42 
                 −37.767 
                 49.201 
                 26.530 
                 1.00 
                 17.20 
                 O 
               
               
                 ATOM 
                 1217 
                 N 
                 SER 
                 B 
                 43 
                 −35.685 
                 48.681 
                 27.192 
                 1.00 
                 17.18 
                 N 
               
               
                 ATOM 
                 1218 
                 CA 
                 SER 
                 B 
                 43 
                 −35.417 
                 50.000 
                 27.745 
                 1.00 
                 17.77 
                 C 
               
               
                 ATOM 
                 1219 
                 C 
                 SER 
                 B 
                 43 
                 −34.087 
                 50.586 
                 27.256 
                 1.00 
                 18.27 
                 C 
               
               
                 ATOM 
                 1220 
                 O 
                 SER 
                 B 
                 43 
                 −33.140 
                 49.870 
                 26.945 
                 1.00 
                 17.60 
                 O 
               
               
                 ATOM 
                 1221 
                 CB 
                 SER 
                 B 
                 43 
                 −35.466 
                 49.951 
                 29.284 
                 1.00 
                 17.81 
                 C 
               
               
                 ATOM 
                 1222 
                 OG 
                 SER 
                 B 
                 43 
                 −34.746 
                 51.026 
                 29.864 
                 1.00 
                 18.04 
                 O 
               
               
                 ATOM 
                 1223 
                 N 
                 THR 
                 B 
                 44 
                 −34.042 
                 51.910 
                 27.217 
                 1.00 
                 19.66 
                 N 
               
               
                 ATOM 
                 1224 
                 CA 
                 THR 
                 B 
                 44 
                 −32.907 
                 52.670 
                 26.711 
                 1.00 
                 21.11 
                 C 
               
               
                 ATOM 
                 1225 
                 C 
                 THR 
                 B 
                 44 
                 −32.100 
                 53.352 
                 27.846 
                 1.00 
                 21.91 
                 C 
               
               
                 ATOM 
                 1226 
                 O 
                 THR 
                 B 
                 44 
                 −31.000 
                 53.871 
                 27.624 
                 1.00 
                 22.34 
                 O 
               
               
                 ATOM 
                 1227 
                 CB 
                 THR 
                 B 
                 44 
                 −33.454 
                 53.681 
                 25.660 
                 1.00 
                 21.50 
                 C 
               
               
                 ATOM 
                 1228 
                 OG1 
                 THR 
                 B 
                 44 
                 −32.669 
                 53.614 
                 24.459 
                 1.00 
                 23.73 
                 O 
               
               
                 ATOM 
                 1229 
                 CG2 
                 THR 
                 B 
                 44 
                 −33.377 
                 55.141 
                 26.129 
                 1.00 
                 21.82 
                 C 
               
               
                 ATOM 
                 1230 
                 N 
                 ASN 
                 B 
                 45 
                 −32.628 
                 53.319 
                 29.066 
                 1.00 
                 22.83 
                 N 
               
               
                 ATOM 
                 1231 
                 CA 
                 ASN 
                 B 
                 45 
                 −32.014 
                 54.024 
                 30.205 
                 1.00 
                 23.46 
                 C 
               
               
                 ATOM 
                 1232 
                 C 
                 ASN 
                 B 
                 45 
                 −31.136 
                 53.131 
                 31.066 
                 1.00 
                 23.26 
                 C 
               
               
                 ATOM 
                 1233 
                 O 
                 ASN 
                 B 
                 45 
                 −31.591 
                 52.099 
                 31.558 
                 1.00 
                 23.12 
                 O 
               
               
                 ATOM 
                 1234 
                 CB 
                 ASN 
                 B 
                 45 
                 −33.106 
                 54.667 
                 31.077 
                 1.00 
                 23.67 
                 C 
               
               
                 ATOM 
                 1235 
                 CG 
                 ASN 
                 B 
                 45 
                 −33.466 
                 56.067 
                 30.609 
                 1.00 
                 25.41 
                 C 
               
               
                 ATOM 
                 1236 
                 OD1 
                 ASN 
                 B 
                 45 
                 −34.592 
                 56.322 
                 30.178 
                 1.00 
                 26.74 
                 O 
               
               
                 ATOM 
                 1237 
                 ND2 
                 ASN 
                 B 
                 45 
                 −32.498 
                 56.987 
                 30.688 
                 1.00 
                 27.93 
                 N 
               
               
                 ATOM 
                 1238 
                 N 
                 GLU 
                 B 
                 46 
                 −29.881 
                 53.532 
                 31.252 
                 1.00 
                 23.42 
                 N 
               
               
                 ATOM 
                 1239 
                 CA 
                 GLU 
                 B 
                 46 
                 −28.997 
                 52.825 
                 32.171 
                 1.00 
                 23.74 
                 C 
               
               
                 ATOM 
                 1240 
                 C 
                 GLU 
                 B 
                 46 
                 −29.372 
                 53.162 
                 33.610 
                 1.00 
                 23.50 
                 C 
               
               
                 ATOM 
                 1241 
                 O 
                 GLU 
                 B 
                 46 
                 −29.600 
                 54.324 
                 33.967 
                 1.00 
                 23.84 
                 O 
               
               
                 ATOM 
                 1242 
                 CB 
                 GLU 
                 B 
                 46 
                 −27.509 
                 53.116 
                 31.908 
                 1.00 
                 24.34 
                 C 
               
               
                 ATOM 
                 1243 
                 CG 
                 GLU 
                 B 
                 46 
                 −26.610 
                 52.000 
                 32.432 
                 1.00 
                 25.93 
                 C 
               
               
                 ATOM 
                 1244 
                 CD 
                 GLU 
                 B 
                 46 
                 −25.140 
                 52.365 
                 32.520 
                 1.00 
                 28.62 
                 C 
               
               
                 ATOM 
                 1245 
                 OE1 
                 GLU 
                 B 
                 46 
                 −24.813 
                 53.403 
                 33.137 
                 1.00 
                 32.72 
                 O 
               
               
                 ATOM 
                 1246 
                 OE2 
                 GLU 
                 B 
                 46 
                 −24.306 
                 51.589 
                 32.008 
                 1.00 
                 28.07 
                 O 
               
               
                 ATOM 
                 1247 
                 N 
                 GLN 
                 B 
                 47 
                 −29.421 
                 52.125 
                 34.431 
                 1.00 
                 23.10 
                 N 
               
               
                 ATOM 
                 1248 
                 CA 
                 GLN 
                 B 
                 47 
                 −30.050 
                 52.178 
                 35.744 
                 1.00 
                 22.80 
                 C 
               
               
                 ATOM 
                 1249 
                 C 
                 GLN 
                 B 
                 47 
                 −29.087 
                 51.583 
                 36.767 
                 1.00 
                 22.28 
                 C 
               
               
                 ATOM 
                 1250 
                 O 
                 GLN 
                 B 
                 47 
                 −28.519 
                 50.516 
                 36.546 
                 1.00 
                 21.53 
                 O 
               
               
                 ATOM 
                 1251 
                 CB 
                 GLN 
                 B 
                 47 
                 −31.325 
                 51.328 
                 35.716 
                 1.00 
                 23.05 
                 C 
               
               
                 ATOM 
                 1252 
                 CG 
                 GLN 
                 B 
                 47 
                 −32.607 
                 52.035 
                 36.047 
                 1.00 
                 25.12 
                 C 
               
               
                 ATOM 
                 1253 
                 CD 
                 GLN 
                 B 
                 47 
                 −33.784 
                 51.074 
                 36.091 
                 1.00 
                 27.20 
                 C 
               
               
                 ATOM 
                 1254 
                 OE1 
                 GLN 
                 B 
                 47 
                 −33.945 
                 50.234 
                 35.192 
                 1.00 
                 28.88 
                 O 
               
               
                 ATOM 
                 1255 
                 NE2 
                 GLN 
                 B 
                 47 
                 −34.602 
                 51.184 
                 37.135 
                 1.00 
                 27.84 
                 N 
               
               
                 ATOM 
                 1256 
                 N 
                 SER 
                 B 
                 48 
                 −28.922 
                 52.265 
                 37.890 
                 1.00 
                 21.60 
                 N 
               
               
                 ATOM 
                 1257 
                 CA 
                 SER 
                 B 
                 48 
                 −28.186 
                 51.721 
                 39.010 
                 1.00 
                 21.63 
                 C 
               
               
                 ATOM 
                 1258 
                 C 
                 SER 
                 B 
                 48 
                 −28.843 
                 50.437 
                 39.546 
                 1.00 
                 21.29 
                 C 
               
               
                 ATOM 
                 1259 
                 O 
                 SER 
                 B 
                 48 
                 −30.048 
                 50.361 
                 39.660 
                 1.00 
                 20.52 
                 O 
               
               
                 ATOM 
                 1260 
                 CB 
                 SER 
                 B 
                 48 
                 −28.131 
                 52.766 
                 40.124 
                 1.00 
                 22.04 
                 C 
               
               
                 ATOM 
                 1261 
                 OG 
                 SER 
                 B 
                 48 
                 −27.498 
                 52.228 
                 41.261 
                 1.00 
                 23.32 
                 O 
               
               
                 ATOM 
                 1262 
                 N 
                 ILE 
                 B 
                 49 
                 −28.031 
                 49.440 
                 39.875 
                 1.00 
                 21.21 
                 N 
               
               
                 ATOM 
                 1263 
                 CA 
                 ILE 
                 B 
                 49 
                 −28.505 
                 48.225 
                 40.529 
                 1.00 
                 21.20 
                 C 
               
               
                 ATOM 
                 1264 
                 C 
                 ILE 
                 B 
                 49 
                 −28.340 
                 48.370 
                 42.049 
                 1.00 
                 21.46 
                 C 
               
               
                 ATOM 
                 1265 
                 O 
                 ILE 
                 B 
                 49 
                 −27.271 
                 48.725 
                 42.553 
                 1.00 
                 21.11 
                 O 
               
               
                 ATOM 
                 1266 
                 CB 
                 ILE 
                 B 
                 49 
                 −27.713 
                 46.980 
                 40.005 
                 1.00 
                 21.53 
                 C 
               
               
                 ATOM 
                 1267 
                 CG1 
                 ILE 
                 B 
                 49 
                 −27.996 
                 46.756 
                 38.511 
                 1.00 
                 20.53 
                 C 
               
               
                 ATOM 
                 1268 
                 CG2 
                 ILE 
                 B 
                 49 
                 −28.080 
                 45.740 
                 40.843 
                 1.00 
                 21.49 
                 C 
               
               
                 ATOM 
                 1269 
                 CD1 
                 ILE 
                 B 
                 49 
                 −27.027 
                 45.830 
                 37.797 
                 1.00 
                 22.53 
                 C 
               
               
                 ATOM 
                 1270 
                 N 
                 SER 
                 B 
                 50 
                 −29.409 
                 48.078 
                 42.774 
                 1.00 
                 22.04 
                 N 
               
               
                 ATOM 
                 1271 
                 CA 
                 SER 
                 B 
                 50 
                 −29.406 
                 48.084 
                 44.233 
                 1.00 
                 22.35 
                 C 
               
               
                 ATOM 
                 1272 
                 C 
                 SER 
                 B 
                 50 
                 −28.888 
                 46.745 
                 44.755 
                 1.00 
                 22.25 
                 C 
               
               
                 ATOM 
                 1273 
                 O 
                 SER 
                 B 
                 50 
                 −29.509 
                 45.708 
                 44.539 
                 1.00 
                 22.62 
                 O 
               
               
                 ATOM 
                 1274 
                 CB 
                 SER 
                 B 
                 50 
                 −30.823 
                 48.335 
                 44.765 
                 1.00 
                 22.21 
                 C 
               
               
                 ATOM 
                 1275 
                 OG 
                 SER 
                 B 
                 50 
                 −30.800 
                 49.354 
                 45.746 
                 1.00 
                 23.43 
                 O 
               
               
                 ATOM 
                 1276 
                 N 
                 ILE 
                 B 
                 51 
                 −27.744 
                 46.771 
                 45.428 
                 1.00 
                 22.47 
                 N 
               
               
                 ATOM 
                 1277 
                 CA 
                 ILE 
                 B 
                 51 
                 −27.136 
                 45.539 
                 45.918 
                 1.00 
                 22.78 
                 C 
               
               
                 ATOM 
                 1278 
                 C 
                 ILE 
                 B 
                 51 
                 −27.933 
                 45.009 
                 47.098 
                 1.00 
                 22.80 
                 C 
               
               
                 ATOM 
                 1279 
                 O 
                 ILE 
                 B 
                 51 
                 −28.062 
                 45.677 
                 48.127 
                 1.00 
                 22.88 
                 O 
               
               
                 ATOM 
                 1280 
                 CB 
                 ILE 
                 B 
                 51 
                 −25.635 
                 45.742 
                 46.289 
                 1.00 
                 22.82 
                 C 
               
               
                 ATOM 
                 1281 
                 CG1 
                 ILE 
                 B 
                 51 
                 −24.833 
                 46.198 
                 45.059 
                 1.00 
                 22.79 
                 C 
               
               
                 ATOM 
                 1282 
                 CG2 
                 ILE 
                 B 
                 51 
                 −25.041 
                 44.451 
                 46.872 
                 1.00 
                 22.51 
                 C 
               
               
                 ATOM 
                 1283 
                 CD1 
                 ILE 
                 B 
                 51 
                 −25.034 
                 45.335 
                 43.799 
                 1.00 
                 23.44 
                 C 
               
               
                 ATOM 
                 1284 
                 N 
                 GLY 
                 B 
                 52 
                 −28.470 
                 43.808 
                 46.922 
                 1.00 
                 23.07 
                 N 
               
               
                 ATOM 
                 1285 
                 CA 
                 GLY 
                 B 
                 52 
                 −29.354 
                 43.185 
                 47.899 
                 1.00 
                 23.46 
                 C 
               
               
                 ATOM 
                 1286 
                 C 
                 GLY 
                 B 
                 52 
                 −30.214 
                 42.108 
                 47.244 
                 1.00 
                 23.47 
                 C 
               
               
                 ATOM 
                 1287 
                 O 
                 GLY 
                 B 
                 52 
                 −30.438 
                 42.136 
                 46.027 
                 1.00 
                 23.12 
                 O 
               
               
                 ATOM 
                 1288 
                 N 
                 GLY 
                 B 
                 53 
                 −30.673 
                 41.149 
                 48.043 
                 1.00 
                 23.65 
                 N 
               
               
                 ATOM 
                 1289 
                 CA 
                 GLY 
                 B 
                 53 
                 −31.579 
                 40.111 
                 47.571 
                 1.00 
                 24.06 
                 C 
               
               
                 ATOM 
                 1290 
                 C 
                 GLY 
                 B 
                 53 
                 −30.945 
                 39.186 
                 46.542 
                 1.00 
                 24.34 
                 C 
               
               
                 ATOM 
                 1291 
                 O 
                 GLY 
                 B 
                 53 
                 −29.968 
                 38.492 
                 46.838 
                 1.00 
                 24.13 
                 O 
               
               
                 ATOM 
                 1292 
                 N 
                 ARG 
                 B 
                 54 
                 −31.513 
                 39.178 
                 45.334 
                 1.00 
                 24.75 
                 N 
               
               
                 ATOM 
                 1293 
                 CA 
                 ARG 
                 B 
                 54 
                 −31.014 
                 38.374 
                 44.210 
                 1.00 
                 24.67 
                 C 
               
               
                 ATOM 
                 1294 
                 C 
                 ARG 
                 B 
                 54 
                 −29.618 
                 38.827 
                 43.735 
                 1.00 
                 23.81 
                 C 
               
               
                 ATOM 
                 1295 
                 O 
                 ARG 
                 B 
                 54 
                 −28.868 
                 38.043 
                 43.158 
                 1.00 
                 23.10 
                 O 
               
               
                 ATOM 
                 1296 
                 CB 
                 ARG 
                 B 
                 54 
                 −32.004 
                 38.433 
                 43.027 
                 1.00 
                 24.89 
                 C 
               
               
                 ATOM 
                 1297 
                 CG 
                 ARG 
                 B 
                 54 
                 −33.349 
                 37.771 
                 43.297 
                 1.00 
                 27.65 
                 C 
               
               
                 ATOM 
                 1298 
                 CD 
                 ARG 
                 B 
                 54 
                 −34.212 
                 37.530 
                 42.032 
                 1.00 
                 30.21 
                 C 
               
               
                 ATOM 
                 1299 
                 NE 
                 ARG 
                 B 
                 54 
                 −34.407 
                 38.753 
                 41.234 
                 1.00 
                 31.75 
                 N 
               
               
                 ATOM 
                 1300 
                 CZ 
                 ARG 
                 B 
                 54 
                 −33.979 
                 38.962 
                 39.977 
                 1.00 
                 32.55 
                 C 
               
               
                 ATOM 
                 1301 
                 NH1 
                 ARG 
                 B 
                 54 
                 −33.278 
                 38.042 
                 39.305 
                 1.00 
                 33.03 
                 N 
               
               
                 ATOM 
                 1302 
                 NH2 
                 ARG 
                 B 
                 54 
                 −34.248 
                 40.126 
                 39.390 
                 1.00 
                 31.95 
                 N 
               
               
                 ATOM 
                 1303 
                 N 
                 TYR 
                 B 
                 55 
                 −29.293 
                 40.089 
                 43.991 
                 1.00 
                 23.32 
                 N 
               
               
                 ATOM 
                 1304 
                 CA 
                 TYR 
                 B 
                 55 
                 −28.022 
                 40.699 
                 43.607 
                 1.00 
                 23.27 
                 C 
               
               
                 ATOM 
                 1305 
                 C 
                 TYR 
                 B 
                 55 
                 −26.985 
                 40.714 
                 44.741 
                 1.00 
                 22.65 
                 C 
               
               
                 ATOM 
                 1306 
                 O 
                 TYR 
                 B 
                 55 
                 −27.022 
                 41.627 
                 45.569 
                 1.00 
                 23.40 
                 O 
               
               
                 ATOM 
                 1307 
                 CB 
                 TYR 
                 B 
                 55 
                 −28.280 
                 42.156 
                 43.200 
                 1.00 
                 23.51 
                 C 
               
               
                 ATOM 
                 1308 
                 CG 
                 TYR 
                 B 
                 55 
                 −29.332 
                 42.366 
                 42.128 
                 1.00 
                 25.16 
                 C 
               
               
                 ATOM 
                 1309 
                 CD1 
                 TYR 
                 B 
                 55 
                 −30.554 
                 42.974 
                 42.433 
                 1.00 
                 27.40 
                 C 
               
               
                 ATOM 
                 1310 
                 CD2 
                 TYR 
                 B 
                 55 
                 −29.098 
                 41.990 
                 40.809 
                 1.00 
                 25.31 
                 C 
               
               
                 ATOM 
                 1311 
                 CE1 
                 TYR 
                 B 
                 55 
                 −31.526 
                 43.176 
                 41.448 
                 1.00 
                 28.63 
                 C 
               
               
                 ATOM 
                 1312 
                 CE2 
                 TYR 
                 B 
                 55 
                 −30.052 
                 42.193 
                 39.814 
                 1.00 
                 27.21 
                 C 
               
               
                 ATOM 
                 1313 
                 CZ 
                 TYR 
                 B 
                 55 
                 −31.262 
                 42.784 
                 40.136 
                 1.00 
                 29.16 
                 C 
               
               
                 ATOM 
                 1314 
                 OH 
                 TYR 
                 B 
                 55 
                 −32.216 
                 42.985 
                 39.165 
                 1.00 
                 30.31 
                 O 
               
               
                 ATOM 
                 1315 
                 N 
                 VAL 
                 B 
                 56 
                 −26.068 
                 39.741 
                 44.814 
                 1.00 
                 21.32 
                 N 
               
               
                 ATOM 
                 1316 
                 CA 
                 VAL 
                 B 
                 56 
                 −25.013 
                 39.817 
                 45.831 
                 1.00 
                 20.28 
                 C 
               
               
                 ATOM 
                 1317 
                 C 
                 VAL 
                 B 
                 56 
                 −23.637 
                 40.141 
                 45.224 
                 1.00 
                 19.36 
                 C 
               
               
                 ATOM 
                 1318 
                 O 
                 VAL 
                 B 
                 56 
                 −23.141 
                 39.458 
                 44.307 
                 1.00 
                 18.27 
                 O 
               
               
                 ATOM 
                 1319 
                 CB 
                 VAL 
                 B 
                 56 
                 −24.976 
                 38.592 
                 46.817 
                 1.00 
                 20.58 
                 C 
               
               
                 ATOM 
                 1320 
                 CG1 
                 VAL 
                 B 
                 56 
                 −26.399 
                 38.065 
                 47.118 
                 1.00 
                 20.96 
                 C 
               
               
                 ATOM 
                 1321 
                 CG2 
                 VAL 
                 B 
                 56 
                 −24.080 
                 37.497 
                 46.328 
                 1.00 
                 21.01 
                 C 
               
               
                 ATOM 
                 1322 
                 N 
                 GLU 
                 B 
                 57 
                 −23.075 
                 41.249 
                 45.707 
                 1.00 
                 18.11 
                 N 
               
               
                 ATOM 
                 1323 
                 CA 
                 GLU 
                 B 
                 57 
                 −21.745 
                 41.689 
                 45.348 
                 1.00 
                 17.19 
                 C 
               
               
                 ATOM 
                 1324 
                 C 
                 GLU 
                 B 
                 57 
                 −20.708 
                 41.168 
                 46.343 
                 1.00 
                 16.51 
                 C 
               
               
                 ATOM 
                 1325 
                 O 
                 GLU 
                 B 
                 57 
                 −20.935 
                 41.148 
                 47.548 
                 1.00 
                 17.87 
                 O 
               
               
                 ATOM 
                 1326 
                 CB 
                 GLU 
                 B 
                 57 
                 −21.689 
                 43.211 
                 45.299 
                 1.00 
                 17.51 
                 C 
               
               
                 ATOM 
                 1327 
                 CG 
                 GLU 
                 B 
                 57 
                 −20.379 
                 43.725 
                 44.737 
                 1.00 
                 16.73 
                 C 
               
               
                 ATOM 
                 1328 
                 CD 
                 GLU 
                 B 
                 57 
                 −20.183 
                 45.223 
                 44.875 
                 1.00 
                 17.23 
                 C 
               
               
                 ATOM 
                 1329 
                 OE1 
                 GLU 
                 B 
                 57 
                 −20.587 
                 45.808 
                 45.907 
                 1.00 
                 18.09 
                 O 
               
               
                 ATOM 
                 1330 
                 OE2 
                 GLU 
                 B 
                 57 
                 −19.597 
                 45.818 
                 43.938 
                 1.00 
                 13.96 
                 O 
               
               
                 ATOM 
                 1331 
                 N 
                 THR 
                 B 
                 58 
                 −19.571 
                 40.742 
                 45.826 
                 1.00 
                 15.66 
                 N 
               
               
                 ATOM 
                 1332 
                 CA 
                 THR 
                 B 
                 58 
                 −18.425 
                 40.374 
                 46.630 
                 1.00 
                 15.37 
                 C 
               
               
                 ATOM 
                 1333 
                 C 
                 THR 
                 B 
                 58 
                 −17.281 
                 41.269 
                 46.156 
                 1.00 
                 15.05 
                 C 
               
               
                 ATOM 
                 1334 
                 O 
                 THR 
                 B 
                 58 
                 −16.978 
                 41.276 
                 44.986 
                 1.00 
                 14.93 
                 O 
               
               
                 ATOM 
                 1335 
                 CB 
                 THR 
                 B 
                 58 
                 −18.058 
                 38.900 
                 46.381 
                 1.00 
                 15.38 
                 C 
               
               
                 ATOM 
                 1336 
                 OG1 
                 THR 
                 B 
                 58 
                 −19.184 
                 38.058 
                 46.659 
                 1.00 
                 14.54 
                 O 
               
               
                 ATOM 
                 1337 
                 CG2 
                 THR 
                 B 
                 58 
                 −16.981 
                 38.447 
                 47.346 
                 1.00 
                 16.33 
                 C 
               
               
                 ATOM 
                 1338 
                 N 
                 VAL 
                 B 
                 59 
                 −16.665 
                 42.012 
                 47.064 
                 1.00 
                 14.77 
                 N 
               
               
                 ATOM 
                 1339 
                 CA 
                 VAL 
                 B 
                 59 
                 −15.529 
                 42.862 
                 46.748 
                 1.00 
                 15.29 
                 C 
               
               
                 ATOM 
                 1340 
                 C 
                 VAL 
                 B 
                 59 
                 −14.298 
                 42.387 
                 47.510 
                 1.00 
                 15.36 
                 C 
               
               
                 ATOM 
                 1341 
                 O 
                 VAL 
                 B 
                 59 
                 −14.342 
                 42.194 
                 48.728 
                 1.00 
                 14.34 
                 O 
               
               
                 ATOM 
                 1342 
                 CB 
                 VAL 
                 B 
                 59 
                 −15.814 
                 44.337 
                 47.101 
                 1.00 
                 14.87 
                 C 
               
               
                 ATOM 
                 1343 
                 CG1 
                 VAL 
                 B 
                 59 
                 −14.650 
                 45.211 
                 46.733 
                 1.00 
                 15.38 
                 C 
               
               
                 ATOM 
                 1344 
                 CG2 
                 VAL 
                 B 
                 59 
                 −17.081 
                 44.826 
                 46.388 
                 1.00 
                 16.71 
                 C 
               
               
                 ATOM 
                 1345 
                 N 
                 ASN 
                 B 
                 60 
                 −13.209 
                 42.205 
                 46.767 
                 1.00 
                 16.17 
                 N 
               
               
                 ATOM 
                 1346 
                 CA 
                 ASN 
                 B 
                 60 
                 −11.895 
                 41.886 
                 47.303 
                 1.00 
                 17.20 
                 C 
               
               
                 ATOM 
                 1347 
                 C 
                 ASN 
                 B 
                 60 
                 −10.940 
                 43.002 
                 46.931 
                 1.00 
                 17.56 
                 C 
               
               
                 ATOM 
                 1348 
                 O 
                 ASN 
                 B 
                 60 
                 −10.420 
                 43.048 
                 45.813 
                 1.00 
                 16.19 
                 O 
               
               
                 ATOM 
                 1349 
                 CB 
                 ASN 
                 B 
                 60 
                 −11.397 
                 40.536 
                 46.770 
                 1.00 
                 17.33 
                 C 
               
               
                 ATOM 
                 1350 
                 CG 
                 ASN 
                 B 
                 60 
                 −12.368 
                 39.418 
                 47.033 
                 1.00 
                 20.49 
                 C 
               
               
                 ATOM 
                 1351 
                 OD1 
                 ASN 
                 B 
                 60 
                 −12.978 
                 38.869 
                 46.103 
                 1.00 
                 27.00 
                 O 
               
               
                 ATOM 
                 1352 
                 ND2 
                 ASN 
                 B 
                 60 
                 −12.538 
                 39.068 
                 48.309 
                 1.00 
                 24.14 
                 N 
               
               
                 ATOM 
                 1353 
                 N 
                 LYS 
                 B 
                 61 
                 −10.725 
                 43.930 
                 47.860 
                 1.00 
                 18.73 
                 N 
               
               
                 ATOM 
                 1354 
                 CA 
                 LYS 
                 B 
                 61 
                 −9.984 
                 45.152 
                 47.523 
                 1.00 
                 20.20 
                 C 
               
               
                 ATOM 
                 1355 
                 C 
                 LYS 
                 B 
                 61 
                 −8.524 
                 44.868 
                 47.247 
                 1.00 
                 20.68 
                 C 
               
               
                 ATOM 
                 1356 
                 O 
                 LYS 
                 B 
                 61 
                 −7.929 
                 45.496 
                 46.389 
                 1.00 
                 20.73 
                 O 
               
               
                 ATOM 
                 1357 
                 CB 
                 LYS 
                 B 
                 61 
                 −10.056 
                 46.190 
                 48.628 
                 1.00 
                 20.55 
                 C 
               
               
                 ATOM 
                 1358 
                 CG 
                 LYS 
                 B 
                 61 
                 −11.155 
                 47.169 
                 48.436 
                 1.00 
                 22.89 
                 C 
               
               
                 ATOM 
                 1359 
                 CD 
                 LYS 
                 B 
                 61 
                 −11.078 
                 48.286 
                 49.467 
                 1.00 
                 26.16 
                 C 
               
               
                 ATOM 
                 1360 
                 CE 
                 LYS 
                 B 
                 61 
                 −12.306 
                 49.166 
                 49.399 
                 1.00 
                 27.62 
                 C 
               
               
                 ATOM 
                 1361 
                 NZ 
                 LYS 
                 B 
                 61 
                 −13.300 
                 48.623 
                 48.388 
                 1.00 
                 29.13 
                 N 
               
               
                 ATOM 
                 1362 
                 N 
                 GLY 
                 B 
                 62 
                 −7.961 
                 43.930 
                 47.994 
                 1.00 
                 21.46 
                 N 
               
               
                 ATOM 
                 1363 
                 CA 
                 GLY 
                 B 
                 62 
                 −6.559 
                 43.575 
                 47.852 
                 1.00 
                 22.44 
                 C 
               
               
                 ATOM 
                 1364 
                 C 
                 GLY 
                 B 
                 62 
                 −6.243 
                 43.175 
                 46.423 
                 1.00 
                 22.90 
                 C 
               
               
                 ATOM 
                 1365 
                 O 
                 GLY 
                 B 
                 62 
                 −5.297 
                 43.708 
                 45.842 
                 1.00 
                 24.02 
                 O 
               
               
                 ATOM 
                 1366 
                 N 
                 SER 
                 B 
                 63 
                 −7.067 
                 42.279 
                 45.874 
                 1.00 
                 22.81 
                 N 
               
               
                 ATOM 
                 1367 
                 CA 
                 SER 
                 B 
                 63 
                 −6.944 
                 41.770 
                 44.511 
                 1.00 
                 23.15 
                 C 
               
               
                 ATOM 
                 1368 
                 C 
                 SER 
                 B 
                 63 
                 −7.628 
                 42.667 
                 43.487 
                 1.00 
                 23.09 
                 C 
               
               
                 ATOM 
                 1369 
                 O 
                 SER 
                 B 
                 63 
                 −7.706 
                 42.330 
                 42.312 
                 1.00 
                 23.32 
                 O 
               
               
                 ATOM 
                 1370 
                 CB 
                 SER 
                 B 
                 63 
                 −7.550 
                 40.373 
                 44.429 
                 1.00 
                 23.09 
                 C 
               
               
                 ATOM 
                 1371 
                 OG 
                 SER 
                 B 
                 63 
                 −8.972 
                 40.441 
                 44.436 
                 1.00 
                 23.15 
                 O 
               
               
                 ATOM 
                 1372 
                 N 
                 LYS 
                 B 
                 64 
                 −8.154 
                 43.793 
                 43.960 
                 1.00 
                 22.85 
                 N 
               
               
                 ATOM 
                 1373 
                 CA 
                 LYS 
                 B 
                 64 
                 −8.785 
                 44.801 
                 43.138 
                 1.00 
                 22.19 
                 C 
               
               
                 ATOM 
                 1374 
                 C 
                 LYS 
                 B 
                 64 
                 −9.942 
                 44.238 
                 42.309 
                 1.00 
                 21.21 
                 C 
               
               
                 ATOM 
                 1375 
                 O 
                 LYS 
                 B 
                 64 
                 −10.214 
                 44.712 
                 41.204 
                 1.00 
                 19.51 
                 O 
               
               
                 ATOM 
                 1376 
                 CB 
                 LYS 
                 B 
                 64 
                 −7.737 
                 45.482 
                 42.255 
                 1.00 
                 23.45 
                 C 
               
               
                 ATOM 
                 1377 
                 CG 
                 LYS 
                 B 
                 64 
                 −6.574 
                 46.121 
                 43.043 
                 1.00 
                 25.37 
                 C 
               
               
                 ATOM 
                 1378 
                 CD 
                 LYS 
                 B 
                 64 
                 −6.368 
                 47.592 
                 42.640 
                 1.00 
                 28.91 
                 C 
               
               
                 ATOM 
                 1379 
                 CE 
                 LYS 
                 B 
                 64 
                 −4.962 
                 48.125 
                 42.973 
                 1.00 
                 30.56 
                 C 
               
               
                 ATOM 
                 1380 
                 NZ 
                 LYS 
                 B 
                 64 
                 −4.919 
                 49.645 
                 42.954 
                 1.00 
                 31.78 
                 N 
               
               
                 ATOM 
                 1381 
                 N 
                 SER 
                 B 
                 65 
                 −10.630 
                 43.234 
                 42.850 
                 1.00 
                 19.74 
                 N 
               
               
                 ATOM 
                 1382 
                 CA 
                 SER 
                 B 
                 65 
                 −11.720 
                 42.615 
                 42.118 
                 1.00 
                 19.85 
                 C 
               
               
                 ATOM 
                 1383 
                 C 
                 SER 
                 B 
                 65 
                 −13.073 
                 42.732 
                 42.831 
                 1.00 
                 18.80 
                 C 
               
               
                 ATOM 
                 1384 
                 O 
                 SER 
                 B 
                 65 
                 −13.165 
                 42.809 
                 44.057 
                 1.00 
                 17.00 
                 O 
               
               
                 ATOM 
                 1385 
                 CB 
                 SER 
                 B 
                 65 
                 −11.398 
                 41.177 
                 41.757 
                 1.00 
                 20.53 
                 C 
               
               
                 ATOM 
                 1386 
                 OG 
                 SER 
                 B 
                 65 
                 −10.882 
                 40.462 
                 42.843 
                 1.00 
                 23.59 
                 O 
               
               
                 ATOM 
                 1387 
                 N 
                 PHE 
                 B 
                 66 
                 −14.104 
                 42.817 
                 42.010 
                 1.00 
                 18.42 
                 N 
               
               
                 ATOM 
                 1388 
                 CA 
                 PHE 
                 B 
                 66 
                 −15.463 
                 42.953 
                 42.454 
                 1.00 
                 19.37 
                 C 
               
               
                 ATOM 
                 1389 
                 C 
                 PHE 
                 B 
                 66 
                 −16.404 
                 42.203 
                 41.511 
                 1.00 
                 19.75 
                 C 
               
               
                 ATOM 
                 1390 
                 O 
                 PHE 
                 B 
                 66 
                 −16.303 
                 42.317 
                 40.285 
                 1.00 
                 20.89 
                 O 
               
               
                 ATOM 
                 1391 
                 CB 
                 PHE 
                 B 
                 66 
                 −15.867 
                 44.435 
                 42.664 
                 1.00 
                 19.52 
                 C 
               
               
                 ATOM 
                 1392 
                 CG 
                 PHE 
                 B 
                 66 
                 −15.477 
                 45.392 
                 41.550 
                 1.00 
                 19.35 
                 C 
               
               
                 ATOM 
                 1393 
                 CD1 
                 PHE 
                 B 
                 66 
                 −14.162 
                 45.594 
                 41.201 
                 1.00 
                 19.89 
                 C 
               
               
                 ATOM 
                 1394 
                 CD2 
                 PHE 
                 B 
                 66 
                 −16.447 
                 46.173 
                 40.942 
                 1.00 
                 22.22 
                 C 
               
               
                 ATOM 
                 1395 
                 CE1 
                 PHE 
                 B 
                 66 
                 −13.817 
                 46.489 
                 40.211 
                 1.00 
                 23.28 
                 C 
               
               
                 ATOM 
                 1396 
                 CE2 
                 PHE 
                 B 
                 66 
                 −16.121 
                 47.079 
                 39.942 
                 1.00 
                 22.06 
                 C 
               
               
                 ATOM 
                 1397 
                 CZ 
                 PHE 
                 B 
                 66 
                 −14.804 
                 47.239 
                 39.577 
                 1.00 
                 24.56 
                 C 
               
               
                 ATOM 
                 1398 
                 N 
                 SER 
                 B 
                 67 
                 −17.301 
                 41.407 
                 42.089 
                 1.00 
                 19.90 
                 N 
               
               
                 ATOM 
                 1399 
                 CA 
                 SER 
                 B 
                 67 
                 −18.226 
                 40.596 
                 41.307 
                 1.00 
                 20.00 
                 C 
               
               
                 ATOM 
                 1400 
                 C 
                 SER 
                 B 
                 67 
                 −19.671 
                 40.698 
                 41.776 
                 1.00 
                 19.50 
                 C 
               
               
                 ATOM 
                 1401 
                 O 
                 SER 
                 B 
                 67 
                 −19.951 
                 41.023 
                 42.915 
                 1.00 
                 19.54 
                 O 
               
               
                 ATOM 
                 1402 
                 CB 
                 SER 
                 B 
                 67 
                 −17.786 
                 39.139 
                 41.278 
                 1.00 
                 19.89 
                 C 
               
               
                 ATOM 
                 1403 
                 OG 
                 SER 
                 B 
                 67 
                 −17.691 
                 38.597 
                 42.569 
                 1.00 
                 23.57 
                 O 
               
               
                 ATOM 
                 1404 
                 N 
                 LEU 
                 B 
                 68 
                 −20.580 
                 40.428 
                 40.848 
                 1.00 
                 18.79 
                 N 
               
               
                 ATOM 
                 1405 
                 CA 
                 LEU 
                 B 
                 68 
                 −21.998 
                 40.461 
                 41.082 
                 1.00 
                 18.33 
                 C 
               
               
                 ATOM 
                 1406 
                 C 
                 LEU 
                 B 
                 68 
                 −22.553 
                 39.108 
                 40.665 
                 1.00 
                 18.42 
                 C 
               
               
                 ATOM 
                 1407 
                 O 
                 LEU 
                 B 
                 68 
                 −22.380 
                 38.712 
                 39.524 
                 1.00 
                 18.10 
                 O 
               
               
                 ATOM 
                 1408 
                 CB 
                 LEU 
                 B 
                 68 
                 −22.615 
                 41.528 
                 40.194 
                 1.00 
                 18.09 
                 C 
               
               
                 ATOM 
                 1409 
                 CG 
                 LEU 
                 B 
                 68 
                 −23.841 
                 42.366 
                 40.571 
                 1.00 
                 18.46 
                 C 
               
               
                 ATOM 
                 1410 
                 CD1 
                 LEU 
                 B 
                 68 
                 −24.726 
                 42.505 
                 39.396 
                 1.00 
                 18.36 
                 C 
               
               
                 ATOM 
                 1411 
                 CD2 
                 LEU 
                 B 
                 68 
                 −24.609 
                 41.922 
                 41.814 
                 1.00 
                 17.75 
                 C 
               
               
                 ATOM 
                 1412 
                 N 
                 ARG 
                 B 
                 69 
                 −23.194 
                 38.406 
                 41.587 
                 1.00 
                 18.74 
                 N 
               
               
                 ATOM 
                 1413 
                 CA 
                 ARG 
                 B 
                 69 
                 −23.923 
                 37.179 
                 41.278 
                 1.00 
                 19.25 
                 C 
               
               
                 ATOM 
                 1414 
                 C 
                 ARG 
                 B 
                 69 
                 −25.429 
                 37.453 
                 41.352 
                 1.00 
                 19.35 
                 C 
               
               
                 ATOM 
                 1415 
                 O 
                 ARG 
                 B 
                 69 
                 −25.948 
                 37.865 
                 42.402 
                 1.00 
                 18.55 
                 O 
               
               
                 ATOM 
                 1416 
                 CB 
                 ARG 
                 B 
                 69 
                 −23.547 
                 36.057 
                 42.238 
                 1.00 
                 19.56 
                 C 
               
               
                 ATOM 
                 1417 
                 CG 
                 ARG 
                 B 
                 69 
                 −24.193 
                 34.712 
                 41.888 
                 1.00 
                 21.15 
                 C 
               
               
                 ATOM 
                 1418 
                 CD 
                 ARG 
                 B 
                 69 
                 −23.508 
                 33.525 
                 42.544 
                 1.00 
                 23.00 
                 C 
               
               
                 ATOM 
                 1419 
                 NE 
                 ARG 
                 B 
                 69 
                 −23.997 
                 32.225 
                 42.077 
                 1.00 
                 23.21 
                 N 
               
               
                 ATOM 
                 1420 
                 CZ 
                 ARG 
                 B 
                 69 
                 −24.973 
                 31.514 
                 42.651 
                 1.00 
                 26.91 
                 C 
               
               
                 ATOM 
                 1421 
                 NH1 
                 ARG 
                 B 
                 69 
                 −25.607 
                 31.945 
                 43.746 
                 1.00 
                 27.11 
                 N 
               
               
                 ATOM 
                 1422 
                 NH2 
                 ARG 
                 B 
                 69 
                 −25.322 
                 30.340 
                 42.124 
                 1.00 
                 27.81 
                 N 
               
               
                 ATOM 
                 1423 
                 N 
                 ILE 
                 B 
                 70 
                 −26.108 
                 37.270 
                 40.222 
                 1.00 
                 19.75 
                 N 
               
               
                 ATOM 
                 1424 
                 CA 
                 ILE 
                 B 
                 70 
                 −27.553 
                 37.452 
                 40.117 
                 1.00 
                 20.46 
                 C 
               
               
                 ATOM 
                 1425 
                 C 
                 ILE 
                 B 
                 70 
                 −28.187 
                 36.081 
                 40.074 
                 1.00 
                 20.76 
                 C 
               
               
                 ATOM 
                 1426 
                 O 
                 ILE 
                 B 
                 70 
                 −27.852 
                 35.304 
                 39.201 
                 1.00 
                 19.79 
                 O 
               
               
                 ATOM 
                 1427 
                 CB 
                 ILE 
                 B 
                 70 
                 −27.914 
                 38.220 
                 38.829 
                 1.00 
                 20.68 
                 C 
               
               
                 ATOM 
                 1428 
                 CG1 
                 ILE 
                 B 
                 70 
                 −27.058 
                 39.472 
                 38.680 
                 1.00 
                 21.64 
                 C 
               
               
                 ATOM 
                 1429 
                 CG2 
                 ILE 
                 B 
                 70 
                 −29.385 
                 38.622 
                 38.815 
                 1.00 
                 20.79 
                 C 
               
               
                 ATOM 
                 1430 
                 CD1 
                 ILE 
                 B 
                 70 
                 −27.131 
                 40.061 
                 37.288 
                 1.00 
                 23.84 
                 C 
               
               
                 ATOM 
                 1431 
                 N 
                 SER 
                 B 
                 71 
                 −29.106 
                 35.794 
                 41.013 
                 1.00 
                 21.41 
                 N 
               
               
                 ATOM 
                 1432 
                 CA 
                 SER 
                 B 
                 71 
                 −29.778 
                 34.489 
                 41.114 
                 1.00 
                 22.13 
                 C 
               
               
                 ATOM 
                 1433 
                 C 
                 SER 
                 B 
                 71 
                 −31.295 
                 34.535 
                 40.702 
                 1.00 
                 22.62 
                 C 
               
               
                 ATOM 
                 1434 
                 O 
                 SER 
                 B 
                 71 
                 −31.913 
                 35.609 
                 40.661 
                 1.00 
                 22.56 
                 O 
               
               
                 ATOM 
                 1435 
                 CB 
                 SER 
                 B 
                 71 
                 −29.633 
                 33.953 
                 42.548 
                 1.00 
                 22.67 
                 C 
               
               
                 ATOM 
                 1436 
                 OG 
                 SER 
                 B 
                 71 
                 −30.156 
                 34.874 
                 43.500 
                 1.00 
                 22.85 
                 O 
               
               
                 ATOM 
                 1437 
                 N 
                 ASP 
                 B 
                 72 
                 −31.867 
                 33.370 
                 40.373 
                 1.00 
                 23.13 
                 N 
               
               
                 ATOM 
                 1438 
                 CA 
                 ASP 
                 B 
                 72 
                 −33.302 
                 33.248 
                 39.942 
                 1.00 
                 23.77 
                 C 
               
               
                 ATOM 
                 1439 
                 C 
                 ASP 
                 B 
                 72 
                 −33.660 
                 34.144 
                 38.730 
                 1.00 
                 23.69 
                 C 
               
               
                 ATOM 
                 1440 
                 O 
                 ASP 
                 B 
                 72 
                 −34.691 
                 34.924 
                 38.744 
                 1.00 
                 24.26 
                 O 
               
               
                 ATOM 
                 1441 
                 CB 
                 ASP 
                 B 
                 72 
                 −34.234 
                 33.567 
                 41.120 
                 1.00 
                 23.85 
                 C 
               
               
                 ATOM 
                 1442 
                 CG 
                 ASP 
                 B 
                 72 
                 −35.733 
                 33.299 
                 40.809 
                 1.00 
                 26.52 
                 C 
               
               
                 ATOM 
                 1443 
                 OD1 
                 ASP 
                 B 
                 72 
                 −36.086 
                 32.403 
                 39.975 
                 1.00 
                 28.52 
                 O 
               
               
                 ATOM 
                 1444 
                 OD2 
                 ASP 
                 B 
                 72 
                 −36.650 
                 33.939 
                 41.381 
                 1.00 
                 27.73 
                 O 
               
               
                 ATOM 
                 1445 
                 N 
                 LEU 
                 B 
                 73 
                 −32.763 
                 34.051 
                 37.704 
                 1.00 
                 23.03 
                 N 
               
               
                 ATOM 
                 1446 
                 CA 
                 LEU 
                 B 
                 73 
                 −32.827 
                 34.936 
                 36.552 
                 1.00 
                 22.50 
                 C 
               
               
                 ATOM 
                 1447 
                 C 
                 LEU 
                 B 
                 73 
                 −34.185 
                 34.813 
                 35.870 
                 1.00 
                 22.48 
                 C 
               
               
                 ATOM 
                 1448 
                 O 
                 LEU 
                 B 
                 73 
                 −34.819 
                 33.754 
                 35.886 
                 1.00 
                 22.20 
                 O 
               
               
                 ATOM 
                 1449 
                 CB 
                 LEU 
                 B 
                 73 
                 −31.678 
                 34.664 
                 35.562 
                 1.00 
                 22.31 
                 C 
               
               
                 ATOM 
                 1450 
                 CG 
                 LEU 
                 B 
                 73 
                 −30.259 
                 35.096 
                 35.998 
                 1.00 
                 20.96 
                 C 
               
               
                 ATOM 
                 1451 
                 CD1 
                 LEU 
                 B 
                 73 
                 −29.192 
                 34.406 
                 35.158 
                 1.00 
                 21.05 
                 C 
               
               
                 ATOM 
                 1452 
                 CD2 
                 LEU 
                 B 
                 73 
                 −30.062 
                 36.598 
                 35.937 
                 1.00 
                 20.29 
                 C 
               
               
                 ATOM 
                 1453 
                 N 
                 ARG 
                 B 
                 74 
                 −34.630 
                 35.917 
                 35.285 
                 1.00 
                 22.48 
                 N 
               
               
                 ATOM 
                 1454 
                 CA 
                 ARG 
                 B 
                 74 
                 −35.889 
                 35.960 
                 34.554 
                 1.00 
                 22.53 
                 C 
               
               
                 ATOM 
                 1455 
                 C 
                 ARG 
                 B 
                 74 
                 −35.647 
                 36.673 
                 33.230 
                 1.00 
                 21.88 
                 C 
               
               
                 ATOM 
                 1456 
                 O 
                 ARG 
                 B 
                 74 
                 −34.612 
                 37.320 
                 33.046 
                 1.00 
                 20.92 
                 O 
               
               
                 ATOM 
                 1457 
                 CB 
                 ARG 
                 B 
                 74 
                 −36.939 
                 36.677 
                 35.391 
                 1.00 
                 23.31 
                 C 
               
               
                 ATOM 
                 1458 
                 CG 
                 ARG 
                 B 
                 74 
                 −36.941 
                 36.233 
                 36.866 
                 1.00 
                 26.36 
                 C 
               
               
                 ATOM 
                 1459 
                 CD 
                 ARG 
                 B 
                 74 
                 −38.018 
                 36.857 
                 37.719 
                 1.00 
                 30.47 
                 C 
               
               
                 ATOM 
                 1460 
                 NE 
                 ARG 
                 B 
                 74 
                 −37.625 
                 38.189 
                 38.197 
                 1.00 
                 33.76 
                 N 
               
               
                 ATOM 
                 1461 
                 CZ 
                 ARG 
                 B 
                 74 
                 −38.058 
                 39.348 
                 37.687 
                 1.00 
                 35.80 
                 C 
               
               
                 ATOM 
                 1462 
                 NH1 
                 ARG 
                 B 
                 74 
                 −37.633 
                 40.495 
                 38.218 
                 1.00 
                 36.67 
                 N 
               
               
                 ATOM 
                 1463 
                 NH2 
                 ARG 
                 B 
                 74 
                 −38.905 
                 39.378 
                 36.654 
                 1.00 
                 35.80 
                 N 
               
               
                 ATOM 
                 1464 
                 N 
                 VAL 
                 B 
                 75 
                 −36.584 
                 36.542 
                 32.298 
                 1.00 
                 21.12 
                 N 
               
               
                 ATOM 
                 1465 
                 CA 
                 VAL 
                 B 
                 75 
                 −36.404 
                 37.117 
                 30.966 
                 1.00 
                 20.73 
                 C 
               
               
                 ATOM 
                 1466 
                 C 
                 VAL 
                 B 
                 75 
                 −36.158 
                 38.627 
                 31.034 
                 1.00 
                 20.51 
                 C 
               
               
                 ATOM 
                 1467 
                 O 
                 VAL 
                 B 
                 75 
                 −35.397 
                 39.177 
                 30.221 
                 1.00 
                 19.93 
                 O 
               
               
                 ATOM 
                 1468 
                 CB 
                 VAL 
                 B 
                 75 
                 −37.606 
                 36.808 
                 30.050 
                 1.00 
                 20.73 
                 C 
               
               
                 ATOM 
                 1469 
                 CG1 
                 VAL 
                 B 
                 75 
                 −37.525 
                 37.604 
                 28.740 
                 1.00 
                 20.89 
                 C 
               
               
                 ATOM 
                 1470 
                 CG2 
                 VAL 
                 B 
                 75 
                 −37.661 
                 35.314 
                 29.753 
                 1.00 
                 20.79 
                 C 
               
               
                 ATOM 
                 1471 
                 N 
                 GLU 
                 B 
                 76 
                 −36.781 
                 39.270 
                 32.024 
                 1.00 
                 20.02 
                 N 
               
               
                 ATOM 
                 1472 
                 CA 
                 GLU 
                 B 
                 76 
                 −36.723 
                 40.717 
                 32.209 
                 1.00 
                 20.19 
                 C 
               
               
                 ATOM 
                 1473 
                 C 
                 GLU 
                 B 
                 76 
                 −35.321 
                 41.208 
                 32.623 
                 1.00 
                 19.74 
                 C 
               
               
                 ATOM 
                 1474 
                 O 
                 GLU 
                 B 
                 76 
                 −35.004 
                 42.382 
                 32.440 
                 1.00 
                 20.00 
                 O 
               
               
                 ATOM 
                 1475 
                 CB 
                 GLU 
                 B 
                 76 
                 −37.790 
                 41.154 
                 33.244 
                 1.00 
                 20.38 
                 C 
               
               
                 ATOM 
                 1476 
                 CG 
                 GLU 
                 B 
                 76 
                 −37.555 
                 42.511 
                 33.904 
                 1.00 
                 22.07 
                 C 
               
               
                 ATOM 
                 1477 
                 CD 
                 GLU 
                 B 
                 76 
                 −38.751 
                 43.040 
                 34.673 
                 1.00 
                 24.50 
                 C 
               
               
                 ATOM 
                 1478 
                 OE1 
                 GLU 
                 B 
                 76 
                 −38.901 
                 42.686 
                 35.863 
                 1.00 
                 26.47 
                 O 
               
               
                 ATOM 
                 1479 
                 OE2 
                 GLU 
                 B 
                 76 
                 −39.544 
                 43.817 
                 34.087 
                 1.00 
                 26.87 
                 O 
               
               
                 ATOM 
                 1480 
                 N 
                 ASP 
                 B 
                 77 
                 −34.504 
                 40.314 
                 33.185 
                 1.00 
                 19.27 
                 N 
               
               
                 ATOM 
                 1481 
                 CA 
                 ASP 
                 B 
                 77 
                 −33.105 
                 40.609 
                 33.542 
                 1.00 
                 18.84 
                 C 
               
               
                 ATOM 
                 1482 
                 C 
                 ASP 
                 B 
                 77 
                 −32.144 
                 40.679 
                 32.358 
                 1.00 
                 18.39 
                 C 
               
               
                 ATOM 
                 1483 
                 O 
                 ASP 
                 B 
                 77 
                 −30.973 
                 41.095 
                 32.520 
                 1.00 
                 18.03 
                 O 
               
               
                 ATOM 
                 1484 
                 CB 
                 ASP 
                 B 
                 77 
                 −32.572 
                 39.564 
                 34.531 
                 1.00 
                 19.00 
                 C 
               
               
                 ATOM 
                 1485 
                 CG 
                 ASP 
                 B 
                 77 
                 −33.338 
                 39.553 
                 35.836 
                 1.00 
                 19.95 
                 C 
               
               
                 ATOM 
                 1486 
                 OD1 
                 ASP 
                 B 
                 77 
                 −33.747 
                 40.645 
                 36.287 
                 1.00 
                 20.99 
                 O 
               
               
                 ATOM 
                 1487 
                 OD2 
                 ASP 
                 B 
                 77 
                 −33.586 
                 38.504 
                 36.470 
                 1.00 
                 20.23 
                 O 
               
               
                 ATOM 
                 1488 
                 N 
                 SER 
                 B 
                 78 
                 −32.603 
                 40.255 
                 31.183 
                 1.00 
                 17.22 
                 N 
               
               
                 ATOM 
                 1489 
                 CA 
                 SER 
                 B 
                 78 
                 −31.825 
                 40.445 
                 29.973 
                 1.00 
                 17.27 
                 C 
               
               
                 ATOM 
                 1490 
                 C 
                 SER 
                 B 
                 78 
                 −31.410 
                 41.909 
                 29.880 
                 1.00 
                 16.95 
                 C 
               
               
                 ATOM 
                 1491 
                 O 
                 SER 
                 B 
                 78 
                 −32.182 
                 42.808 
                 30.218 
                 1.00 
                 17.21 
                 O 
               
               
                 ATOM 
                 1492 
                 CB 
                 SER 
                 B 
                 78 
                 −32.623 
                 40.060 
                 28.714 
                 1.00 
                 17.26 
                 C 
               
               
                 ATOM 
                 1493 
                 OG 
                 SER 
                 B 
                 78 
                 −33.040 
                 38.701 
                 28.749 
                 1.00 
                 17.63 
                 O 
               
               
                 ATOM 
                 1494 
                 N 
                 GLY 
                 B 
                 79 
                 −30.195 
                 42.147 
                 29.405 
                 1.00 
                 16.58 
                 N 
               
               
                 ATOM 
                 1495 
                 CA 
                 GLY 
                 B 
                 79 
                 −29.696 
                 43.501 
                 29.261 
                 1.00 
                 16.32 
                 C 
               
               
                 ATOM 
                 1496 
                 C 
                 GLY 
                 B 
                 79 
                 −28.197 
                 43.570 
                 29.333 
                 1.00 
                 15.94 
                 C 
               
               
                 ATOM 
                 1497 
                 O 
                 GLY 
                 B 
                 79 
                 −27.520 
                 42.550 
                 29.407 
                 1.00 
                 15.54 
                 O 
               
               
                 ATOM 
                 1498 
                 N 
                 THR 
                 B 
                 80 
                 −27.679 
                 44.788 
                 29.314 
                 1.00 
                 15.66 
                 N 
               
               
                 ATOM 
                 1499 
                 CA 
                 THR 
                 B 
                 80 
                 −26.253 
                 45.004 
                 29.385 
                 1.00 
                 15.73 
                 C 
               
               
                 ATOM 
                 1500 
                 C 
                 THR 
                 B 
                 80 
                 −25.903 
                 45.522 
                 30.770 
                 1.00 
                 15.82 
                 C 
               
               
                 ATOM 
                 1501 
                 O 
                 THR 
                 B 
                 80 
                 −26.410 
                 46.558 
                 31.193 
                 1.00 
                 16.07 
                 O 
               
               
                 ATOM 
                 1502 
                 CB 
                 THR 
                 B 
                 80 
                 −25.830 
                 45.984 
                 28.287 
                 1.00 
                 15.80 
                 C 
               
               
                 ATOM 
                 1503 
                 OG1 
                 THR 
                 B 
                 80 
                 −26.002 
                 45.369 
                 27.000 
                 1.00 
                 15.74 
                 O 
               
               
                 ATOM 
                 1504 
                 CG2 
                 THR 
                 B 
                 80 
                 −24.334 
                 46.296 
                 28.374 
                 1.00 
                 15.85 
                 C 
               
               
                 ATOM 
                 1505 
                 N 
                 TYR 
                 B 
                 81 
                 −25.045 
                 44.774 
                 31.461 
                 1.00 
                 15.97 
                 N 
               
               
                 ATOM 
                 1506 
                 CA 
                 TYR 
                 B 
                 81 
                 −24.585 
                 45.082 
                 32.807 
                 1.00 
                 16.35 
                 C 
               
               
                 ATOM 
                 1507 
                 C 
                 TYR 
                 B 
                 81 
                 −23.181 
                 45.663 
                 32.775 
                 1.00 
                 16.12 
                 C 
               
               
                 ATOM 
                 1508 
                 O 
                 TYR 
                 B 
                 81 
                 −22.326 
                 45.216 
                 31.999 
                 1.00 
                 16.10 
                 O 
               
               
                 ATOM 
                 1509 
                 CB 
                 TYR 
                 B 
                 81 
                 −24.590 
                 43.808 
                 33.669 
                 1.00 
                 16.87 
                 C 
               
               
                 ATOM 
                 1510 
                 CG 
                 TYR 
                 B 
                 81 
                 −25.986 
                 43.276 
                 33.931 
                 1.00 
                 17.11 
                 C 
               
               
                 ATOM 
                 1511 
                 CD1 
                 TYR 
                 B 
                 81 
                 −26.565 
                 43.384 
                 35.186 
                 1.00 
                 16.85 
                 C 
               
               
                 ATOM 
                 1512 
                 CD2 
                 TYR 
                 B 
                 81 
                 −26.739 
                 42.686 
                 32.916 
                 1.00 
                 16.44 
                 C 
               
               
                 ATOM 
                 1513 
                 CE1 
                 TYR 
                 B 
                 81 
                 −27.856 
                 42.911 
                 35.443 
                 1.00 
                 15.57 
                 C 
               
               
                 ATOM 
                 1514 
                 CE2 
                 TYR 
                 B 
                 81 
                 −28.051 
                 42.219 
                 33.163 
                 1.00 
                 15.21 
                 C 
               
               
                 ATOM 
                 1515 
                 CZ 
                 TYR 
                 B 
                 81 
                 −28.596 
                 42.326 
                 34.431 
                 1.00 
                 14.59 
                 C 
               
               
                 ATOM 
                 1516 
                 OH 
                 TYR 
                 B 
                 81 
                 −29.886 
                 41.875 
                 34.722 
                 1.00 
                 12.32 
                 O 
               
               
                 ATOM 
                 1517 
                 N 
                 LYS 
                 B 
                 82 
                 −22.943 
                 46.662 
                 33.611 
                 1.00 
                 16.11 
                 N 
               
               
                 ATOM 
                 1518 
                 CA 
                 LYS 
                 B 
                 82 
                 −21.618 
                 47.268 
                 33.736 
                 1.00 
                 16.55 
                 C 
               
               
                 ATOM 
                 1519 
                 C 
                 LYS 
                 B 
                 82 
                 −21.290 
                 47.528 
                 35.202 
                 1.00 
                 16.62 
                 C 
               
               
                 ATOM 
                 1520 
                 O 
                 LYS 
                 B 
                 82 
                 −22.154 
                 47.904 
                 35.987 
                 1.00 
                 17.10 
                 O 
               
               
                 ATOM 
                 1521 
                 CB 
                 LYS 
                 B 
                 82 
                 −21.543 
                 48.567 
                 32.938 
                 1.00 
                 16.71 
                 C 
               
               
                 ATOM 
                 1522 
                 CG 
                 LYS 
                 B 
                 82 
                 −21.334 
                 48.337 
                 31.463 
                 1.00 
                 17.46 
                 C 
               
               
                 ATOM 
                 1523 
                 CD 
                 LYS 
                 B 
                 82 
                 −21.201 
                 49.623 
                 30.709 
                 1.00 
                 18.30 
                 C 
               
               
                 ATOM 
                 1524 
                 CE 
                 LYS 
                 B 
                 82 
                 −21.401 
                 49.380 
                 29.236 
                 1.00 
                 19.09 
                 C 
               
               
                 ATOM 
                 1525 
                 NZ 
                 LYS 
                 B 
                 82 
                 −21.113 
                 50.617 
                 28.492 
                 1.00 
                 21.44 
                 N 
               
               
                 ATOM 
                 1526 
                 N 
                 CYS 
                 B 
                 83 
                 −20.036 
                 47.301 
                 35.550 
                 1.00 
                 16.49 
                 N 
               
               
                 ATOM 
                 1527 
                 CA 
                 CYS 
                 B 
                 83 
                 −19.504 
                 47.644 
                 36.852 
                 1.00 
                 17.38 
                 C 
               
               
                 ATOM 
                 1528 
                 C 
                 CYS 
                 B 
                 83 
                 −18.682 
                 48.929 
                 36.761 
                 1.00 
                 17.36 
                 C 
               
               
                 ATOM 
                 1529 
                 O 
                 CYS 
                 B 
                 83 
                 −18.203 
                 49.275 
                 35.699 
                 1.00 
                 18.22 
                 O 
               
               
                 ATOM 
                 1530 
                 CB 
                 CYS 
                 B 
                 83 
                 −18.606 
                 46.514 
                 37.328 
                 1.00 
                 18.04 
                 C 
               
               
                 ATOM 
                 1531 
                 SG 
                 CYS 
                 B 
                 83 
                 −17.223 
                 46.143 
                 36.230 
                 1.00 
                 19.55 
                 S 
               
               
                 ATOM 
                 1532 
                 N 
                 GLN 
                 B 
                 84 
                 −18.522 
                 49.647 
                 37.862 
                 1.00 
                 17.20 
                 N 
               
               
                 ATOM 
                 1533 
                 CA 
                 GLN 
                 B 
                 84 
                 −17.693 
                 50.849 
                 37.870 
                 1.00 
                 17.02 
                 C 
               
               
                 ATOM 
                 1534 
                 C 
                 GLN 
                 B 
                 84 
                 −16.913 
                 50.936 
                 39.156 
                 1.00 
                 16.97 
                 C 
               
               
                 ATOM 
                 1535 
                 O 
                 GLN 
                 B 
                 84 
                 −17.444 
                 50.623 
                 40.223 
                 1.00 
                 16.56 
                 O 
               
               
                 ATOM 
                 1536 
                 CB 
                 GLN 
                 B 
                 84 
                 −18.525 
                 52.109 
                 37.748 
                 1.00 
                 17.35 
                 C 
               
               
                 ATOM 
                 1537 
                 CG 
                 GLN 
                 B 
                 84 
                 −17.666 
                 53.383 
                 37.630 
                 1.00 
                 18.26 
                 C 
               
               
                 ATOM 
                 1538 
                 CD 
                 GLN 
                 B 
                 84 
                 −18.275 
                 54.425 
                 36.724 
                 1.00 
                 20.08 
                 C 
               
               
                 ATOM 
                 1539 
                 OE1 
                 GLN 
                 B 
                 84 
                 −17.572 
                 55.069 
                 35.941 
                 1.00 
                 23.24 
                 O 
               
               
                 ATOM 
                 1540 
                 NE2 
                 GLN 
                 B 
                 84 
                 −19.570 
                 54.603 
                 36.828 
                 1.00 
                 18.52 
                 N 
               
               
                 ATOM 
                 1541 
                 N 
                 ALA 
                 B 
                 85 
                 −15.653 
                 51.358 
                 39.031 
                 1.00 
                 16.63 
                 N 
               
               
                 ATOM 
                 1542 
                 CA 
                 ALA 
                 B 
                 85 
                 −14.775 
                 51.612 
                 40.166 
                 1.00 
                 16.67 
                 C 
               
               
                 ATOM 
                 1543 
                 C 
                 ALA 
                 B 
                 85 
                 −14.937 
                 53.058 
                 40.599 
                 1.00 
                 16.25 
                 C 
               
               
                 ATOM 
                 1544 
                 O 
                 ALA 
                 B 
                 85 
                 −15.165 
                 53.933 
                 39.767 
                 1.00 
                 16.09 
                 O 
               
               
                 ATOM 
                 1545 
                 CB 
                 ALA 
                 B 
                 85 
                 −13.288 
                 51.341 
                 39.783 
                 1.00 
                 16.01 
                 C 
               
               
                 ATOM 
                 1546 
                 N 
                 PHE 
                 B 
                 86 
                 −14.767 
                 53.283 
                 41.897 
                 1.00 
                 16.14 
                 N 
               
               
                 ATOM 
                 1547 
                 CA 
                 PHE 
                 B 
                 86 
                 −14.710 
                 54.606 
                 42.488 
                 1.00 
                 16.71 
                 C 
               
               
                 ATOM 
                 1548 
                 C 
                 PHE 
                 B 
                 86 
                 −13.449 
                 54.774 
                 43.339 
                 1.00 
                 16.53 
                 C 
               
               
                 ATOM 
                 1549 
                 O 
                 PHE 
                 B 
                 86 
                 −12.977 
                 53.828 
                 43.967 
                 1.00 
                 15.05 
                 O 
               
               
                 ATOM 
                 1550 
                 CB 
                 PHE 
                 B 
                 86 
                 −15.910 
                 54.831 
                 43.403 
                 1.00 
                 17.17 
                 C 
               
               
                 ATOM 
                 1551 
                 CG 
                 PHE 
                 B 
                 86 
                 −17.195 
                 54.931 
                 42.676 
                 1.00 
                 18.63 
                 C 
               
               
                 ATOM 
                 1552 
                 CD1 
                 PHE 
                 B 
                 86 
                 −17.871 
                 53.797 
                 42.296 
                 1.00 
                 18.73 
                 C 
               
               
                 ATOM 
                 1553 
                 CD2 
                 PHE 
                 B 
                 86 
                 −17.730 
                 56.170 
                 42.371 
                 1.00 
                 21.86 
                 C 
               
               
                 ATOM 
                 1554 
                 CE1 
                 PHE 
                 B 
                 86 
                 −19.047 
                 53.881 
                 41.600 
                 1.00 
                 20.98 
                 C 
               
               
                 ATOM 
                 1555 
                 CE2 
                 PHE 
                 B 
                 86 
                 −18.916 
                 56.265 
                 41.679 
                 1.00 
                 23.65 
                 C 
               
               
                 ATOM 
                 1556 
                 CZ 
                 PHE 
                 B 
                 86 
                 −19.578 
                 55.103 
                 41.290 
                 1.00 
                 22.79 
                 C 
               
               
                 ATOM 
                 1557 
                 N 
                 TYR 
                 B 
                 87 
                 −12.961 
                 56.014 
                 43.379 
                 1.00 
                 17.00 
                 N 
               
               
                 ATOM 
                 1558 
                 CA 
                 TYR 
                 B 
                 87 
                 −11.781 
                 56.396 
                 44.122 
                 1.00 
                 17.28 
                 C 
               
               
                 ATOM 
                 1559 
                 C 
                 TYR 
                 B 
                 87 
                 −12.120 
                 57.517 
                 45.070 
                 1.00 
                 18.27 
                 C 
               
               
                 ATOM 
                 1560 
                 O 
                 TYR 
                 B 
                 87 
                 −13.229 
                 58.030 
                 45.038 
                 1.00 
                 17.26 
                 O 
               
               
                 ATOM 
                 1561 
                 CB 
                 TYR 
                 B 
                 87 
                 −10.746 
                 56.915 
                 43.139 
                 1.00 
                 17.73 
                 C 
               
               
                 ATOM 
                 1562 
                 CG 
                 TYR 
                 B 
                 87 
                 −10.346 
                 55.916 
                 42.097 
                 1.00 
                 16.88 
                 C 
               
               
                 ATOM 
                 1563 
                 CD1 
                 TYR 
                 B 
                 87 
                 −10.367 
                 56.245 
                 40.752 
                 1.00 
                 17.20 
                 C 
               
               
                 ATOM 
                 1564 
                 CD2 
                 TYR 
                 B 
                 87 
                 −9.946 
                 54.629 
                 42.459 
                 1.00 
                 17.73 
                 C 
               
               
                 ATOM 
                 1565 
                 CE1 
                 TYR 
                 B 
                 87 
                 −9.982 
                 55.327 
                 39.782 
                 1.00 
                 17.23 
                 C 
               
               
                 ATOM 
                 1566 
                 CE2 
                 TYR 
                 B 
                 87 
                 −9.553 
                 53.697 
                 41.496 
                 1.00 
                 18.63 
                 C 
               
               
                 ATOM 
                 1567 
                 CZ 
                 TYR 
                 B 
                 87 
                 −9.577 
                 54.054 
                 40.154 
                 1.00 
                 18.65 
                 C 
               
               
                 ATOM 
                 1568 
                 OH 
                 TYR 
                 B 
                 87 
                 −9.190 
                 53.137 
                 39.183 
                 1.00 
                 19.23 
                 O 
               
               
                 ATOM 
                 1569 
                 N 
                 SER 
                 B 
                 88 
                 −11.152 
                 57.919 
                 45.891 
                 1.00 
                 19.12 
                 N 
               
               
                 ATOM 
                 1570 
                 CA 
                 SER 
                 B 
                 88 
                 −11.294 
                 59.134 
                 46.674 
                 1.00 
                 20.75 
                 C 
               
               
                 ATOM 
                 1571 
                 C 
                 SER 
                 B 
                 88 
                 −9.993 
                 59.942 
                 46.761 
                 1.00 
                 22.29 
                 C 
               
               
                 ATOM 
                 1572 
                 O 
                 SER 
                 B 
                 88 
                 −8.890 
                 59.421 
                 46.612 
                 1.00 
                 22.12 
                 O 
               
               
                 ATOM 
                 1573 
                 CB 
                 SER 
                 B 
                 88 
                 −11.789 
                 58.819 
                 48.096 
                 1.00 
                 20.72 
                 C 
               
               
                 ATOM 
                 1574 
                 OG 
                 SER 
                 B 
                 88 
                 −10.788 
                 58.145 
                 48.827 
                 1.00 
                 20.04 
                 O 
               
               
                 ATOM 
                 1575 
                 N 
                 LEU 
                 B 
                 89 
                 −10.139 
                 61.227 
                 47.018 
                 1.00 
                 24.28 
                 N 
               
               
                 ATOM 
                 1576 
                 CA 
                 LEU 
                 B 
                 89 
                 −8.987 
                 62.040 
                 47.362 
                 1.00 
                 26.19 
                 C 
               
               
                 ATOM 
                 1577 
                 C 
                 LEU 
                 B 
                 89 
                 −9.266 
                 62.856 
                 48.625 
                 1.00 
                 27.08 
                 C 
               
               
                 ATOM 
                 1578 
                 O 
                 LEU 
                 B 
                 89 
                 −10.419 
                 63.118 
                 48.968 
                 1.00 
                 26.58 
                 O 
               
               
                 ATOM 
                 1579 
                 CB 
                 LEU 
                 B 
                 89 
                 −8.557 
                 62.907 
                 46.171 
                 1.00 
                 26.68 
                 C 
               
               
                 ATOM 
                 1580 
                 CG 
                 LEU 
                 B 
                 89 
                 −9.445 
                 64.001 
                 45.544 
                 1.00 
                 28.47 
                 C 
               
               
                 ATOM 
                 1581 
                 CD1 
                 LEU 
                 B 
                 89 
                 −9.280 
                 63.988 
                 44.028 
                 1.00 
                 28.80 
                 C 
               
               
                 ATOM 
                 1582 
                 CD2 
                 LEU 
                 B 
                 89 
                 −10.922 
                 63.909 
                 45.883 
                 1.00 
                 29.53 
                 C 
               
               
                 ATOM 
                 1583 
                 N 
                 PRO 
                 B 
                 90 
                 −8.223 
                 63.187 
                 49.372 
                 1.00 
                 28.97 
                 N 
               
               
                 ATOM 
                 1584 
                 CA 
                 PRO 
                 B 
                 90 
                 −8.336 
                 64.275 
                 50.351 
                 1.00 
                 29.81 
                 C 
               
               
                 ATOM 
                 1585 
                 C 
                 PRO 
                 B 
                 90 
                 −8.264 
                 65.614 
                 49.611 
                 1.00 
                 30.96 
                 C 
               
               
                 ATOM 
                 1586 
                 O 
                 PRO 
                 B 
                 90 
                 −7.366 
                 65.718 
                 48.772 
                 1.00 
                 31.41 
                 O 
               
               
                 ATOM 
                 1587 
                 CB 
                 PRO 
                 B 
                 90 
                 −7.118 
                 64.072 
                 51.260 
                 1.00 
                 29.62 
                 C 
               
               
                 ATOM 
                 1588 
                 CG 
                 PRO 
                 B 
                 90 
                 −6.516 
                 62.752 
                 50.856 
                 1.00 
                 29.50 
                 C 
               
               
                 ATOM 
                 1589 
                 CD 
                 PRO 
                 B 
                 90 
                 −6.899 
                 62.539 
                 49.417 
                 1.00 
                 29.26 
                 C 
               
               
                 ATOM 
                 1590 
                 N 
                 LEU 
                 B 
                 91 
                 −9.127 
                 66.610 
                 49.864 
                 1.00 
                 32.14 
                 N 
               
               
                 ATOM 
                 1591 
                 CA 
                 LEU 
                 B 
                 91 
                 −10.181 
                 66.619 
                 50.890 
                 1.00 
                 32.64 
                 C 
               
               
                 ATOM 
                 1592 
                 C 
                 LEU 
                 B 
                 91 
                 −9.654 
                 66.206 
                 52.261 
                 1.00 
                 32.94 
                 C 
               
               
                 ATOM 
                 1593 
                 O 
                 LEU 
                 B 
                 91 
                 −9.912 
                 65.096 
                 52.744 
                 1.00 
                 33.37 
                 O 
               
               
                 ATOM 
                 1594 
                 CB 
                 LEU 
                 B 
                 91 
                 −11.402 
                 65.789 
                 50.453 
                 1.00 
                 33.03 
                 C 
               
               
                 ATOM 
                 1595 
                 CG 
                 LEU 
                 B 
                 91 
                 −12.780 
                 66.333 
                 50.876 
                 1.00 
                 33.50 
                 C 
               
               
                 ATOM 
                 1596 
                 CD1 
                 LEU 
                 B 
                 91 
                 −12.873 
                 66.545 
                 52.382 
                 1.00 
                 33.54 
                 C 
               
               
                 ATOM 
                 1597 
                 CD2 
                 LEU 
                 B 
                 91 
                 −13.093 
                 67.641 
                 50.143 
                 1.00 
                 33.79 
                 C 
               
               
                 ATOM 
                 1598 
                 N 
                 GLY 
                 B 
                 92 
                 −8.924 
                 67.132 
                 52.874 
                 1.00 
                 32.78 
                 N 
               
               
                 ATOM 
                 1599 
                 CA 
                 GLY 
                 B 
                 92 
                 −8.174 
                 66.865 
                 54.078 
                 1.00 
                 32.66 
                 C 
               
               
                 ATOM 
                 1600 
                 C 
                 GLY 
                 B 
                 92 
                 −8.970 
                 67.126 
                 55.336 
                 1.00 
                 32.67 
                 C 
               
               
                 ATOM 
                 1601 
                 O 
                 GLY 
                 B 
                 92 
                 −8.948 
                 68.230 
                 55.894 
                 1.00 
                 31.99 
                 O 
               
               
                 ATOM 
                 1602 
                 N 
                 ASP 
                 B 
                 93 
                 −9.696 
                 66.098 
                 55.765 
                 1.00 
                 32.42 
                 N 
               
               
                 ATOM 
                 1603 
                 CA 
                 ASP 
                 B 
                 93 
                 −10.223 
                 66.050 
                 57.131 
                 1.00 
                 32.02 
                 C 
               
               
                 ATOM 
                 1604 
                 C 
                 ASP 
                 B 
                 93 
                 −10.482 
                 64.577 
                 57.505 
                 1.00 
                 31.47 
                 C 
               
               
                 ATOM 
                 1605 
                 O 
                 ASP 
                 B 
                 93 
                 −10.682 
                 63.721 
                 56.621 
                 1.00 
                 30.74 
                 O 
               
               
                 ATOM 
                 1606 
                 CB 
                 ASP 
                 B 
                 93 
                 −11.468 
                 66.936 
                 57.272 
                 1.00 
                 32.07 
                 C 
               
               
                 ATOM 
                 1607 
                 CG 
                 ASP 
                 B 
                 93 
                 −12.260 
                 66.640 
                 58.522 
                 1.00 
                 32.22 
                 C 
               
               
                 ATOM 
                 1608 
                 OD1 
                 ASP 
                 B 
                 93 
                 −13.295 
                 65.950 
                 58.415 
                 1.00 
                 32.43 
                 O 
               
               
                 ATOM 
                 1609 
                 OD2 
                 ASP 
                 B 
                 93 
                 −11.915 
                 67.035 
                 59.657 
                 1.00 
                 33.64 
                 O 
               
               
                 ATOM 
                 1610 
                 N 
                 TYR 
                 B 
                 94 
                 −10.421 
                 64.287 
                 58.808 
                 1.00 
                 30.71 
                 N 
               
               
                 ATOM 
                 1611 
                 CA 
                 TYR 
                 B 
                 94 
                 −10.430 
                 62.905 
                 59.294 
                 1.00 
                 30.32 
                 C 
               
               
                 ATOM 
                 1612 
                 C 
                 TYR 
                 B 
                 94 
                 −11.721 
                 62.175 
                 58.944 
                 1.00 
                 29.29 
                 C 
               
               
                 ATOM 
                 1613 
                 O 
                 TYR 
                 B 
                 94 
                 −11.677 
                 61.040 
                 58.486 
                 1.00 
                 29.11 
                 O 
               
               
                 ATOM 
                 1614 
                 CB 
                 TYR 
                 B 
                 94 
                 −10.162 
                 62.821 
                 60.811 
                 1.00 
                 30.66 
                 C 
               
               
                 ATOM 
                 1615 
                 CG 
                 TYR 
                 B 
                 94 
                 −10.018 
                 61.390 
                 61.314 
                 1.00 
                 32.23 
                 C 
               
               
                 ATOM 
                 1616 
                 CD1 
                 TYR 
                 B 
                 94 
                 −9.185 
                 60.479 
                 60.655 
                 1.00 
                 33.94 
                 C 
               
               
                 ATOM 
                 1617 
                 CD2 
                 TYR 
                 B 
                 94 
                 −10.733 
                 60.939 
                 62.426 
                 1.00 
                 33.45 
                 C 
               
               
                 ATOM 
                 1618 
                 CE1 
                 TYR 
                 B 
                 94 
                 −9.055 
                 59.166 
                 61.099 
                 1.00 
                 34.92 
                 C 
               
               
                 ATOM 
                 1619 
                 CE2 
                 TYR 
                 B 
                 94 
                 −10.611 
                 59.618 
                 62.878 
                 1.00 
                 34.33 
                 C 
               
               
                 ATOM 
                 1620 
                 CZ 
                 TYR 
                 B 
                 94 
                 −9.769 
                 58.736 
                 62.208 
                 1.00 
                 35.76 
                 C 
               
               
                 ATOM 
                 1621 
                 OH 
                 TYR 
                 B 
                 94 
                 −9.635 
                 57.423 
                 62.629 
                 1.00 
                 37.28 
                 O 
               
               
                 ATOM 
                 1622 
                 N 
                 ASN 
                 B 
                 95 
                 −12.862 
                 62.829 
                 59.137 
                 1.00 
                 28.16 
                 N 
               
               
                 ATOM 
                 1623 
                 CA 
                 ASN 
                 B 
                 95 
                 −14.144 
                 62.221 
                 58.784 
                 1.00 
                 27.21 
                 C 
               
               
                 ATOM 
                 1624 
                 C 
                 ASN 
                 B 
                 95 
                 −14.461 
                 62.276 
                 57.279 
                 1.00 
                 26.08 
                 C 
               
               
                 ATOM 
                 1625 
                 O 
                 ASN 
                 B 
                 95 
                 −15.162 
                 61.393 
                 56.787 
                 1.00 
                 26.22 
                 O 
               
               
                 ATOM 
                 1626 
                 CB 
                 ASN 
                 B 
                 95 
                 −15.296 
                 62.844 
                 59.589 
                 1.00 
                 27.50 
                 C 
               
               
                 ATOM 
                 1627 
                 CG 
                 ASN 
                 B 
                 95 
                 −15.025 
                 62.868 
                 61.093 
                 1.00 
                 28.06 
                 C 
               
               
                 ATOM 
                 1628 
                 OD1 
                 ASN 
                 B 
                 95 
                 −15.185 
                 61.861 
                 61.784 
                 1.00 
                 29.15 
                 O 
               
               
                 ATOM 
                 1629 
                 ND2 
                 ASN 
                 B 
                 95 
                 −14.616 
                 64.025 
                 61.600 
                 1.00 
                 28.91 
                 N 
               
               
                 ATOM 
                 1630 
                 N 
                 TYR 
                 B 
                 96 
                 −13.931 
                 63.265 
                 56.545 
                 1.00 
                 24.35 
                 N 
               
               
                 ATOM 
                 1631 
                 CA 
                 TYR 
                 B 
                 96 
                 −14.346 
                 63.501 
                 55.145 
                 1.00 
                 23.11 
                 C 
               
               
                 ATOM 
                 1632 
                 C 
                 TYR 
                 B 
                 96 
                 −13.270 
                 63.343 
                 54.042 
                 1.00 
                 21.64 
                 C 
               
               
                 ATOM 
                 1633 
                 O 
                 TYR 
                 B 
                 96 
                 −12.145 
                 63.812 
                 54.171 
                 1.00 
                 21.25 
                 O 
               
               
                 ATOM 
                 1634 
                 CB 
                 TYR 
                 B 
                 96 
                 −15.001 
                 64.882 
                 55.013 
                 1.00 
                 23.06 
                 C 
               
               
                 ATOM 
                 1635 
                 CG 
                 TYR 
                 B 
                 96 
                 −16.167 
                 65.107 
                 55.963 
                 1.00 
                 24.50 
                 C 
               
               
                 ATOM 
                 1636 
                 CD1 
                 TYR 
                 B 
                 96 
                 −16.118 
                 66.099 
                 56.952 
                 1.00 
                 25.24 
                 C 
               
               
                 ATOM 
                 1637 
                 CD2 
                 TYR 
                 B 
                 96 
                 −17.317 
                 64.335 
                 55.879 
                 1.00 
                 24.87 
                 C 
               
               
                 ATOM 
                 1638 
                 CE1 
                 TYR 
                 B 
                 96 
                 −17.191 
                 66.306 
                 57.827 
                 1.00 
                 25.86 
                 C 
               
               
                 ATOM 
                 1639 
                 CE2 
                 TYR 
                 B 
                 96 
                 −18.398 
                 64.535 
                 56.754 
                 1.00 
                 25.97 
                 C 
               
               
                 ATOM 
                 1640 
                 CZ 
                 TYR 
                 B 
                 96 
                 −18.330 
                 65.520 
                 57.722 
                 1.00 
                 26.29 
                 C 
               
               
                 ATOM 
                 1641 
                 OH 
                 TYR 
                 B 
                 96 
                 −19.395 
                 65.713 
                 58.586 
                 1.00 
                 26.82 
                 O 
               
               
                 ATOM 
                 1642 
                 N 
                 SER 
                 B 
                 97 
                 −13.655 
                 62.674 
                 52.960 
                 1.00 
                 20.03 
                 N 
               
               
                 ATOM 
                 1643 
                 CA 
                 SER 
                 B 
                 97 
                 −12.905 
                 62.653 
                 51.699 
                 1.00 
                 19.27 
                 C 
               
               
                 ATOM 
                 1644 
                 C 
                 SER 
                 B 
                 97 
                 −13.869 
                 62.771 
                 50.523 
                 1.00 
                 18.44 
                 C 
               
               
                 ATOM 
                 1645 
                 O 
                 SER 
                 B 
                 97 
                 −15.080 
                 62.683 
                 50.680 
                 1.00 
                 17.65 
                 O 
               
               
                 ATOM 
                 1646 
                 CB 
                 SER 
                 B 
                 97 
                 −12.097 
                 61.357 
                 51.533 
                 1.00 
                 19.13 
                 C 
               
               
                 ATOM 
                 1647 
                 OG 
                 SER 
                 B 
                 97 
                 −10.972 
                 61.327 
                 52.399 
                 1.00 
                 19.63 
                 O 
               
               
                 ATOM 
                 1648 
                 N 
                 LEU 
                 B 
                 98 
                 −13.328 
                 62.982 
                 49.336 
                 1.00 
                 18.23 
                 N 
               
               
                 ATOM 
                 1649 
                 CA 
                 LEU 
                 B 
                 98 
                 −14.162 
                 63.093 
                 48.161 
                 1.00 
                 18.60 
                 C 
               
               
                 ATOM 
                 1650 
                 C 
                 LEU 
                 B 
                 98 
                 −14.082 
                 61.839 
                 47.355 
                 1.00 
                 17.81 
                 C 
               
               
                 ATOM 
                 1651 
                 O 
                 LEU 
                 B 
                 98 
                 −13.018 
                 61.400 
                 46.967 
                 1.00 
                 17.98 
                 O 
               
               
                 ATOM 
                 1652 
                 CB 
                 LEU 
                 B 
                 98 
                 −13.761 
                 64.271 
                 47.287 
                 1.00 
                 19.46 
                 C 
               
               
                 ATOM 
                 1653 
                 CG 
                 LEU 
                 B 
                 98 
                 −14.959 
                 65.100 
                 46.824 
                 1.00 
                 20.85 
                 C 
               
               
                 ATOM 
                 1654 
                 CD1 
                 LEU 
                 B 
                 98 
                 −15.248 
                 66.226 
                 47.810 
                 1.00 
                 20.64 
                 C 
               
               
                 ATOM 
                 1655 
                 CD2 
                 LEU 
                 B 
                 98 
                 −14.699 
                 65.623 
                 45.416 
                 1.00 
                 22.29 
                 C 
               
               
                 ATOM 
                 1656 
                 N 
                 LEU 
                 B 
                 99 
                 −15.243 
                 61.265 
                 47.125 
                 1.00 
                 17.25 
                 N 
               
               
                 ATOM 
                 1657 
                 CA 
                 LEU 
                 B 
                 99 
                 −15.387 
                 60.098 
                 46.297 
                 1.00 
                 17.01 
                 C 
               
               
                 ATOM 
                 1658 
                 C 
                 LEU 
                 B 
                 99 
                 −15.487 
                 60.578 
                 44.854 
                 1.00 
                 16.38 
                 C 
               
               
                 ATOM 
                 1659 
                 O 
                 LEU 
                 B 
                 99 
                 −16.166 
                 61.556 
                 44.576 
                 1.00 
                 15.68 
                 O 
               
               
                 ATOM 
                 1660 
                 CB 
                 LEU 
                 B 
                 99 
                 −16.682 
                 59.387 
                 46.654 
                 1.00 
                 17.31 
                 C 
               
               
                 ATOM 
                 1661 
                 CG 
                 LEU 
                 B 
                 99 
                 −16.740 
                 57.946 
                 47.140 
                 1.00 
                 19.55 
                 C 
               
               
                 ATOM 
                 1662 
                 CD1 
                 LEU 
                 B 
                 99 
                 −18.108 
                 57.398 
                 46.718 
                 1.00 
                 21.25 
                 C 
               
               
                 ATOM 
                 1663 
                 CD2 
                 LEU 
                 B 
                 99 
                 −15.627 
                 57.043 
                 46.660 
                 1.00 
                 18.90 
                 C 
               
               
                 ATOM 
                 1664 
                 N 
                 PHE 
                 B 
                 100 
                 −14.822 
                 59.892 
                 43.941 
                 1.00 
                 15.94 
                 N 
               
               
                 ATOM 
                 1665 
                 CA 
                 PHE 
                 B 
                 100 
                 −14.995 
                 60.202 
                 42.535 
                 1.00 
                 16.65 
                 C 
               
               
                 ATOM 
                 1666 
                 C 
                 PHE 
                 B 
                 100 
                 −15.046 
                 58.977 
                 41.629 
                 1.00 
                 16.49 
                 C 
               
               
                 ATOM 
                 1667 
                 O 
                 PHE 
                 B 
                 100 
                 −14.625 
                 57.896 
                 41.988 
                 1.00 
                 16.43 
                 O 
               
               
                 ATOM 
                 1668 
                 CB 
                 PHE 
                 B 
                 100 
                 −13.986 
                 61.265 
                 42.045 
                 1.00 
                 16.45 
                 C 
               
               
                 ATOM 
                 1669 
                 CG 
                 PHE 
                 B 
                 100 
                 −12.550 
                 60.818 
                 42.013 
                 1.00 
                 16.97 
                 C 
               
               
                 ATOM 
                 1670 
                 CD1 
                 PHE 
                 B 
                 100 
                 −11.938 
                 60.466 
                 40.810 
                 1.00 
                 18.14 
                 C 
               
               
                 ATOM 
                 1671 
                 CD2 
                 PHE 
                 B 
                 100 
                 −11.788 
                 60.798 
                 43.176 
                 1.00 
                 16.86 
                 C 
               
               
                 ATOM 
                 1672 
                 CE1 
                 PHE 
                 B 
                 100 
                 −10.582 
                 60.077 
                 40.771 
                 1.00 
                 17.07 
                 C 
               
               
                 ATOM 
                 1673 
                 CE2 
                 PHE 
                 B 
                 100 
                 −10.445 
                 60.405 
                 43.145 
                 1.00 
                 18.19 
                 C 
               
               
                 ATOM 
                 1674 
                 CZ 
                 PHE 
                 B 
                 100 
                 −9.840 
                 60.053 
                 41.930 
                 1.00 
                 17.19 
                 C 
               
               
                 ATOM 
                 1675 
                 N 
                 ARG 
                 B 
                 101 
                 −15.608 
                 59.200 
                 40.450 
                 1.00 
                 17.08 
                 N 
               
               
                 ATOM 
                 1676 
                 CA 
                 ARG 
                 B 
                 101 
                 −15.884 
                 58.172 
                 39.477 
                 1.00 
                 17.76 
                 C 
               
               
                 ATOM 
                 1677 
                 C 
                 ARG 
                 B 
                 101 
                 −14.597 
                 57.728 
                 38.822 
                 1.00 
                 17.11 
                 C 
               
               
                 ATOM 
                 1678 
                 O 
                 ARG 
                 B 
                 101 
                 −13.847 
                 58.555 
                 38.310 
                 1.00 
                 16.40 
                 O 
               
               
                 ATOM 
                 1679 
                 CB 
                 ARG 
                 B 
                 101 
                 −16.824 
                 58.737 
                 38.395 
                 1.00 
                 18.57 
                 C 
               
               
                 ATOM 
                 1680 
                 CG 
                 ARG 
                 B 
                 101 
                 −18.056 
                 57.886 
                 38.135 
                 1.00 
                 21.82 
                 C 
               
               
                 ATOM 
                 1681 
                 CD 
                 ARG 
                 B 
                 101 
                 −19.196 
                 58.631 
                 37.439 
                 1.00 
                 24.74 
                 C 
               
               
                 ATOM 
                 1682 
                 NE 
                 ARG 
                 B 
                 101 
                 −20.327 
                 58.826 
                 38.341 
                 1.00 
                 27.71 
                 N 
               
               
                 ATOM 
                 1683 
                 CZ 
                 ARG 
                 B 
                 101 
                 −21.194 
                 57.878 
                 38.692 
                 1.00 
                 28.04 
                 C 
               
               
                 ATOM 
                 1684 
                 NH1 
                 ARG 
                 B 
                 101 
                 −21.081 
                 56.639 
                 38.235 
                 1.00 
                 29.97 
                 N 
               
               
                 ATOM 
                 1685 
                 NH2 
                 ARG 
                 B 
                 101 
                 −22.187 
                 58.174 
                 39.515 
                 1.00 
                 30.47 
                 N 
               
               
                 ATOM 
                 1686 
                 N 
                 GLY 
                 B 
                 102 
                 −14.378 
                 56.415 
                 38.808 
                 1.00 
                 16.71 
                 N 
               
               
                 ATOM 
                 1687 
                 CA 
                 GLY 
                 B 
                 102 
                 −13.265 
                 55.820 
                 38.094 
                 1.00 
                 16.36 
                 C 
               
               
                 ATOM 
                 1688 
                 C 
                 GLY 
                 B 
                 102 
                 −13.731 
                 55.107 
                 36.836 
                 1.00 
                 16.19 
                 C 
               
               
                 ATOM 
                 1689 
                 O 
                 GLY 
                 B 
                 102 
                 −14.804 
                 55.376 
                 36.305 
                 1.00 
                 15.43 
                 O 
               
               
                 ATOM 
                 1690 
                 N 
                 GLU 
                 B 
                 103 
                 −12.947 
                 54.131 
                 36.411 
                 1.00 
                 15.92 
                 N 
               
               
                 ATOM 
                 1691 
                 CA 
                 GLU 
                 B 
                 103 
                 −13.155 
                 53.459 
                 35.126 
                 1.00 
                 16.00 
                 C 
               
               
                 ATOM 
                 1692 
                 C 
                 GLU 
                 B 
                 103 
                 −14.294 
                 52.456 
                 35.219 
                 1.00 
                 16.23 
                 C 
               
               
                 ATOM 
                 1693 
                 O 
                 GLU 
                 B 
                 103 
                 −14.661 
                 52.007 
                 36.297 
                 1.00 
                 14.93 
                 O 
               
               
                 ATOM 
                 1694 
                 CB 
                 GLU 
                 B 
                 103 
                 −11.882 
                 52.731 
                 34.703 
                 1.00 
                 15.57 
                 C 
               
               
                 ATOM 
                 1695 
                 CG 
                 GLU 
                 B 
                 103 
                 −10.726 
                 53.669 
                 34.411 
                 1.00 
                 16.30 
                 C 
               
               
                 ATOM 
                 1696 
                 CD 
                 GLU 
                 B 
                 103 
                 −9.986 
                 54.115 
                 35.652 
                 1.00 
                 16.19 
                 C 
               
               
                 ATOM 
                 1697 
                 OE1 
                 GLU 
                 B 
                 103 
                 −9.137 
                 54.998 
                 35.508 
                 1.00 
                 16.39 
                 O 
               
               
                 ATOM 
                 1698 
                 OE2 
                 GLU 
                 B 
                 103 
                 −10.260 
                 53.592 
                 36.777 
                 1.00 
                 15.82 
                 O 
               
               
                 ATOM 
                 1699 
                 N 
                 LYS 
                 B 
                 104 
                 −14.828 
                 52.096 
                 34.063 
                 1.00 
                 17.04 
                 N 
               
               
                 ATOM 
                 1700 
                 CA 
                 LYS 
                 B 
                 104 
                 −16.031 
                 51.299 
                 33.978 
                 1.00 
                 17.92 
                 C 
               
               
                 ATOM 
                 1701 
                 C 
                 LYS 
                 B 
                 104 
                 −15.728 
                 50.063 
                 33.124 
                 1.00 
                 17.90 
                 C 
               
               
                 ATOM 
                 1702 
                 O 
                 LYS 
                 B 
                 104 
                 −14.934 
                 50.121 
                 32.169 
                 1.00 
                 16.60 
                 O 
               
               
                 ATOM 
                 1703 
                 CB 
                 LYS 
                 B 
                 104 
                 −17.150 
                 52.159 
                 33.363 
                 1.00 
                 18.66 
                 C 
               
               
                 ATOM 
                 1704 
                 CG 
                 LYS 
                 B 
                 104 
                 −18.552 
                 51.885 
                 33.857 
                 1.00 
                 21.78 
                 C 
               
               
                 ATOM 
                 1705 
                 CD 
                 LYS 
                 B 
                 104 
                 −19.605 
                 52.757 
                 33.118 
                 1.00 
                 24.78 
                 C 
               
               
                 ATOM 
                 1706 
                 CE 
                 LYS 
                 B 
                 104 
                 −21.036 
                 52.466 
                 33.580 
                 1.00 
                 25.87 
                 C 
               
               
                 ATOM 
                 1707 
                 NZ 
                 LYS 
                 B 
                 104 
                 −22.126 
                 53.297 
                 32.887 
                 1.00 
                 28.01 
                 N 
               
               
                 ATOM 
                 1708 
                 N 
                 GLY 
                 B 
                 105 
                 −16.362 
                 48.942 
                 33.484 
                 1.00 
                 17.73 
                 N 
               
               
                 ATOM 
                 1709 
                 CA 
                 GLY 
                 B 
                 105 
                 −16.316 
                 47.745 
                 32.677 
                 1.00 
                 17.68 
                 C 
               
               
                 ATOM 
                 1710 
                 C 
                 GLY 
                 B 
                 105 
                 −16.960 
                 47.943 
                 31.323 
                 1.00 
                 17.40 
                 C 
               
               
                 ATOM 
                 1711 
                 O 
                 GLY 
                 B 
                 105 
                 −17.822 
                 48.799 
                 31.162 
                 1.00 
                 17.93 
                 O 
               
               
                 ATOM 
                 1712 
                 N 
                 ALA 
                 B 
                 106 
                 −16.523 
                 47.159 
                 30.343 
                 1.00 
                 16.99 
                 N 
               
               
                 ATOM 
                 1713 
                 CA 
                 ALA 
                 B 
                 106 
                 −17.004 
                 47.300 
                 28.969 
                 1.00 
                 17.63 
                 C 
               
               
                 ATOM 
                 1714 
                 C 
                 ALA 
                 B 
                 106 
                 −18.384 
                 46.692 
                 28.753 
                 1.00 
                 17.50 
                 C 
               
               
                 ATOM 
                 1715 
                 O 
                 ALA 
                 B 
                 106 
                 −18.974 
                 46.949 
                 27.732 
                 1.00 
                 17.21 
                 O 
               
               
                 ATOM 
                 1716 
                 CB 
                 ALA 
                 B 
                 106 
                 −16.013 
                 46.688 
                 27.977 
                 1.00 
                 17.39 
                 C 
               
               
                 ATOM 
                 1717 
                 N 
                 GLY 
                 B 
                 107 
                 −18.860 
                 45.882 
                 29.704 
                 1.00 
                 17.48 
                 N 
               
               
                 ATOM 
                 1718 
                 CA 
                 GLY 
                 B 
                 107 
                 −20.216 
                 45.352 
                 29.709 
                 1.00 
                 17.63 
                 C 
               
               
                 ATOM 
                 1719 
                 C 
                 GLY 
                 B 
                 107 
                 −20.338 
                 43.833 
                 29.604 
                 1.00 
                 17.28 
                 C 
               
               
                 ATOM 
                 1720 
                 O 
                 GLY 
                 B 
                 107 
                 −19.452 
                 43.160 
                 29.110 
                 1.00 
                 17.81 
                 O 
               
               
                 ATOM 
                 1721 
                 N 
                 THR 
                 B 
                 108 
                 −21.478 
                 43.316 
                 30.052 
                 1.00 
                 17.48 
                 N 
               
               
                 ATOM 
                 1722 
                 CA 
                 THR 
                 B 
                 108 
                 −21.879 
                 41.917 
                 29.908 
                 1.00 
                 16.91 
                 C 
               
               
                 ATOM 
                 1723 
                 C 
                 THR 
                 B 
                 108 
                 −23.251 
                 41.948 
                 29.289 
                 1.00 
                 16.96 
                 C 
               
               
                 ATOM 
                 1724 
                 O 
                 THR 
                 B 
                 108 
                 −24.159 
                 42.543 
                 29.874 
                 1.00 
                 16.69 
                 O 
               
               
                 ATOM 
                 1725 
                 CB 
                 THR 
                 B 
                 108 
                 −22.010 
                 41.208 
                 31.293 
                 1.00 
                 16.78 
                 C 
               
               
                 ATOM 
                 1726 
                 OG1 
                 THR 
                 B 
                 108 
                 −20.720 
                 41.021 
                 31.894 
                 1.00 
                 15.50 
                 O 
               
               
                 ATOM 
                 1727 
                 CG2 
                 THR 
                 B 
                 108 
                 −22.588 
                 39.765 
                 31.132 
                 1.00 
                 17.18 
                 C 
               
               
                 ATOM 
                 1728 
                 N 
                 ALA 
                 B 
                 109 
                 −23.420 
                 41.306 
                 28.131 
                 1.00 
                 16.67 
                 N 
               
               
                 ATOM 
                 1729 
                 CA 
                 ALA 
                 B 
                 109 
                 −24.706 
                 41.262 
                 27.448 
                 1.00 
                 16.55 
                 C 
               
               
                 ATOM 
                 1730 
                 C 
                 ALA 
                 B 
                 109 
                 −25.353 
                 39.961 
                 27.846 
                 1.00 
                 16.99 
                 C 
               
               
                 ATOM 
                 1731 
                 O 
                 ALA 
                 B 
                 109 
                 −24.939 
                 38.896 
                 27.394 
                 1.00 
                 17.11 
                 O 
               
               
                 ATOM 
                 1732 
                 CB 
                 ALA 
                 B 
                 109 
                 −24.540 
                 41.324 
                 25.893 
                 1.00 
                 16.53 
                 C 
               
               
                 ATOM 
                 1733 
                 N 
                 LEU 
                 B 
                 110 
                 −26.363 
                 40.047 
                 28.699 
                 1.00 
                 17.44 
                 N 
               
               
                 ATOM 
                 1734 
                 CA 
                 LEU 
                 B 
                 110 
                 −27.059 
                 38.870 
                 29.180 
                 1.00 
                 17.82 
                 C 
               
               
                 ATOM 
                 1735 
                 C 
                 LEU 
                 B 
                 110 
                 −28.334 
                 38.654 
                 28.402 
                 1.00 
                 18.45 
                 C 
               
               
                 ATOM 
                 1736 
                 O 
                 LEU 
                 B 
                 110 
                 −29.121 
                 39.585 
                 28.200 
                 1.00 
                 18.97 
                 O 
               
               
                 ATOM 
                 1737 
                 CB 
                 LEU 
                 B 
                 110 
                 −27.410 
                 39.018 
                 30.660 
                 1.00 
                 17.67 
                 C 
               
               
                 ATOM 
                 1738 
                 CG 
                 LEU 
                 B 
                 110 
                 −28.233 
                 37.905 
                 31.297 
                 1.00 
                 16.52 
                 C 
               
               
                 ATOM 
                 1739 
                 CD1 
                 LEU 
                 B 
                 110 
                 −27.559 
                 36.562 
                 31.143 
                 1.00 
                 15.11 
                 C 
               
               
                 ATOM 
                 1740 
                 CD2 
                 LEU 
                 B 
                 110 
                 −28.502 
                 38.236 
                 32.784 
                 1.00 
                 17.55 
                 C 
               
               
                 ATOM 
                 1741 
                 N 
                 THR 
                 B 
                 111 
                 −28.529 
                 37.408 
                 27.989 
                 1.00 
                 18.42 
                 N 
               
               
                 ATOM 
                 1742 
                 CA 
                 THR 
                 B 
                 111 
                 −29.781 
                 36.945 
                 27.444 
                 1.00 
                 18.62 
                 C 
               
               
                 ATOM 
                 1743 
                 C 
                 THR 
                 B 
                 111 
                 −30.320 
                 35.854 
                 28.342 
                 1.00 
                 18.54 
                 C 
               
               
                 ATOM 
                 1744 
                 O 
                 THR 
                 B 
                 111 
                 −29.648 
                 34.855 
                 28.574 
                 1.00 
                 18.20 
                 O 
               
               
                 ATOM 
                 1745 
                 CB 
                 THR 
                 B 
                 111 
                 −29.557 
                 36.395 
                 26.049 
                 1.00 
                 18.49 
                 C 
               
               
                 ATOM 
                 1746 
                 OG1 
                 THR 
                 B 
                 111 
                 −29.304 
                 37.485 
                 25.159 
                 1.00 
                 19.06 
                 O 
               
               
                 ATOM 
                 1747 
                 CG2 
                 THR 
                 B 
                 111 
                 −30.821 
                 35.724 
                 25.509 
                 1.00 
                 18.48 
                 C 
               
               
                 ATOM 
                 1748 
                 N 
                 VAL 
                 B 
                 112 
                 −31.529 
                 36.063 
                 28.854 
                 1.00 
                 18.62 
                 N 
               
               
                 ATOM 
                 1749 
                 CA 
                 VAL 
                 B 
                 112 
                 −32.203 
                 35.061 
                 29.650 
                 1.00 
                 18.98 
                 C 
               
               
                 ATOM 
                 1750 
                 C 
                 VAL 
                 B 
                 112 
                 −33.437 
                 34.563 
                 28.897 
                 1.00 
                 19.41 
                 C 
               
               
                 ATOM 
                 1751 
                 O 
                 VAL 
                 B 
                 112 
                 −34.285 
                 35.347 
                 28.455 
                 1.00 
                 19.07 
                 O 
               
               
                 ATOM 
                 1752 
                 CB 
                 VAL 
                 B 
                 112 
                 −32.666 
                 35.600 
                 31.023 
                 1.00 
                 18.78 
                 C 
               
               
                 ATOM 
                 1753 
                 CG1 
                 VAL 
                 B 
                 112 
                 −33.204 
                 34.452 
                 31.902 
                 1.00 
                 18.38 
                 C 
               
               
                 ATOM 
                 1754 
                 CG2 
                 VAL 
                 B 
                 112 
                 −31.540 
                 36.356 
                 31.735 
                 1.00 
                 19.56 
                 C 
               
               
                 ATOM 
                 1755 
                 N 
                 LYS 
                 B 
                 113 
                 −33.518 
                 33.255 
                 28.732 
                 1.00 
                 20.11 
                 N 
               
               
                 ATOM 
                 1756 
                 CA 
                 LYS 
                 B 
                 113 
                 −34.805 
                 32.612 
                 28.521 
                 1.00 
                 20.80 
                 C 
               
               
                 ATOM 
                 1757 
                 C 
                 LYS 
                 B 
                 113 
                 −34.736 
                 31.166 
                 28.964 
                 1.00 
                 20.93 
                 C 
               
               
                 ATOM 
                 1758 
                 O 
                 LYS 
                 B 
                 113 
                 −35.505 
                 30.751 
                 29.825 
                 1.00 
                 21.05 
                 O 
               
               
                 ATOM 
                 1759 
                 CB 
                 LYS 
                 B 
                 113 
                 −35.265 
                 32.714 
                 27.070 
                 1.00 
                 21.14 
                 C 
               
               
                 ATOM 
                 1760 
                 CG 
                 LYS 
                 B 
                 113 
                 −36.797 
                 32.926 
                 26.932 
                 1.00 
                 21.95 
                 C 
               
               
                 ATOM 
                 1761 
                 CD 
                 LYS 
                 B 
                 113 
                 −37.613 
                 31.644 
                 27.254 
                 1.00 
                 23.53 
                 C 
               
               
                 ATOM 
                 1762 
                 CE 
                 LYS 
                 B 
                 113 
                 −38.619 
                 31.803 
                 28.420 
                 1.00 
                 23.96 
                 C 
               
               
                 ATOM 
                 1763 
                 NZ 
                 LYS 
                 B 
                 113 
                 −38.373 
                 30.833 
                 29.560 
                 1.00 
                 24.62 
                 N 
               
               
                 TER 
                 1764 
                   
                 LYS 
                 B 
                 113 
               
               
                 HETATM 
                 1765 
                 O 
                 HOH 
                   
                 1 
                 −3.603 
                 22.565 
                 27.326 
                 1.00 
                 32.62 
                 O 
               
               
                 HETATM 
                 1766 
                 O 
                 HOH 
                   
                 2 
                 −2.025 
                 37.576 
                 31.649 
                 1.00 
                 28.80 
                 O 
               
               
                 HETATM 
                 1767 
                 O 
                 HOH 
                   
                 3 
                 −11.564 
                 37.382 
                 17.647 
                 1.00 
                 29.79 
                 O 
               
               
                 HETATM 
                 1768 
                 O 
                 HOH 
                   
                 4 
                 −12.147 
                 50.601 
                 31.887 
                 1.00 
                 29.72 
                 O 
               
               
                 HETATM 
                 1769 
                 O 
                 HOH 
                   
                 5 
                 −14.153 
                 45.214 
                 30.485 
                 1.00 
                 27.66 
                 O 
               
               
                 HETATM 
                 1770 
                 O 
                 HOH 
                   
                 6 
                 −8.057 
                 56.130 
                 33.388 
                 1.00 
                 37.02 
                 O 
               
               
                 HETATM 
                 1771 
                 O 
                 HOH 
                   
                 7 
                 −17.902 
                 51.226 
                 29.662 
                 1.00 
                 34.89 
                 O 
               
               
                 HETATM 
                 1772 
                 O 
                 HOH 
                   
                 8 
                 −12.752 
                 39.758 
                 34.757 
                 1.00 
                 28.89 
                 O 
               
               
                 HETATM 
                 1773 
                 O 
                 HOH 
                   
                 9 
                 −8.631 
                 55.669 
                 45.707 
                 1.00 
                 41.15 
                 O 
               
               
                 HETATM 
                 1774 
                 O 
                 HOH 
                   
                 10 
                 13.151 
                 25.246 
                 35.468 
                 1.00 
                 53.94 
                 O 
               
               
                 HETATM 
                 1775 
                 O 
                 HOH 
                   
                 11 
                 −20.020 
                 44.397 
                 48.086 
                 1.00 
                 34.26 
                 O 
               
               
                 HETATM 
                 1776 
                 O 
                 HOH 
                   
                 12 
                 −2.478 
                 40.620 
                 21.138 
                 1.00 
                 31.91 
                 O 
               
               
                 HETATM 
                 1777 
                 O 
                 HOH 
                   
                 13 
                 6.817 
                 45.918 
                 20.781 
                 1.00 
                 34.15 
                 O 
               
               
                 HETATM 
                 1778 
                 O 
                 HOH 
                   
                 14 
                 −10.720 
                 41.048 
                 19.742 
                 1.00 
                 29.28 
                 O 
               
               
                 HETATM 
                 1779 
                 O 
                 HOH 
                   
                 15 
                 5.136 
                 27.001 
                 33.682 
                 1.00 
                 34.01 
                 O 
               
               
                 HETATM 
                 1780 
                 O 
                 HOH 
                   
                 16 
                 −8.752 
                 34.083 
                 17.394 
                 1.00 
                 32.30 
                 O 
               
               
                 HETATM 
                 1781 
                 O 
                 HOH 
                   
                 17 
                 6.370 
                 25.987 
                 36.062 
                 1.00 
                 46.53 
                 O 
               
               
                 HETATM 
                 1782 
                 O 
                 HOH 
                   
                 18 
                 −2.835 
                 44.271 
                 34.848 
                 1.00 
                 46.44 
                 O 
               
               
                 HETATM 
                 1783 
                 O 
                 HOH 
                   
                 19 
                 12.329 
                 46.062 
                 32.976 
                 1.00 
                 41.31 
                 O 
               
               
                 HETATM 
                 1784 
                 O 
                 HOH 
                   
                 20 
                 7.260 
                 23.068 
                 29.837 
                 1.00 
                 38.09 
                 O 
               
               
                 HETATM 
                 1785 
                 O 
                 HOH 
                   
                 21 
                 9.196 
                 26.047 
                 36.490 
                 1.00 
                 47.12 
                 O 
               
               
                 HETATM 
                 1786 
                 O 
                 HOH 
                   
                 22 
                 −15.395 
                 35.722 
                 34.664 
                 1.00 
                 41.20 
                 O 
               
               
                 HETATM 
                 1787 
                 O 
                 HOH 
                   
                 23 
                 −0.653 
                 40.172 
                 17.501 
                 1.00 
                 37.13 
                 O 
               
               
                 HETATM 
                 1788 
                 O 
                 HOH 
                   
                 24 
                 −5.694 
                 32.125 
                 32.899 
                 1.00 
                 44.72 
                 O 
               
               
                 HETATM 
                 1789 
                 O 
                 HOH 
                   
                 25 
                 −12.701 
                 48.162 
                 29.678 
                 1.00 
                 45.56 
                 O 
               
               
                 HETATM 
                 1790 
                 O 
                 HOH 
                   
                 26 
                 −2.261 
                 42.933 
                 22.850 
                 1.00 
                 45.39 
                 O 
               
               
                 HETATM 
                 1791 
                 O 
                 HOH 
                   
                 27 
                 −1.180 
                 27.915 
                 31.872 
                 1.00 
                 44.10 
                 O 
               
               
                 HETATM 
                 1792 
                 O 
                 HOH 
                   
                 28 
                 −11.917 
                 36.985 
                 27.031 
                 1.00 
                 46.78 
                 O 
               
               
                 HETATM 
                 1793 
                 O 
                 HOH 
                   
                 29 
                 −22.053 
                 53.082 
                 44.383 
                 1.00 
                 57.53 
                 O 
               
               
                 HETATM 
                 1794 
                 O 
                 HOH 
                   
                 30 
                 8.896 
                 28.691 
                 22.223 
                 1.00 
                 36.55 
                 O 
               
               
                 HETATM 
                 1795 
                 O 
                 HOH 
                   
                 31 
                 11.139 
                 27.149 
                 35.370 
                 1.00 
                 40.73 
                 O 
               
               
                 HETATM 
                 1796 
                 O 
                 HOH 
                   
                 32 
                 16.384 
                 43.712 
                 24.651 
                 1.00 
                 35.03 
                 O 
               
               
                 HETATM 
                 1797 
                 O 
                 HOH 
                   
                 33 
                 −1.673 
                 32.550 
                 31.734 
                 1.00 
                 53.95 
                 O 
               
               
                 HETATM 
                 1798 
                 O 
                 HOH 
                   
                 34 
                 −0.534 
                 41.750 
                 25.977 
                 1.00 
                 26.15 
                 O 
               
               
                 HETATM 
                 1799 
                 O 
                 HOH 
                   
                 35 
                 −25.707 
                 49.370 
                 30.021 
                 1.00 
                 55.33 
                 O 
               
               
                 HETATM 
                 1800 
                 O 
                 HOH 
                   
                 36 
                 7.758 
                 32.565 
                 39.383 
                 1.00 
                 44.45 
                 O 
               
               
                 HETATM 
                 1801 
                 O 
                 HOH 
                   
                 37 
                 −9.122 
                 42.014 
                 49.736 
                 1.00 
                 40.33 
                 O 
               
               
                 HETATM 
                 1802 
                 O 
                 HOH 
                   
                 38 
                 −7.490 
                 26.790 
                 15.325 
                 1.00 
                 45.84 
                 O 
               
               
                 HETATM 
                 1803 
                 O 
                 HOH 
                   
                 39 
                 −15.093 
                 35.774 
                 21.413 
                 1.00 
                 58.89 
                 O 
               
               
                 HETATM 
                 1804 
                 O 
                 HOH 
                   
                 40 
                 −13.787 
                 53.303 
                 31.695 
                 1.00 
                 48.06 
                 O 
               
               
                 HETATM 
                 1805 
                 O 
                 HOH 
                   
                 41 
                 −26.881 
                 36.152 
                 44.074 
                 1.00 
                 45.18 
                 O 
               
               
                 HETATM 
                 1806 
                 O 
                 HOH 
                   
                 42 
                 −31.999 
                 47.971 
                 25.667 
                 1.00 
                 45.30 
                 O 
               
               
                 HETATM 
                 1807 
                 O 
                 HOH 
                   
                 43 
                 −2.869 
                 45.128 
                 37.465 
                 1.00 
                 51.46 
                 O 
               
               
                 HETATM 
                 1808 
                 O 
                 HOH 
                   
                 44 
                 −11.522 
                 33.793 
                 24.204 
                 1.00 
                 48.27 
                 O 
               
               
                 HETATM 
                 1809 
                 O 
                 HOH 
                   
                 45 
                 0.741 
                 49.839 
                 30.801 
                 1.00 
                 64.89 
                 O 
               
               
                 HETATM 
                 1810 
                 O 
                 HOH 
                   
                 46 
                 3.995 
                 28.946 
                 34.996 
                 1.00 
                 46.15 
                 O 
               
               
                 HETATM 
                 1811 
                 O 
                 HOH 
                   
                 47 
                 1.716 
                 24.921 
                 22.872 
                 1.00 
                 50.97 
                 O 
               
               
                 HETATM 
                 1812 
                 O 
                 HOH 
                   
                 48 
                 −14.528 
                 49.967 
                 29.489 
                 1.00 
                 32.12 
                 O 
               
               
                 HETATM 
                 1813 
                 O 
                 HOH 
                   
                 49 
                 −3.397 
                 54.514 
                 35.732 
                 1.00 
                 75.25 
                 O 
               
               
                 HETATM 
                 1814 
                 O 
                 HOH 
                   
                 50 
                 7.350 
                 36.188 
                 38.637 
                 1.00 
                 44.58 
                 O 
               
               
                 HETATM 
                 1815 
                 O 
                 HOH 
                   
                 51 
                 −11.258 
                 36.392 
                 32.460 
                 1.00 
                 64.14 
                 O 
               
               
                 HETATM 
                 1816 
                 O 
                 HOH 
                   
                 52 
                 −5.919 
                 28.213 
                 33.670 
                 1.00 
                 53.43 
                 O 
               
               
                 HETATM 
                 1817 
                 O 
                 HOH 
                   
                 53 
                 −29.035 
                 35.826 
                 45.961 
                 1.00 
                 52.26 
                 O 
               
               
                 HETATM 
                 1818 
                 O 
                 HOH 
                   
                 54 
                 0.619 
                 37.563 
                 35.722 
                 1.00 
                 36.13 
                 O 
               
               
                 HETATM 
                 1819 
                 O 
                 HOH 
                   
                 55 
                 17.630 
                 44.800 
                 22.683 
                 0.50 
                 19.47 
                 O 
               
               
                 HETATM 
                 1820 
                 O 
                 HOH 
                   
                 56 
                 10.658 
                 48.432 
                 27.654 
                 1.00 
                 57.06 
                 O 
               
               
                 HETATM 
                 1821 
                 O 
                 HOH 
                   
                 57 
                 12.883 
                 47.166 
                 27.270 
                 1.00 
                 47.82 
                 O 
               
               
                 HETATM 
                 1822 
                 O 
                 HOH 
                   
                 58 
                 −10.204 
                 43.420 
                 20.875 
                 1.00 
                 54.59 
                 O 
               
               
                 HETATM 
                 1823 
                 O 
                 HOH 
                   
                 59 
                 −17.821 
                 36.045 
                 26.779 
                 1.00 
                 48.73 
                 O 
               
               
                 HETATM 
                 1824 
                 O 
                 HOH 
                   
                 60 
                 −33.575 
                 46.023 
                 24.555 
                 0.50 
                 57.14 
                 O 
               
               
                 HETATM 
                 1825 
                 O 
                 HOH 
                   
                 61 
                 −9.513 
                 32.401 
                 30.497 
                 1.00 
                 49.08 
                 O 
               
               
                 HETATM 
                 1826 
                 O 
                 HOH 
                   
                 62 
                 −22.035 
                 32.931 
                 35.329 
                 1.00 
                 53.74 
                 O 
               
               
                 HETATM 
                 1827 
                 O 
                 HOH 
                   
                 63 
                 −26.276 
                 37.813 
                 25.169 
                 1.00 
                 43.04 
                 O 
               
               
                 HETATM 
                 1828 
                 O 
                 HOH 
                   
                 64 
                 6.554 
                 36.026 
                 15.888 
                 1.00 
                 49.25 
                 O 
               
               
                 HETATM 
                 1829 
                 O 
                 HOH 
                   
                 65 
                 −14.945 
                 36.915 
                 28.030 
                 1.00 
                 55.95 
                 O 
               
               
                 HETATM 
                 1830 
                 O 
                 HOH 
                   
                 66 
                 11.110 
                 41.062 
                 21.523 
                 1.00 
                 47.74 
                 O 
               
               
                 HETATM 
                 1831 
                 O 
                 HOH 
                   
                 67 
                 3.797 
                 45.196 
                 35.142 
                 1.00 
                 49.98 
                 O 
               
               
                 HETATM 
                 1832 
                 O 
                 HOH 
                   
                 68 
                 −7.103 
                 48.353 
                 46.125 
                 1.00 
                 63.67 
                 O 
               
               
                 HETATM 
                 1833 
                 O 
                 HOH 
                   
                 69 
                 −26.227 
                 28.904 
                 36.563 
                 1.00 
                 67.40 
                 O 
               
               
                 HETATM 
                 1834 
                 O 
                 HOH 
                   
                 70 
                 −21.008 
                 37.879 
                 44.773 
                 1.00 
                 38.83 
                 O 
               
               
                 HETATM 
                 1835 
                 O 
                 HOH 
                   
                 71 
                 −8.401 
                 39.932 
                 48.004 
                 1.00 
                 59.32 
                 O 
               
               
                 HETATM 
                 1836 
                 O 
                 HOH 
                   
                 72 
                 −7.060 
                 55.805 
                 37.587 
                 1.00 
                 36.59 
                 O 
               
               
                 HETATM 
                 1837 
                 O 
                 HOH 
                   
                 73 
                 2.254 
                 43.055 
                 28.212 
                 1.00 
                 37.43 
                 O 
               
               
                 HETATM 
                 1838 
                 O 
                 HOH 
                   
                 74 
                 −15.957 
                 41.782 
                 22.346 
                 1.00 
                 52.21 
                 O 
               
               
                 HETATM 
                 1839 
                 O 
                 HOH 
                   
                 75 
                 −30.836 
                 46.157 
                 27.026 
                 1.00 
                 41.75 
                 O 
               
               
                 HETATM 
                 1840 
                 O 
                 HOH 
                   
                 76 
                 0.243 
                 30.979 
                 36.033 
                 1.00 
                 54.97 
                 O 
               
               
                 HETATM 
                 1841 
                 O 
                 HOH 
                   
                 77 
                 0.247 
                 38.128 
                 13.711 
                 1.00 
                 71.28 
                 O 
               
               
                 HETATM 
                 1842 
                 O 
                 HOH 
                   
                 78 
                 5.404 
                 42.527 
                 18.589 
                 1.00 
                 45.84 
                 O 
               
               
                 HETATM 
                 1843 
                 O 
                 HOH 
                   
                 79 
                 −10.308 
                 34.296 
                 26.893 
                 1.00 
                 53.88 
                 O 
               
               
                 HETATM 
                 1844 
                 O 
                 HOH 
                   
                 80 
                 −6.664 
                 53.994 
                 39.217 
                 1.00 
                 42.65 
                 O 
               
               
                 HETATM 
                 1845 
                 O 
                 HOH 
                   
                 81 
                 −5.087 
                 41.168 
                 17.628 
                 1.00 
                 50.54 
                 O 
               
               
                 HETATM 
                 1846 
                 O 
                 HOH 
                   
                 82 
                 −22.020 
                 51.083 
                 47.018 
                 1.00 
                 63.47 
                 O 
               
               
                 HETATM 
                 1847 
                 O 
                 HOH 
                   
                 83 
                 −5.142 
                 35.512 
                 13.750 
                 1.00 
                 49.89 
                 O 
               
               
                 HETATM 
                 1848 
                 O 
                 HOH 
                   
                 84 
                 10.297 
                 24.970 
                 22.199 
                 1.00 
                 54.97 
                 O 
               
               
                 HETATM 
                 1849 
                 O 
                 HOH 
                   
                 85 
                 −3.029 
                 49.876 
                 30.159 
                 1.00 
                 67.18 
                 O 
               
               
                 HETATM 
                 1850 
                 O 
                 HOH 
                   
                 86 
                 −15.585 
                 36.101 
                 16.657 
                 1.00 
                 62.06 
                 O 
               
               
                 HETATM 
                 1851 
                 O 
                 HOH 
                   
                 87 
                 −31.964 
                 47.184 
                 41.589 
                 1.00 
                 51.59 
                 O 
               
               
                 HETATM 
                 1852 
                 O 
                 HOH 
                   
                 88 
                 −32.818 
                 49.890 
                 32.367 
                 1.00 
                 49.76 
                 O 
               
               
                 HETATM 
                 1853 
                 O 
                 HOH 
                   
                 89 
                 15.015 
                 43.317 
                 14.283 
                 1.00 
                 57.75 
                 O 
               
               
                 HETATM 
                 1854 
                 O 
                 HOH 
                   
                 90 
                 −21.719 
                 31.012 
                 37.760 
                 1.00 
                 72.98 
                 O 
               
               
                 HETATM 
                 1855 
                 O 
                 HOH 
                   
                 91 
                 −32.335 
                 46.485 
                 39.125 
                 1.00 
                 68.68 
                 O 
               
               
                 HETATM 
                 1856 
                 O 
                 HOH 
                   
                 92 
                 0.069 
                 40.947 
                 11.925 
                 1.00 
                 58.64 
                 O 
               
               
                 HETATM 
                 1857 
                 O 
                 HOH 
                   
                 93 
                 15.333 
                 44.973 
                 29.047 
                 1.00 
                 58.06 
                 O 
               
               
                 HETATM 
                 1858 
                 O 
                 HOH 
                   
                 94 
                 4.602 
                 29.902 
                 37.670 
                 1.00 
                 58.96 
                 O 
               
               
                 HETATM 
                 1859 
                 O 
                 HOH 
                   
                 95 
                 8.321 
                 46.401 
                 37.041 
                 1.00 
                 79.54 
                 O 
               
               
                 HETATM 
                 1860 
                 O 
                 HOH 
                   
                 96 
                 16.844 
                 44.827 
                 27.035 
                 1.00 
                 53.07 
                 O 
               
               
                 HETATM 
                 1861 
                 O 
                 HOH 
                   
                 97 
                 8.643 
                 34.976 
                 14.645 
                 1.00 
                 61.34 
                 O 
               
               
                 HETATM 
                 1862 
                 O 
                 HOH 
                   
                 98 
                 15.081 
                 30.053 
                 40.624 
                 1.00 
                 58.50 
                 O 
               
               
                 HETATM 
                 1863 
                 O 
                 HOH 
                   
                 99 
                 −29.173 
                 38.671 
                 49.216 
                 1.00 
                 77.24 
                 O 
               
               
                 HETATM 
                 1864 
                 O 
                 HOH 
                   
                 100 
                 −34.367 
                 30.230 
                 40.676 
                 1.00 
                 87.45 
                 O 
               
               
                 HETATM 
                 1865 
                 O 
                 HOH 
                   
                 101 
                 13.024 
                 40.796 
                 42.706 
                 1.00 
                 66.67 
                 O 
               
               
                 HETATM 
                 1866 
                 O 
                 HOH 
                   
                 102 
                 −24.986 
                 34.816 
                 45.384 
                 1.00 
                 54.92 
                 O 
               
               
                 HETATM 
                 1867 
                 O 
                 HOH 
                   
                 103 
                 3.596 
                 42.385 
                 20.233 
                 1.00 
                 37.71 
                 O 
               
               
                 HETATM 
                 1868 
                 O 
                 HOH 
                   
                 104 
                 −23.493 
                 49.334 
                 44.992 
                 1.00 
                 44.76 
                 O 
               
               
                 HETATM 
                 1869 
                 O 
                 HOH 
                   
                 105 
                 −22.358 
                 44.809 
                 26.526 
                 1.00 
                 68.31 
                 O 
               
               
                 HETATM 
                 1870 
                 O 
                 HOH 
                   
                 106 
                 −17.446 
                 32.842 
                 37.601 
                 1.00 
                 65.30 
                 O 
               
               
                 HETATM 
                 1871 
                 O 
                 HOH 
                   
                 107 
                 −22.821 
                 52.720 
                 29.818 
                 1.00 
                 71.05 
                 O 
               
               
                 HETATM 
                 1872 
                 O 
                 HOH 
                   
                 108 
                 −8.572 
                 26.810 
                 23.048 
                 1.00 
                 81.52 
                 O 
               
               
                 HETATM 
                 1873 
                 O 
                 HOH 
                   
                 109 
                 4.419 
                 46.453 
                 27.301 
                 1.00 
                 63.98 
                 O 
               
               
                 HETATM 
                 1874 
                 O 
                 HOH 
                   
                 110 
                 23.410 
                 26.310 
                 29.884 
                 1.00 
                 72.88 
                 O 
               
               
                 HETATM 
                 1875 
                 O 
                 HOH 
                   
                 111 
                 9.649 
                 42.598 
                 19.288 
                 1.00 
                 58.11 
                 O 
               
               
                 HETATM 
                 1876 
                 O 
                 HOH 
                   
                 112 
                 −15.692 
                 35.133 
                 41.149 
                 1.00 
                 63.89 
                 O 
               
               
                 HETATM 
                 1877 
                 O 
                 HOH 
                   
                 113 
                 −26.983 
                 54.986 
                 35.486 
                 1.00 
                 87.73 
                 O 
               
               
                 HETATM 
                 1878 
                 O 
                 HOH 
                   
                 114 
                 −24.223 
                 45.040 
                 24.854 
                 0.50 
                 34.45 
                 O 
               
               
                 HETATM 
                 1879 
                 O 
                 HOH 
                   
                 115 
                 −5.537 
                 55.893 
                 46.218 
                 1.00 
                 46.13 
                 O 
               
               
                 HETATM 
                 1880 
                 O 
                 HOH 
                   
                 116 
                 −22.125 
                 35.353 
                 45.825 
                 1.00 
                 54.11 
                 O 
               
               
                 HETATM 
                 1881 
                 O 
                 HOH 
                   
                 117 
                 −4.303 
                 38.534 
                 32.607 
                 1.00 
                 65.18 
                 O 
               
               
                 HETATM 
                 1882 
                 O 
                 HOH 
                   
                 118 
                 −24.701 
                 49.655 
                 42.592 
                 1.00 
                 44.09 
                 O 
               
               
                 HETATM 
                 1883 
                 O 
                 HOH 
                   
                 119 
                 −6.344 
                 37.080 
                 33.536 
                 1.00 
                 56.70 
                 O 
               
               
                 HETATM 
                 1884 
                 O 
                 HOH 
                   
                 120 
                 −16.010 
                 39.018 
                 19.540 
                 1.00 
                 47.12 
                 O 
               
               
                 HETATM 
                 1885 
                 O 
                 HOH 
                   
                 121 
                 −27.762 
                 40.565 
                 50.157 
                 1.00 
                 65.48 
                 O 
               
               
                 HETATM 
                 1886 
                 O 
                 HOH 
                   
                 122 
                 −38.022 
                 50.782 
                 33.568 
                 1.00 
                 73.64 
                 O 
               
               
                 HETATM 
                 1887 
                 O 
                 HOH 
                   
                 123 
                 −1.625 
                 52.480 
                 34.057 
                 1.00 
                 74.28 
                 O 
               
               
                 HETATM 
                 1888 
                 O 
                 HOH 
                   
                 124 
                 −21.663 
                 35.323 
                 48.955 
                 1.00 
                 65.30 
                 O 
               
               
                 HETATM 
                 1889 
                 O 
                 HOH 
                   
                 125 
                 −6.821 
                 48.170 
                 48.922 
                 1.00 
                 73.82 
                 O 
               
               
                 HETATM 
                 1890 
                 O 
                 HOH 
                   
                 126 
                 −13.845 
                 39.478 
                 40.011 
                 1.00 
                 60.84 
                 O 
               
               
                 HETATM 
                 1891 
                 O 
                 HOH 
                   
                 127 
                 6.927 
                 41.038 
                 17.007 
                 1.00 
                 68.49 
                 O 
               
               
                 HETATM 
                 1892 
                 O 
                 HOH 
                   
                 128 
                 −1.966 
                 52.839 
                 44.944 
                 1.00 
                 87.28 
                 O 
               
               
                 HETATM 
                 1893 
                 O 
                 HOH 
                   
                 129 
                 −7.847 
                 23.965 
                 22.241 
                 1.00 
                 58.88 
                 O 
               
               
                 HETATM 
                 1894 
                 O 
                 HOH 
                   
                 130 
                 −3.206 
                 50.463 
                 45.678 
                 1.00 
                 81.46 
                 O 
               
               
                 HETATM 
                 1895 
                 O 
                 HOH 
                   
                 131 
                 −20.734 
                 33.268 
                 29.612 
                 1.00 
                 65.97 
                 O 
               
               
                 HETATM 
                 1896 
                 O 
                 HOH 
                   
                 132 
                 −3.239 
                 43.318 
                 28.931 
                 1.00 
                 60.99 
                 O 
               
               
                 HETATM 
                 1897 
                 O 
                 HOH 
                   
                 133 
                 −40.181 
                 49.870 
                 32.489 
                 1.00 
                 76.03 
                 O 
               
               
                 HETATM 
                 1898 
                 O 
                 HOH 
                   
                 134 
                 −13.701 
                 39.202 
                 25.401 
                 1.00 
                 64.57 
                 O 
               
               
                 HETATM 
                 1899 
                 O 
                 HOH 
                   
                 135 
                 −28.332 
                 46.062 
                 26.011 
                 1.00 
                 50.13 
                 O 
               
               
                 HETATM 
                 1900 
                 O 
                 HOH 
                   
                 136 
                 −14.074 
                 29.707 
                 23.160 
                 1.00 
                 83.09 
                 O 
               
               
                 HETATM 
                 1901 
                 O 
                 HOH 
                   
                 137 
                 −4.377 
                 47.534 
                 39.617 
                 1.00 
                 61.39 
                 O 
               
               
                 HETATM 
                 1902 
                 O 
                 HOH 
                   
                 138 
                 −14.674 
                 39.434 
                 43.947 
                 1.00 
                 61.24 
                 O 
               
               
                 HETATM 
                 1903 
                 O 
                 HOH 
                   
                 139 
                 −28.314 
                 52.582 
                 28.145 
                 1.00 
                 60.30 
                 O 
               
               
                 HETATM 
                 1904 
                 O 
                 HOH 
                   
                 140 
                 −18.687 
                 49.110 
                 26.208 
                 1.00 
                 54.09 
                 O 
               
               
                 HETATM 
                 1905 
                 O 
                 HOH 
                   
                 141 
                 −15.685 
                 39.305 
                 23.521 
                 1.00 
                 65.29 
                 O 
               
               
                 HETATM 
                 1906 
                 O 
                 HOH 
                   
                 142 
                 −33.598 
                 49.435 
                 41.980 
                 1.00 
                 83.02 
                 O 
               
               
                 HETATM 
                 1907 
                 O 
                 HOH 
                   
                 143 
                 −38.646 
                 26.243 
                 29.939 
                 1.00 
                 92.35 
                 O 
               
               
                 HETATM 
                 1908 
                 O 
                 HOH 
                   
                 144 
                 −20.693 
                 42.535 
                 25.536 
                 1.00 
                 61.60 
                 O 
               
               
                 HETATM 
                 1909 
                 O 
                 HOH 
                   
                 145 
                 −21.614 
                 55.217 
                 35.058 
                 1.00 
                 54.35 
                 O 
               
               
                 HETATM 
                 1910 
                 O 
                 HOH 
                   
                 146 
                 20.340 
                 33.477 
                 28.720 
                 1.00 
                 57.13 
                 O 
               
               
                 HETATM 
                 1911 
                 O 
                 HOH 
                   
                 147 
                 −14.937 
                 35.262 
                 30.134 
                 1.00 
                 80.62 
                 O 
               
               
                 HETATM 
                 1912 
                 O 
                 HOH 
                   
                 148 
                 −30.357 
                 41.475 
                 51.126 
                 1.00 
                 55.90 
                 O 
               
               
                 HETATM 
                 1913 
                 O 
                 HOH 
                   
                 149 
                 −7.343 
                 19.838 
                 22.057 
                 1.00 
                 58.33 
                 O 
               
               
                 HETATM 
                 1914 
                 O 
                 HOH 
                   
                 150 
                 10.363 
                 41.633 
                 41.955 
                 1.00 
                 80.85 
                 O 
               
               
                 HETATM 
                 1915 
                 O 
                 HOH 
                   
                 151 
                 −28.516 
                 56.353 
                 29.977 
                 1.00 
                 67.64 
                 O 
               
               
                 HETATM 
                 1916 
                 O 
                 HOH 
                   
                 152 
                 0.289 
                 49.396 
                 28.161 
                 1.00 
                 82.96 
                 O 
               
               
                 HETATM 
                 1917 
                 O 
                 HOH 
                   
                 153 
                 −5.197 
                 44.204 
                 39.334 
                 1.00 
                 57.87 
                 O 
               
               
                 HETATM 
                 1918 
                 O 
                 HOH 
                   
                 154 
                 −1.892 
                 29.898 
                 33.032 
                 1.00 
                 81.31 
                 O 
               
               
                 HETATM 
                 1919 
                 O 
                 HOH 
                   
                 155 
                 −6.354 
                 40.306 
                 40.369 
                 1.00 
                 64.96 
                 O 
               
               
                 HETATM 
                 1920 
                 O 
                 HOH 
                   
                 156 
                 −35.505 
                 42.575 
                 36.471 
                 1.00 
                 61.68 
                 O 
               
               
                 HETATM 
                 1921 
                 O 
                 HOH 
                   
                 157 
                 −11.766 
                 41.049 
                 25.763 
                 1.00 
                 67.31 
                 O 
               
               
                 HETATM 
                 1922 
                 O 
                 HOH 
                   
                 158 
                 24.549 
                 41.790 
                 44.796 
                 1.00 
                 94.46 
                 O 
               
               
                 HETATM 
                 1923 
                 O 
                 HOH 
                   
                 159 
                 21.990 
                 42.199 
                 17.194 
                 1.00 
                 71.97 
                 O 
               
               
                 HETATM 
                 1924 
                 O 
                 HOH 
                   
                 160 
                 −21.524 
                 48.235 
                 45.392 
                 1.00 
                 38.60 
                 O 
               
               
                 HETATM 
                 1925 
                 O 
                 HOH 
                   
                 161 
                 −8.232 
                 11.927 
                 11.548 
                 1.00 
                 77.25 
                 O 
               
               
                 HETATM 
                 1926 
                 O 
                 HOH 
                   
                 162 
                 18.993 
                 45.611 
                 24.121 
                 0.50 
                 48.25 
                 O 
               
               
                 HETATM 
                 1927 
                 O 
                 HOH 
                   
                 163 
                 −3.423 
                 33.004 
                 33.502 
                 1.00 
                 46.87 
                 O 
               
               
                 HETATM 
                 1928 
                 O 
                 HOH 
                   
                 164 
                 −12.067 
                 38.301 
                 39.035 
                 1.00 
                 66.32 
                 O 
               
               
                 HETATM 
                 1929 
                 O 
                 HOH 
                   
                 165 
                 −19.240 
                 57.453 
                 34.326 
                 1.00 
                 62.19 
                 O 
               
               
                 HETATM 
                 1930 
                 O 
                 HOH 
                   
                 166 
                 −15.369 
                 57.421 
                 34.820 
                 1.00 
                 56.53 
                 O 
               
               
                 HETATM 
                 1931 
                 O 
                 HOH 
                   
                 167 
                 −12.383 
                 46.024 
                 24.556 
                 0.50 
                 107.60 
                 O 
               
               
                 HETATM 
                 1932 
                 O 
                 HOH 
                   
                 168 
                 9.582 
                 23.067 
                 37.226 
                 1.00 
                 68.06 
                 O 
               
               
                 HETATM 
                 1933 
                 O 
                 HOH 
                   
                 169 
                 13.979 
                 44.653 
                 23.993 
                 1.00 
                 59.28 
                 O 
               
               
                 HETATM 
                 1934 
                 O 
                 HOH 
                   
                 170 
                 7.020 
                 20.778 
                 33.662 
                 1.00 
                 55.70 
                 O 
               
               
                 HETATM 
                 1935 
                 O 
                 HOH 
                   
                 171 
                 −6.632 
                 18.659 
                 6.953 
                 1.00 
                 57.16 
                 O 
               
               
                 HETATM 
                 1936 
                 O 
                 HOH 
                   
                 172 
                 −40.140 
                 40.092 
                 30.271 
                 1.00 
                 83.42 
                 O 
               
               
                 HETATM 
                 1937 
                 O 
                 HOH 
                   
                 173 
                 −25.859 
                 49.080 
                 46.581 
                 1.00 
                 72.05 
                 O 
               
               
                 HETATM 
                 1938 
                 O 
                 HOH 
                   
                 174 
                 11.903 
                 33.915 
                 42.794 
                 1.00 
                 62.47 
                 O 
               
               
                 HETATM 
                 1939 
                 O 
                 HOH 
                   
                 175 
                 4.443 
                 37.316 
                 14.253 
                 1.00 
                 54.63 
                 O 
               
               
                 HETATM 
                 1940 
                 O 
                 HOH 
                   
                 176 
                 −23.109 
                 32.164 
                 39.230 
                 1.00 
                 58.67 
                 O 
               
               
                 HETATM 
                 1941 
                 O 
                 HOH 
                   
                 177 
                 16.134 
                 23.618 
                 36.264 
                 1.00 
                 72.38 
                 O 
               
               
                 HETATM 
                 1942 
                 O 
                 HOH 
                   
                 178 
                 6.026 
                 27.145 
                 18.930 
                 1.00 
                 77.90 
                 O 
               
               
                 HETATM 
                 1943 
                 O 
                 HOH 
                   
                 179 
                 −9.688 
                 38.334 
                 40.737 
                 1.00 
                 61.53 
                 O 
               
               
                 HETATM 
                 1944 
                 O 
                 HOH 
                   
                 180 
                 −22.696 
                 49.211 
                 25.803 
                 1.00 
                 65.15 
                 O 
               
               
                 HETATM 
                 1945 
                 O 
                 HOH 
                   
                 181 
                 −30.846 
                 54.695 
                 38.649 
                 1.00 
                 60.05 
                 O 
               
               
                 HETATM 
                 1946 
                 O 
                 HOH 
                   
                 182 
                 −19.785 
                 63.595 
                 61.341 
                 1.00 
                 89.42 
                 O 
               
               
                 HETATM 
                 1947 
                 O 
                 HOH 
                   
                 183 
                 13.553 
                 19.460 
                 30.403 
                 1.00 
                 79.86 
                 O 
               
               
                 HETATM 
                 1948 
                 O 
                 HOH 
                   
                 184 
                 4.577 
                 49.300 
                 32.750 
                 1.00 
                 64.93 
                 O 
               
               
                 HETATM 
                 1949 
                 O 
                 HOH 
                   
                 185 
                 1.307 
                 28.028 
                 35.709 
                 1.00 
                 65.55 
                 O 
               
               
                 HETATM 
                 1950 
                 O 
                 HOH 
                   
                 186 
                 −4.209 
                 8.016 
                 10.568 
                 1.00 
                 76.31 
                 O 
               
               
                 HETATM 
                 1951 
                 O 
                 HOH 
                   
                 187 
                 −7.990 
                 57.550 
                 66.176 
                 1.00 
                 84.96 
                 O 
               
               
                 HETATM 
                 1952 
                 O 
                 HOH 
                   
                 188 
                 −11.759 
                 70.211 
                 53.014 
                 1.00 
                 68.57 
                 O 
               
               
                 HETATM 
                 1953 
                 O 
                 HOH 
                   
                 189 
                 −15.093 
                 31.958 
                 14.184 
                 1.00 
                 77.18 
                 O 
               
               
                 HETATM 
                 1954 
                 O 
                 HOH 
                   
                 190 
                 −23.127 
                 28.574 
                 35.811 
                 1.00 
                 84.33 
                 O 
               
               
                 HETATM 
                 1955 
                 O 
                 HOH 
                   
                 191 
                 −12.687 
                 42.314 
                 29.442 
                 1.00 
                 56.81 
                 O 
               
               
                 HETATM 
                 1956 
                 O 
                 HOH 
                   
                 192 
                 −3.637 
                 39.435 
                 35.154 
                 1.00 
                 57.23 
                 O 
               
               
                 HETATM 
                 1957 
                 O 
                 HOH 
                   
                 193 
                 13.948 
                 40.445 
                 14.939 
                 1.00 
                 74.56 
                 O 
               
               
                 HETATM 
                 1958 
                 O 
                 HOH 
                   
                 194 
                 −24.452 
                 59.655 
                 41.252 
                 1.00 
                 95.39 
                 O 
               
               
                 HETATM 
                 1959 
                 O 
                 HOH 
                   
                 195 
                 −35.101 
                 41.960 
                 42.068 
                 1.00 
                 74.52 
                 O 
               
               
                 HETATM 
                 1960 
                 O 
                 HOH 
                   
                 196 
                 −21.224 
                 54.576 
                 30.539 
                 1.00 
                 93.57 
                 O 
               
               
                 HETATM 
                 1961 
                 O 
                 HOH 
                   
                 197 
                 −6.699 
                 59.049 
                 64.130 
                 1.00 
                 90.32 
                 O 
               
               
                 HETATM 
                 1962 
                 O 
                 HOH 
                   
                 198 
                 −12.852 
                 44.654 
                 28.015 
                 1.00 
                 65.04 
                 O 
               
               
                 HETATM 
                 1963 
                 O 
                 HOH 
                   
                 199 
                 −35.270 
                 35.608 
                 25.394 
                 1.00 
                 91.63 
                 O 
               
               
                 HETATM 
                 1964 
                 O 
                 HOH 
                   
                 200 
                 −27.591 
                 55.725 
                 41.984 
                 1.00 
                 78.78 
                 O 
               
               
                 HETATM 
                 1965 
                 O 
                 HOH 
                   
                 201 
                 −2.304 
                 42.014 
                 35.867 
                 1.00 
                 60.76 
                 O 
               
               
                 HETATM 
                 1966 
                 O 
                 HOH 
                   
                 202 
                 −7.873 
                 38.784 
                 35.085 
                 1.00 
                 60.96 
                 O 
               
               
                 HETATM 
                 1967 
                 O 
                 HOH 
                   
                 203 
                 1.437 
                 49.049 
                 33.215 
                 1.00 
                 91.38 
                 O 
               
               
                 HETATM 
                 1968 
                 O 
                 HOH 
                   
                 204 
                 9.087 
                 29.635 
                 19.856 
                 1.00 
                 44.92 
                 O 
               
               
                 HETATM 
                 1969 
                 O 
                 HOH 
                   
                 205 
                 4.632 
                 27.259 
                 38.041 
                 1.00 
                 73.19 
                 O 
               
               
                 HETATM 
                 1970 
                 O 
                 HOH 
                   
                 206 
                 −6.312 
                 40.374 
                 36.109 
                 1.00 
                 54.83 
                 O 
               
               
                 HETATM 
                 1971 
                 O 
                 HOH 
                   
                 207 
                 16.399 
                 32.078 
                 23.121 
                 1.00 
                 87.24 
                 O 
               
               
                 HETATM 
                 1972 
                 O 
                 HOH 
                   
                 208 
                 15.627 
                 25.767 
                 26.517 
                 1.00 
                 68.61 
                 O 
               
               
                 HETATM 
                 1973 
                 O 
                 HOH 
                   
                 209 
                 22.940 
                 40.400 
                 23.162 
                 1.00 
                 66.19 
                 O 
               
               
                 HETATM 
                 1974 
                 O 
                 HOH 
                   
                 210 
                 9.044 
                 42.885 
                 39.388 
                 1.00 
                 52.86 
                 O 
               
               
                 HETATM 
                 1975 
                 O 
                 HOH 
                   
                 211 
                 2.686 
                 10.774 
                 3.076 
                 1.00 
                 86.36 
                 O 
               
               
                 HETATM 
                 1976 
                 O 
                 HOH 
                   
                 212 
                 −21.576 
                 32.568 
                 32.413 
                 1.00 
                 63.08 
                 O 
               
               
                 HETATM 
                 1977 
                 O 
                 HOH 
                   
                 213 
                 12.714 
                 21.953 
                 33.512 
                 1.00 
                 69.19 
                 O 
               
               
                 HETATM 
                 1978 
                 O 
                 HOH 
                   
                 214 
                 18.333 
                 25.494 
                 30.728 
                 1.00 
                 59.02 
                 O 
               
               
                 HETATM 
                 1979 
                 O 
                 HOH 
                   
                 215 
                 −10.477 
                 70.874 
                 59.283 
                 1.00 
                 90.02 
                 O 
               
               
                 HETATM 
                 1980 
                 O 
                 HOH 
                   
                 216 
                 −24.719 
                 51.729 
                 41.022 
                 1.00 
                 46.48 
                 O 
               
               
                 HETATM 
                 1981 
                 O 
                 HOH 
                   
                 217 
                 14.511 
                 48.063 
                 37.259 
                 1.00 
                 60.62 
                 O 
               
               
                 HETATM 
                 1982 
                 O 
                 HOH 
                   
                 218 
                 −10.655 
                 26.875 
                 15.002 
                 1.00 
                 83.41 
                 O 
               
               
                 HETATM 
                 1983 
                 O 
                 HOH 
                   
                 219 
                 11.207 
                 48.612 
                 31.720 
                 1.00 
                 62.53 
                 O 
               
               
                 HETATM 
                 1984 
                 O 
                 HOH 
                   
                 220 
                 −12.020 
                 30.028 
                 27.373 
                 1.00 
                 74.67 
                 O 
               
               
                 HETATM 
                 1985 
                 O 
                 HOH 
                   
                 221 
                 −37.489 
                 47.701 
                 29.803 
                 1.00 
                 68.54 
                 O 
               
               
                 HETATM 
                 1986 
                 O 
                 HOH 
                   
                 222 
                 6.582 
                 42.620 
                 37.908 
                 1.00 
                 52.68 
                 O 
               
               
                 HETATM 
                 1987 
                 O 
                 HOH 
                   
                 223 
                 −5.169 
                 54.977 
                 49.059 
                 1.00 
                 81.54 
                 O 
               
               
                 HETATM 
                 1988 
                 O 
                 HOH 
                   
                 224 
                 −11.648 
                 73.225 
                 58.749 
                 1.00 
                 71.11 
                 O 
               
               
                 HETATM 
                 1989 
                 O 
                 HOH 
                   
                 225 
                 1.769 
                 39.751 
                 36.817 
                 1.00 
                 83.19 
                 O 
               
               
                 HETATM 
                 1990 
                 O 
                 HOH 
                   
                 226 
                 12.017 
                 35.767 
                 45.531 
                 1.00 
                 87.64 
                 O 
               
               
                 HETATM 
                 1991 
                 O 
                 HOH 
                   
                 227 
                 21.914 
                 39.637 
                 26.810 
                 1.00 
                 61.56 
                 O 
               
               
                 HETATM 
                 1992 
                 O 
                 HOH 
                   
                 228 
                 13.853 
                 42.384 
                 18.211 
                 1.00 
                 47.88 
                 O 
               
               
                 HETATM 
                 1993 
                 O 
                 HOH 
                   
                 229 
                 −2.593 
                 54.747 
                 48.184 
                 1.00 
                 85.82 
                 O 
               
               
                 HETATM 
                 1994 
                 O 
                 HOH 
                   
                 230 
                 16.494 
                 26.070 
                 37.419 
                 1.00 
                 66.70 
                 O 
               
               
                 HETATM 
                 1995 
                 O 
                 HOH 
                   
                 231 
                 −9.482 
                 37.452 
                 37.786 
                 1.00 
                 78.29 
                 O 
               
               
                 HETATM 
                 1996 
                 O 
                 HOH 
                   
                 232 
                 −13.412 
                 29.804 
                 19.190 
                 1.00 
                 95.07 
                 O 
               
               
                 HETATM 
                 1997 
                 O 
                 HOH 
                   
                 233 
                 −11.326 
                 24.573 
                 13.894 
                 1.00 
                 85.94 
                 O 
               
               
                 HETATM 
                 1998 
                 O 
                 HOH 
                   
                 234 
                 18.269 
                 38.041 
                 21.145 
                 1.00 
                 51.57 
                 O 
               
               
                 HETATM 
                 1999 
                 O 
                 HOH 
                   
                 235 
                 −11.946 
                 37.393 
                 36.577 
                 1.00 
                 61.47 
                 O 
               
               
                 HETATM 
                 2000 
                 O 
                 HOH 
                   
                 236 
                 −29.656 
                 56.618 
                 26.887 
                 1.00 
                 77.90 
                 O 
               
               
                 HETATM 
                 2001 
                 O 
                 HOH 
                   
                 237 
                 −12.732 
                 32.774 
                 38.409 
                 1.00 
                 74.56 
                 O 
               
               
                 HETATM 
                 2002 
                 O 
                 HOH 
                   
                 238 
                 17.956 
                 23.840 
                 34.384 
                 1.00 
                 63.80 
                 O 
               
               
                 HETATM 
                 2003 
                 O 
                 HOH 
                   
                 239 
                 −9.416 
                 37.923 
                 44.514 
                 1.00 
                 90.86 
                 O 
               
               
                 HETATM 
                 2004 
                 O 
                 HOH 
                   
                 240 
                 −14.456 
                 60.996 
                 37.550 
                 1.00 
                 80.66 
                 O 
               
               
                 HETATM 
                 2005 
                 O 
                 HOH 
                   
                 241 
                 −1.720 
                 44.079 
                 26.371 
                 1.00 
                 64.22 
                 O 
               
               
                 HETATM 
                 2006 
                 O 
                 HOH 
                   
                 242 
                 −10.339 
                 38.706 
                 33.728 
                 1.00 
                 67.90 
                 O 
               
               
                 HETATM 
                 2007 
                 O 
                 HOH 
                   
                 243 
                 24.244 
                 36.669 
                 35.828 
                 1.00 
                 53.46 
                 O 
               
               
                 HETATM 
                 2008 
                 O 
                 HOH 
                   
                 244 
                 −7.769 
                 23.449 
                 11.359 
                 1.00 
                 84.35 
                 O 
               
               
                 HETATM 
                 2009 
                 O 
                 HOH 
                   
                 245 
                 11.242 
                 21.377 
                 31.295 
                 1.00 
                 59.50 
                 O 
               
               
                 HETATM 
                 2010 
                 O 
                 HOH 
                   
                 246 
                 −29.651 
                 41.449 
                 25.764 
                 1.00 
                 55.60 
                 O 
               
               
                 HETATM 
                 2011 
                 O 
                 HOH 
                   
                 247 
                 −13.689 
                 59.872 
                 55.361 
                 1.00 
                 57.65 
                 O 
               
               
                 HETATM 
                 2012 
                 O 
                 HOH 
                   
                 248 
                 4.670 
                 26.514 
                 16.406 
                 1.00 
                 78.28 
                 O 
               
               
                 HETATM 
                 2013 
                 O 
                 HOH 
                   
                 249 
                 −38.061 
                 52.151 
                 30.188 
                 1.00 
                 74.73 
                 O 
               
               
                 HETATM 
                 2014 
                 O 
                 HOH 
                   
                 250 
                 13.040 
                 26.819 
                 19.529 
                 1.00 
                 73.16 
                 O 
               
               
                 HETATM 
                 2015 
                 O 
                 HOH 
                   
                 251 
                 −17.381 
                 34.165 
                 33.393 
                 1.00 
                 64.24 
                 O 
               
               
                 HETATM 
                 2016 
                 O 
                 HOH 
                   
                 252 
                 −2.223 
                 34.352 
                 37.730 
                 1.00 
                 83.71 
                 O 
               
               
                 HETATM 
                 2017 
                 O 
                 HOH 
                   
                 253 
                 −16.079 
                 31.443 
                 19.478 
                 1.00 
                 84.26 
                 O 
               
               
                 HETATM 
                 2018 
                 O 
                 HOH 
                   
                 254 
                 −8.067 
                 30.366 
                 34.807 
                 1.00 
                 75.21 
                 O 
               
               
                 HETATM 
                 2019 
                 O 
                 HOH 
                   
                 255 
                 −16.052 
                 32.626 
                 17.086 
                 1.00 
                 111.60 
                 O 
               
               
                 HETATM 
                 2020 
                 O 
                 HOH 
                   
                 256 
                 −3.151 
                 32.317 
                 36.134 
                 1.00 
                 76.07 
                 O 
               
               
                 HETATM 
                 2021 
                 O 
                 HOH 
                   
                 257 
                 −28.340 
                 43.292 
                 26.140 
                 1.00 
                 84.47 
                 O 
               
               
                 HETATM 
                 2022 
                 O 
                 HOH 
                   
                 258 
                 −13.201 
                 34.779 
                 40.218 
                 1.00 
                 78.14 
                 O 
               
               
                 HETATM 
                 2023 
                 O 
                 HOH 
                   
                 259 
                 −28.742 
                 28.673 
                 28.253 
                 1.00 
                 65.42 
                 O 
               
               
                 HETATM 
                 2024 
                 O 
                 HOH 
                   
                 260 
                 −20.148 
                 45.068 
                 25.903 
                 0.50 
                 74.24 
                 O 
               
               
                 HETATM 
                 2025 
                 O 
                 HOH 
                   
                 261 
                 11.073 
                 36.391 
                 42.363 
                 1.00 
                 95.30 
                 O 
               
               
                 HETATM 
                 2026 
                 O 
                 HOH 
                   
                 262 
                 −15.738 
                 48.828 
                 48.039 
                 1.00 
                 55.95 
                 O 
               
               
                 HETATM 
                 2027 
                 O 
                 HOH 
                   
                 263 
                 −19.088 
                 33.527 
                 26.503 
                 1.00 
                 87.58 
                 O 
               
               
                 HETATM 
                 2028 
                 O 
                 HOH 
                   
                 264 
                 −0.687 
                 47.729 
                 38.514 
                 1.00 
                 82.39 
                 O 
               
               
                 HETATM 
                 2029 
                 O 
                 HOH 
                   
                 265 
                 13.291 
                 35.265 
                 47.736 
                 1.00 
                 85.03 
                 O 
               
               
                 HETATM 
                 2030 
                 O 
                 HOH 
                   
                 266 
                 −2.672 
                 19.489 
                 1.571 
                 1.00 
                 72.65 
                 O 
               
               
                 HETATM 
                 2031 
                 O 
                 HOH 
                   
                 267 
                 −39.451 
                 43.535 
                 26.005 
                 0.50 
                 61.33 
                 O 
               
               
                 HETATM 
                 2032 
                 O 
                 HOH 
                   
                 268 
                 −0.307 
                 24.319 
                 23.263 
                 1.00 
                 61.23 
                 O 
               
               
                 HETATM 
                 2033 
                 O 
                 HOH 
                   
                 269 
                 18.114 
                 42.357 
                 14.347 
                 1.00 
                 74.03 
                 O 
               
               
                 HETATM 
                 2034 
                 O 
                 HOH 
                   
                 270 
                 −1.953 
                 37.146 
                 36.068 
                 1.00 
                 98.52 
                 O 
               
               
                 HETATM 
                 2035 
                 O 
                 HOH 
                   
                 271 
                 −37.503 
                 39.278 
                 41.064 
                 1.00 
                 73.24 
                 O 
               
               
                 HETATM 
                 2036 
                 O 
                 HOH 
                   
                 272 
                 −40.189 
                 28.850 
                 28.128 
                 1.00 
                 87.08 
                 O 
               
               
                 HETATM 
                 2037 
                 O 
                 HOH 
                   
                 273 
                 24.328 
                 34.368 
                 36.983 
                 1.00 
                 75.80 
                 O 
               
               
                 HETATM 
                 2038 
                 O 
                 HOH 
                   
                 274 
                 −37.020 
                 37.405 
                 24.990 
                 1.00 
                 71.53 
                 O 
               
               
                 HETATM 
                 2039 
                 O 
                 HOH 
                   
                 275 
                 −19.465 
                 36.641 
                 43.076 
                 1.00 
                 67.93 
                 O 
               
               
                 HETATM 
                 2040 
                 O 
                 HOH 
                   
                 276 
                 −7.655 
                 24.826 
                 31.230 
                 1.00 
                 49.77 
                 O 
               
               
                 HETATM 
                 2041 
                 O 
                 HOH 
                   
                 277 
                 −2.621 
                 23.763 
                 22.594 
                 1.00 
                 88.43 
                 O 
               
               
                 HETATM 
                 2042 
                 O 
                 HOH 
                   
                 278 
                 −2.830 
                 35.434 
                 33.849 
                 1.00 
                 88.49 
                 O 
               
               
                 HETATM 
                 2043 
                 O 
                 HOH 
                   
                 279 
                 −32.334 
                 34.377 
                 45.004 
                 1.00 
                 93.57 
                 O 
               
               
                 HETATM 
                 2044 
                 O 
                 HOH 
                   
                 280 
                 1.641 
                 44.356 
                 34.318 
                 1.00 
                 50.87 
                 O 
               
               
                 HETATM 
                 2045 
                 O 
                 HOH 
                   
                 281 
                 −36.662 
                 44.555 
                 31.032 
                 1.00 
                 55.72 
                 O 
               
               
                 HETATM 
                 2046 
                 O 
                 HOH 
                   
                 282 
                 −0.094 
                 34.840 
                 10.372 
                 1.00 
                 66.27 
                 O 
               
               
                 HETATM 
                 2047 
                 O 
                 HOH 
                   
                 283 
                 −13.878 
                 31.752 
                 27.095 
                 1.00 
                 69.99 
                 O 
               
               
                 HETATM 
                 2048 
                 O 
                 HOH 
                   
                 284 
                 23.476 
                 43.421 
                 42.279 
                 1.00 
                 105.55 
                 O 
               
               
                 HETATM 
                 2049 
                 O 
                 HOH 
                   
                 285 
                 −23.343 
                 31.731 
                 28.830 
                 1.00 
                 70.21 
                 O 
               
               
                 HETATM 
                 2050 
                 O 
                 HOH 
                   
                 286 
                 5.253 
                 45.138 
                 37.445 
                 1.00 
                 94.42 
                 O 
               
               
                 HETATM 
                 2051 
                 O 
                 HOH 
                   
                 287 
                 10.412 
                 31.220 
                 14.882 
                 1.00 
                 87.46 
                 O 
               
               
                 HETATM 
                 2052 
                 O 
                 HOH 
                   
                 288 
                 14.940 
                 31.880 
                 16.303 
                 1.00 
                 66.56 
                 O 
               
               
                 HETATM 
                 2053 
                 O 
                 HOH 
                   
                 289 
                 17.168 
                 36.449 
                 45.600 
                 0.50 
                 54.04 
                 O 
               
               
                 HETATM 
                 2054 
                 O 
                 HOH 
                   
                 290 
                 2.003 
                 41.955 
                 38.222 
                 1.00 
                 69.37 
                 O 
               
               
                 HETATM 
                 2055 
                 O 
                 HOH 
                   
                 291 
                 6.621 
                 39.950 
                 38.526 
                 1.00 
                 58.61 
                 O 
               
               
                 HETATM 
                 2056 
                 O 
                 HOH 
                   
                 292 
                 −22.166 
                 32.743 
                 25.751 
                 1.00 
                 79.54 
                 O 
               
               
                 HETATM 
                 2057 
                 O 
                 HOH 
                   
                 293 
                 −21.155 
                 47.190 
                 26.170 
                 0.50 
                 53.13 
                 O 
               
               
                 HETATM 
                 2058 
                 O 
                 HOH 
                   
                 294 
                 21.374 
                 37.864 
                 20.799 
                 1.00 
                 77.05 
                 O 
               
               
                 HETATM 
                 2059 
                 O 
                 HOH 
                   
                 295 
                 −13.520 
                 70.582 
                 51.050 
                 1.00 
                 88.38 
                 O 
               
               
                 HETATM 
                 2060 
                 O 
                 HOH 
                   
                 296 
                 25.541 
                 38.807 
                 32.374 
                 1.00 
                 52.13 
                 O 
               
               
                 HETATM 
                 2061 
                 O 
                 HOH 
                   
                 297 
                 −20.150 
                 33.543 
                 42.049 
                 1.00 
                 69.15 
                 O 
               
               
                 HETATM 
                 2062 
                 O 
                 HOH 
                   
                 298 
                 −16.241 
                 69.662 
                 40.827 
                 1.00 
                 75.97 
                 O 
               
               
                 HETATM 
                 2063 
                 O 
                 HOH 
                   
                 299 
                 −15.650 
                 66.556 
                 60.490 
                 1.00 
                 96.19 
                 O 
               
               
                 HETATM 
                 2064 
                 O 
                 HOH 
                   
                 300 
                 −4.674 
                 46.553 
                 26.268 
                 1.00 
                 89.63 
                 O 
               
               
                 HETATM 
                 2065 
                 O 
                 HOH 
                   
                 301 
                 −18.802 
                 36.355 
                 49.179 
                 1.00 
                 77.59 
                 O 
               
               
                 HETATM 
                 2066 
                 O 
                 HOH 
                   
                 302 
                 −25.774 
                 35.475 
                 24.450 
                 1.00 
                 61.75 
                 O 
               
               
                 HETATM 
                 2067 
                 O 
                 HOH 
                   
                 303 
                 −4.490 
                 16.888 
                 11.049 
                 1.00 
                 90.74 
                 O 
               
               
                 HETATM 
                 2068 
                 O 
                 HOH 
                   
                 304 
                 −26.802 
                 27.808 
                 30.640 
                 1.00 
                 77.04 
                 O 
               
               
                 HETATM 
                 2069 
                 O 
                 HOH 
                   
                 305 
                 5.669 
                 22.533 
                 35.676 
                 1.00 
                 73.26 
                 O 
               
               
                 HETATM 
                 2070 
                 O 
                 HOH 
                   
                 306 
                 −31.095 
                 43.543 
                 25.917 
                 1.00 
                 67.07 
                 O 
               
               
                 HETATM 
                 2071 
                 O 
                 HOH 
                   
                 307 
                 −10.776 
                 20.519 
                 3.866 
                 1.00 
                 88.13 
                 O 
               
               
                 HETATM 
                 2072 
                 O 
                 HOH 
                   
                 308 
                 −24.474 
                 29.167 
                 30.418 
                 1.00 
                 83.44 
                 O 
               
               
                 HETATM 
                 2073 
                 O 
                 HOH 
                   
                 309 
                 4.054 
                 47.866 
                 34.653 
                 1.00 
                 67.34 
                 O 
               
               
                 HETATM 
                 2074 
                 O 
                 HOH 
                   
                 310 
                 −40.069 
                 32.480 
                 34.827 
                 1.00 
                 87.72 
                 O 
               
               
                 HETATM 
                 2075 
                 O 
                 HOH 
                   
                 311 
                 −13.867 
                 22.452 
                 8.366 
                 1.00 
                 81.23 
                 O 
               
               
                 HETATM 
                 2076 
                 O 
                 HOH 
                   
                 312 
                 −6.729 
                 34.615 
                 36.646 
                 1.00 
                 91.79 
                 O 
               
               
                 HETATM 
                 2077 
                 O 
                 HOH 
                   
                 313 
                 −13.851 
                 67.948 
                 42.822 
                 1.00 
                 104.93 
                 O 
               
               
                 HETATM 
                 2078 
                 O 
                 HOH 
                   
                 314 
                 −9.942 
                 22.490 
                 2.278 
                 1.00 
                 76.63 
                 O 
               
               
                 HETATM 
                 2079 
                 O 
                 HOH 
                   
                 315 
                 −12.535 
                 69.113 
                 55.555 
                 1.00 
                 84.39 
                 O 
               
               
                 HETATM 
                 2080 
                 O 
                 HOH 
                   
                 316 
                 −35.917 
                 50.015 
                 39.350 
                 1.00 
                 102.90 
                 O 
               
               
                 HETATM 
                 2081 
                 O 
                 HOH 
                   
                 317 
                 6.860 
                 27.799 
                 16.464 
                 1.00 
                 94.15 
                 O 
               
               
                 HETATM 
                 2082 
                 O 
                 HOH 
                   
                 318 
                 −6.624 
                 47.121 
                 27.551 
                 1.00 
                 55.25 
                 O 
               
               
                 HETATM 
                 2083 
                 O 
                 HOH 
                   
                 319 
                 25.633 
                 36.301 
                 33.674 
                 1.00 
                 90.78 
                 O 
               
               
                 HETATM 
                 2084 
                 O 
                 HOH 
                   
                 320 
                 −40.011 
                 28.195 
                 30.647 
                 1.00 
                 72.48 
                 O 
               
               
                 HETATM 
                 2085 
                 O 
                 HOH 
                   
                 321 
                 −0.548 
                 21.349 
                 5.340 
                 1.00 
                 76.60 
                 O 
               
               
                 HETATM 
                 2086 
                 O 
                 HOH 
                   
                 322 
                 −19.675 
                 66.803 
                 60.854 
                 1.00 
                 94.58 
                 O 
               
               
                 HETATM 
                 2087 
                 O 
                 HOH 
                   
                 323 
                 −2.728 
                 51.206 
                 32.260 
                 1.00 
                 77.64 
                 O 
               
               
                 HETATM 
                 2088 
                 O 
                 HOH 
                   
                 324 
                 −1.247 
                 43.110 
                 29.580 
                 1.00 
                 56.25 
                 O 
               
               
                 HETATM 
                 2089 
                 O 
                 HOH 
                   
                 325 
                 −34.343 
                 37.661 
                 47.184 
                 1.00 
                 73.61 
                 O 
               
               
                 HETATM 
                 2090 
                 O 
                 HOH 
                   
                 326 
                 −17.710 
                 48.503 
                 47.282 
                 1.00 
                 51.09 
                 O 
               
               
                 HETATM 
                 2091 
                 O 
                 HOH 
                   
                 327 
                 19.728 
                 28.197 
                 29.672 
                 1.00 
                 71.53 
                 O 
               
               
                 HETATM 
                 2092 
                 O 
                 HOH 
                   
                 328 
                 −16.815 
                 43.464 
                 29.032 
                 1.00 
                 38.64 
                 O 
               
               
                 HETATM 
                 2093 
                 O 
                 HOH 
                   
                 329 
                 −8.769 
                 46.895 
                 26.815 
                 1.00 
                 63.95 
                 O 
               
               
                 HETATM 
                 2094 
                 O 
                 HOH 
                   
                 330 
                 19.385 
                 30.108 
                 27.998 
                 1.00 
                 84.78 
                 O 
               
               
                 HETATM 
                 2095 
                 O 
                 HOH 
                   
                 331 
                 20.296 
                 46.890 
                 36.277 
                 1.00 
                 69.10 
                 O 
               
               
                 HETATM 
                 2096 
                 O 
                 HOH 
                   
                 332 
                 10.011 
                 39.138 
                 22.129 
                 1.00 
                 73.04 
                 O 
               
               
                 HETATM 
                 2097 
                 O 
                 HOH 
                   
                 333 
                 −34.667 
                 43.573 
                 39.921 
                 1.00 
                 94.23 
                 O 
               
               
                 HETATM 
                 2098 
                 O 
                 HOH 
                   
                 334 
                 25.038 
                 44.754 
                 44.084 
                 1.00 
                 62.57 
                 O 
               
               
                 HETATM 
                 2099 
                 O 
                 HOH 
                   
                 335 
                 18.836 
                 44.474 
                 39.123 
                 1.00 
                 79.24 
                 O 
               
               
                 HETATM 
                 2100 
                 O 
                 HOH 
                   
                 336 
                 5.728 
                 24.703 
                 20.348 
                 1.00 
                 91.70 
                 O 
               
               
                 HETATM 
                 2101 
                 O 
                 HOH 
                   
                 337 
                 −37.708 
                 28.757 
                 29.261 
                 1.00 
                 89.30 
                 O 
               
               
                 HETATM 
                 2102 
                 O 
                 HOH 
                   
                 338 
                 24.041 
                 44.585 
                 36.443 
                 1.00 
                 87.02 
                 O 
               
               
                 HETATM 
                 2103 
                 O 
                 HOH 
                   
                 339 
                 −16.021 
                 34.803 
                 49.305 
                 0.50 
                 57.78 
                 O 
               
               
                 HETATM 
                 2104 
                 O 
                 HOH 
                   
                 340 
                 −23.445 
                 54.520 
                 27.866 
                 1.00 
                 97.08 
                 O 
               
               
                 HETATM 
                 2105 
                 O 
                 HOH 
                   
                 341 
                 12.151 
                 43.628 
                 46.109 
                 1.00 
                 87.45 
                 O 
               
               
                 HETATM 
                 2106 
                 O 
                 HOH 
                   
                 342 
                 21.420 
                 30.507 
                 17.302 
                 1.00 
                 70.53 
                 O 
               
               
                 HETATM 
                 2107 
                 O 
                 HOH 
                   
                 343 
                 −34.255 
                 41.798 
                 50.132 
                 1.00 
                 81.37 
                 O 
               
               
                 HETATM 
                 2108 
                 O 
                 HOH 
                   
                 344 
                 18.390 
                 20.362 
                 32.308 
                 1.00 
                 83.10 
                 O 
               
               
                 HETATM 
                 2109 
                 O 
                 HOH 
                   
                 345 
                 −25.000 
                 56.746 
                 38.927 
                 1.00 
                 94.33 
                 O 
               
               
                 HETATM 
                 2110 
                 O 
                 HOH 
                   
                 346 
                 −8.804 
                 60.068 
                 50.157 
                 1.00 
                 79.38 
                 O 
               
               
                 HETATM 
                 2111 
                 O 
                 HOH 
                   
                 347 
                 −20.488 
                 55.011 
                 45.150 
                 1.00 
                 91.93 
                 O 
               
               
                 HETATM 
                 2112 
                 O 
                 HOH 
                   
                 348 
                 −0.212 
                 46.908 
                 32.365 
                 1.00 
                 84.10 
                 O 
               
               
                 HETATM 
                 2113 
                 O 
                 HOH 
                   
                 349 
                 −7.494 
                 7.448 
                 7.764 
                 1.00 
                 76.18 
                 O 
               
               
                 HETATM 
                 2114 
                 O 
                 HOH 
                   
                 350 
                 −17.446 
                 73.178 
                 55.029 
                 1.00 
                 76.88 
                 O 
               
               
                 HETATM 
                 2115 
                 O 
                 HOH 
                   
                 351 
                 −7.818 
                 4.607 
                 5.147 
                 1.00 
                 67.95 
                 O 
               
               
                 HETATM 
                 2116 
                 O 
                 HOH 
                   
                 352 
                 18.532 
                 34.688 
                 16.174 
                 1.00 
                 80.19 
                 O 
               
               
                 HETATM 
                 2117 
                 O 
                 HOH 
                   
                 353 
                 −38.919 
                 53.773 
                 41.038 
                 1.00 
                 77.53 
                 O 
               
               
                 HETATM 
                 2118 
                 O 
                 HOH 
                   
                 354 
                 4.686 
                 42.380 
                 42.213 
                 1.00 
                 66.79 
                 O 
               
               
                 HETATM 
                 2119 
                 O 
                 HOH 
                   
                 355 
                 −43.020 
                 57.512 
                 44.325 
                 1.00 
                 74.66 
                 O 
               
               
                 HETATM 
                 2120 
                 O 
                 HOH 
                   
                 356 
                 −36.610 
                 51.515 
                 43.519 
                 1.00 
                 80.73 
                 O 
               
               
                 HETATM 
                 2121 
                 O 
                 HOH 
                   
                 357 
                 −40.125 
                 38.357 
                 26.648 
                 1.00 
                 83.64 
                 O 
               
               
                 HETATM 
                 2122 
                 O 
                 HOH 
                   
                 358 
                 −42.612 
                 55.808 
                 47.578 
                 1.00 
                 69.35 
                 O 
               
               
                 CONECT 
                 168 
                 649 
               
               
                 CONECT 
                 649 
                 168 
               
               
                 CONECT 
                 1050 
                 1531 
               
               
                 CONECT 
                 1531 
                 1050 
               
               
                 MASTER 
                   
                 377 
                 0 
                   
                 0 
                 2 26 
                 0 0 
                 6 2120 
                 2 
                 4 
                 18 
               
            
           
           
               
            
               
                 END 
               
               
                   
               
            
           
         
       
     
     
       
         
           
               
               
             
               
                 APPENDIX I(c) 
               
               
                   
               
             
            
               
                 HEADER 
                 12A-9 
               
               
                 COMPND 
                 12A-9 
               
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  PROGRAM 
                 : REFMAC 5.2.0005 
               
               
                 REMARK 
                 3 
                  AUTHORS 
                 : MURSHUDOV,VAGIN,DODSON 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 REFINEMENT TARGET : MAXIMUM LIKELIHOOD 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  RESOLUTION RANGE HIGH 
                 (ANGSTROMS) 
                 : 
                  2.10 
               
               
                 REMARK 
                 3 
                  RESOLUTION RANGE LOW 
                 (ANGSTROMS) 
                 : 
                  34.20 
               
               
                 REMARK 
                 3 
                  DATA CUTOFF 
                  (SIGMA(F)) 
                 : 
                 NONE 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPLETENESS FOR RANGE 
                 (%) 
                 : 
                  98.55 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF REFLECTIONS 
                 : 
                   6040 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 FIT TO DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  CROSS-VALIDATION METHOD 
                 : 
                 THROUGHOUT 
               
               
                 REMARK 
                 3 
                  FREE R VALUE TEST SET SELECTION 
                 : 
                 RANDOM 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  R VALUE 
                 (WORKING + TEST SET) 
                 : 
                 0.22276 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  R VALUE 
                 (WORKING SET) 
                 : 
                  0.21668 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  FREE R VALUE 
                 : 
                  0.34914 
               
               
                 REMARK 
                 3 
                  FREE R VALUE TEST SET SIZE (%) 
                 : 
                  4.7 
               
               
                 REMARK 
                 3 
                  FREE R VALUE TEST SET COUNT 
                 : 
                  297 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 FIT IN THE HIGHEST RESOLUTION BIN. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  TOTAL NUMBER OF BINS USED 
                 : 
                  20 
               
               
                 REMARK 
                 3 
                  BIN RESOLUTION RANGE HIGH 
                 : 
                  2.100 
               
               
                 REMARK 
                 3 
                  BIN RESOLUTION RANGE LOW 
                 : 
                  2.154 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  REFLECTION IN BIN 
                 (WORKING SET) 
                 : 
                  432 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BIN COMPLETENESS (WORKING+TEST) (%) 
                 : 
                 100.00 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BIN R VALUE 
                 (WORKING SET) 
                 : 
                  0.261 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BIN FREE R VALUE SET COUNT 
                 : 
                   19 
               
               
                 REMARK 
                 3 
                  BIN FREE R VALUE 
                 : 
                  0.397 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ALL ATOMS 
                  : 
                 963 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 B VALUES. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  FROM WILSON PLOT 
                 (A**2) 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  MEAN B VALUE 
                 (OVERALL, A**2) 
                 :  46.514 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  OVERALL ANISOTROPIC B VALUE. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 B11 (A**2) : 
                 −2.38 
               
               
                 REMARK 
                 3 
                 B22 (A**2) : 
                  2.21 
               
               
                 REMARK 
                 3 
                 B33 (A**2) : 
                  0.17 
               
               
                 REMARK 
                 3 
                 B12 (A**2) : 
                  0.00 
               
               
                 REMARK 
                 3 
                 B13 (A**2) : 
                  0.00 
               
               
                 REMARK 
                 3 
                 B23 (A**2) : 
                  0.00 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 ESTIMATED OVERALL COORDINATE ERROR. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ESU BASED ON R VALUE 
                   (A): 
                  0.308 
               
               
                 REMARK 
                 3 
                  ESU BASED ON FREE R VALUE 
                   (A): 
                  0.299 
               
               
                 REMARK 
                 3 
                  ESU BASED ON MAXIMUM LIKELIHOOD 
                   (A): 
                  0.266 
               
               
                 REMARK 
                 3 
                  ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD 
                 (A**2): 
                 18.684 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  CORRELATION COEFFICIENTS. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  CORRELATION COEFFICIENT FO-FC 
                 : 
                 0.938 
               
               
                 REMARK 
                 3 
                  CORRELATION COEFFICIENT FO-FC FREE 
                 : 
                 0.852 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 RMS DEVIATIONS FROM IDEAL VALUES 
                 COUNT 
                 RMS 
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BOND LENGTHS REFINED ATOMS 
                 (A): 
                  833 ; 
                  0.013 ; 
                  0.022 
               
               
                 REMARK 
                 3 
                  BOND ANGLES REFINED ATOMS 
                 (DEGREES): 
                 1125 ; 
                  1.589 ; 
                  1.959 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 1 
                 (DEGREES): 
                  107 ; 
                  7.310 ; 
                  5.000 
               
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 2 
                 (DEGREES): 
                  35 ; 
                 31.640 ; 
                 22.857 
               
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 3 
                 (DEGREES): 
                  149 ; 
                 17.871 ; 
                 15.000 
               
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 4 
                 (DEGREES): 
                   9 ; 
                 15.120 ; 
                 15.000 
               
               
                 REMARK 
                 3 
                 CHIRAL-CENTER RESTRAINTS 
                 (A**3): 
                  132 ; 
                  0.098 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 GENERAL PLANES REFINED ATOMS 
                 (A): 
                  610 ; 
                  0.006 ; 
                  0.020 
               
               
                 REMARK 
                 3 
                 NON-BONDED CONTACTS REFINED ATOMS 
                 (A): 
                  328 ; 
                  0.262 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 NON-BONDED TORSION REFINED ATOMS 
                 (A): 
                  540 ; 
                  0.307 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 H-BOND (X...Y) REFINED ATOMS 
                 (A): 
                  88 ; 
                  0.234 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 SYMMETRY VDW REFINED ATOMS 
                 (A): 
                  40 ; 
                  0.230 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 SYMMETRY H-BOND REFINED ATOMS 
                 (A): 
                  34 ; 
                  0.251 ; 
                  0.200 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ISOTROPIC THERMAL FACTOR RESTRAINTS. 
                 COUNT 
                 RMS 
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 MAIN-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                  542 ; 
                  0.684 ; 
                  1.500 
               
               
                 REMARK 
                 3 
                 MAIN-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                  853 ; 
                  1.129 ; 
                  2.000 
               
               
                 REMARK 
                 3 
                 SIDE-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                  327 ; 
                  1.950 ; 
                  3.000 
               
               
                 REMARK 
                 3 
                 SIDE-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                  272 ; 
                  2.921 ; 
                  4.500 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  NCS RESTRAINTS STATISTICS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 NUMBER OF NCS GROUPS : NULL 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  TLS DETAILS 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 NUMBER OF TLS GROUPS : 
                 1 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 ATOM RECORD CONTAINS RESIDUAL B FACTORS ONLY 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 TLS GROUP : 
                 1 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF COMPONENTS GROUP : 
                 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                 3 
                  RESIDUE RANGE: 
                 A 
                  1 
                   
                 A 
                  108 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ORIGIN FOR THE GROUP (A): 
                 6.9430 
                 24.5360 
                 17.1020 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  T11: 
                 −0.1693 
                 T22: 
                 −0.1046 
               
               
                 REMARK 
                 3 
                  T33: 
                 −0.2013 
                 T12: 
                  0.0063 
               
               
                 REMARK 
                 3 
                  T13: 
                  0.0567 
                 T23: 
                  0.0059 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  L11: 
                  6.2257 
                 L22: 
                  3.2213 
               
               
                 REMARK 
                 3 
                  L33: 
                  3.2779 
                 L12: 
                  1.8504 
               
               
                 REMARK 
                 3 
                  L13: 
                  1.5143 
                 L23: 
                  0.1677 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  S11: 
                  0.0246 
                 S12: 
                  0.4407 
                 S13: 
                  0.2852 
               
               
                 REMARK 
                 3 
                  S21: 
                 −0.1471 
                 S22: 
                  0.0358 
                 S23: 
                 −0.0174 
               
               
                 REMARK 
                 3 
                  S31: 
                 −0.1461 
                 S32: 
                 −0.0338 
                 S33: 
                 −0.0604 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                   
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   BULK SOLVENT MODELLING. 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   METHOD USED : MASK 
               
               
                 REMARK 
                 3 
                   PARAMETERS FOR MASK CALCULATION 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                   VDW PROBE RADIUS 
                 : 
                 1.20 
               
               
                 REMARK 
                 3 
                   ION PROBE RADIUS 
                 : 
                 0.80 
               
               
                 REMARK 
                 3 
                   SHRINKAGE RADIUS 
                 : 
                 0.80 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                   OTHER REFINEMENT REMARKS: 
               
               
                 REMARK 
                 3 
                   HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS 
               
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 SSBOND 
                 1 
                 CYS 
                 A 
                 22 
                 CYS 
                 A 
                 83 
                   
               
               
                 SSBOND 
                 2 
                 CYS 
                 A 
                 29 
                 CYS 
                 A 
                 89 
               
               
                 CISPEP 
                 1 
                 THR 
                 A 
                  6 
                 PRO 
                 A 
                  7 
                 0.00 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 CRYST1 
                 38.268 
                 68.324 
                 39.511 
                 90.00 
                 90.00 
                 90.00 
                 P 21 
                 21 2 
               
            
           
           
               
               
               
               
               
            
               
                 SCALE1 
                 0.026131 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 SCALE2 
                 0.000000 
                 0.014636 
                 0.000000 
                 0.00000 
               
               
                 SCALE3 
                 0.000000 
                 0.000000 
                 0.025309 
                 0.00000 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 ATOM 
                 1 
                 N 
                 ALA 
                 A 
                 1 
                 4.330 
                 25.995 
                 2.005 
                 1.00 
                 43.85 
                 N 
               
               
                 ATOM 
                 2 
                 CA 
                 ALA 
                 A 
                 1 
                 4.728 
                 27.133 
                 1.107 
                 1.00 
                 43.77 
                 C 
               
               
                 ATOM 
                 3 
                 CB 
                 ALA 
                 A 
                 1 
                 3.593 
                 27.517 
                 0.176 
                 1.00 
                 43.63 
                 C 
               
               
                 ATOM 
                 4 
                 C 
                 ALA 
                 A 
                 1 
                 5.151 
                 28.332 
                 1.936 
                 1.00 
                 43.39 
                 C 
               
               
                 ATOM 
                 5 
                 O 
                 ALA 
                 A 
                 1 
                 5.918 
                 29.172 
                 1.470 
                 1.00 
                 43.85 
                 O 
               
               
                 ATOM 
                 6 
                 N 
                 ARG 
                 A 
                 2 
                 4.579 
                 28.432 
                 3.132 
                 1.00 
                 42.78 
                 N 
               
               
                 ATOM 
                 7 
                 CA 
                 ARG 
                 A 
                 2 
                 5.102 
                 29.264 
                 4.216 
                 1.00 
                 42.72 
                 C 
               
               
                 ATOM 
                 8 
                 CB 
                 ARG 
                 A 
                 2 
                 4.780 
                 30.749 
                 4.023 
                 1.00 
                 42.82 
                 C 
               
               
                 ATOM 
                 9 
                 CG 
                 ARG 
                 A 
                 2 
                 5.657 
                 31.676 
                 4.877 
                 1.00 
                 44.95 
                 C 
               
               
                 ATOM 
                 10 
                 CD 
                 ARG 
                 A 
                 2 
                 5.472 
                 33.132 
                 4.480 
                 1.00 
                 47.25 
                 C 
               
               
                 ATOM 
                 11 
                 NE 
                 ARG 
                 A 
                 2 
                 6.437 
                 34.012 
                 5.135 
                 1.00 
                 49.81 
                 N 
               
               
                 ATOM 
                 12 
                 CZ 
                 ARG 
                 A 
                 2 
                 6.603 
                 35.304 
                 4.828 
                 1.00 
                 51.50 
                 C 
               
               
                 ATOM 
                 13 
                 NH1 
                 ARG 
                 A 
                 2 
                 5.863 
                 35.873 
                 3.885 
                 1.00 
                 51.25 
                 N 
               
               
                 ATOM 
                 14 
                 NH2 
                 ARG 
                 A 
                 2 
                 7.507 
                 36.040 
                 5.465 
                 1.00 
                 51.63 
                 N 
               
               
                 ATOM 
                 15 
                 C 
                 ARG 
                 A 
                 2 
                 4.476 
                 28.768 
                 5.506 
                 1.00 
                 42.13 
                 C 
               
               
                 ATOM 
                 16 
                 O 
                 ARG 
                 A 
                 2 
                 3.283 
                 28.457 
                 5.534 
                 1.00 
                 41.66 
                 O 
               
               
                 ATOM 
                 17 
                 N 
                 VAL 
                 A 
                 3 
                 5.280 
                 28.675 
                 6.567 
                 1.00 
                 41.68 
                 N 
               
               
                 ATOM 
                 18 
                 CA 
                 VAL 
                 A 
                 3 
                 4.755 
                 28.407 
                 7.899 
                 1.00 
                 41.27 
                 C 
               
               
                 ATOM 
                 19 
                 CB 
                 VAL 
                 A 
                 3 
                 5.585 
                 27.367 
                 8.690 
                 1.00 
                 41.29 
                 C 
               
               
                 ATOM 
                 20 
                 CG1 
                 VAL 
                 A 
                 3 
                 5.631 
                 26.054 
                 7.981 
                 1.00 
                 41.79 
                 C 
               
               
                 ATOM 
                 21 
                 CG2 
                 VAL 
                 A 
                 3 
                 4.962 
                 27.123 
                 10.045 
                 1.00 
                 42.69 
                 C 
               
               
                 ATOM 
                 22 
                 C 
                 VAL 
                 A 
                 3 
                 4.695 
                 29.732 
                 8.678 
                 1.00 
                 41.43 
                 C 
               
               
                 ATOM 
                 23 
                 O 
                 VAL 
                 A 
                 3 
                 5.675 
                 30.493 
                 8.728 
                 1.00 
                 41.02 
                 O 
               
               
                 ATOM 
                 24 
                 N 
                 ASP 
                 A 
                 4 
                 3.534 
                 30.006 
                 9.274 
                 1.00 
                 41.22 
                 N 
               
               
                 ATOM 
                 25 
                 CA 
                 ASP 
                 A 
                 4 
                 3.393 
                 31.135 
                 10.171 
                 1.00 
                 40.99 
                 C 
               
               
                 ATOM 
                 26 
                 CB 
                 ASP 
                 A 
                 4 
                 2.059 
                 31.870 
                 9.961 
                 1.00 
                 40.51 
                 C 
               
               
                 ATOM 
                 27 
                 CG 
                 ASP 
                 A 
                 4 
                 1.862 
                 32.377 
                 8.537 
                 1.00 
                 43.34 
                 C 
               
               
                 ATOM 
                 28 
                 OD1 
                 ASP 
                 A 
                 4 
                 0.693 
                 32.684 
                 8.183 
                 1.00 
                 44.24 
                 O 
               
               
                 ATOM 
                 29 
                 OD2 
                 ASP 
                 A 
                 4 
                 2.854 
                 32.502 
                 7.779 
                 1.00 
                 45.58 
                 O 
               
               
                 ATOM 
                 30 
                 C 
                 ASP 
                 A 
                 4 
                 3.469 
                 30.569 
                 11.581 
                 1.00 
                 40.39 
                 C 
               
               
                 ATOM 
                 31 
                 O 
                 ASP 
                 A 
                 4 
                 2.629 
                 29.730 
                 11.968 
                 1.00 
                 40.91 
                 O 
               
               
                 ATOM 
                 32 
                 N 
                 GLN 
                 A 
                 5 
                 4.470 
                 31.000 
                 12.342 
                 1.00 
                 39.37 
                 N 
               
               
                 ATOM 
                 33 
                 CA 
                 GLN 
                 A 
                 5 
                 4.613 
                 30.557 
                 13.755 
                 1.00 
                 39.62 
                 C 
               
               
                 ATOM 
                 34 
                 CB 
                 GLN 
                 A 
                 5 
                 6.033 
                 30.097 
                 14.056 
                 1.00 
                 39.21 
                 C 
               
               
                 ATOM 
                 35 
                 CG 
                 GLN 
                 A 
                 5 
                 6.143 
                 29.286 
                 15.330 
                 1.00 
                 39.71 
                 C 
               
               
                 ATOM 
                 36 
                 CD 
                 GLN 
                 A 
                 5 
                 7.566 
                 28.809 
                 15.616 
                 1.00 
                 40.20 
                 C 
               
               
                 ATOM 
                 37 
                 OE1 
                 GLN 
                 A 
                 5 
                 8.281 
                 28.355 
                 14.720 
                 1.00 
                 38.99 
                 O 
               
               
                 ATOM 
                 38 
                 NE2 
                 GLN 
                 A 
                 5 
                 7.995 
                 28.953 
                 16.871 
                 1.00 
                 39.67 
                 N 
               
               
                 ATOM 
                 39 
                 C 
                 GLN 
                 A 
                 5 
                 4.305 
                 31.695 
                 14.702 
                 1.00 
                 39.74 
                 C 
               
               
                 ATOM 
                 40 
                 O 
                 GLN 
                 A 
                 5 
                 4.878 
                 32.804 
                 14.545 
                 1.00 
                 39.27 
                 O 
               
               
                 ATOM 
                 41 
                 N 
                 THR 
                 A 
                 6 
                 3.436 
                 31.431 
                 15.683 
                 1.00 
                 39.68 
                 N 
               
               
                 ATOM 
                 42 
                 CA 
                 THR 
                 A 
                 6 
                 3.127 
                 32.446 
                 16.692 
                 1.00 
                 39.83 
                 C 
               
               
                 ATOM 
                 43 
                 CB 
                 THR 
                 A 
                 6 
                 1.908 
                 33.215 
                 16.266 
                 1.00 
                 39.82 
                 C 
               
               
                 ATOM 
                 44 
                 OG1 
                 THR 
                 A 
                 6 
                 1.666 
                 34.263 
                 17.204 
                 1.00 
                 43.51 
                 O 
               
               
                 ATOM 
                 45 
                 CG2 
                 THR 
                 A 
                 6 
                 0.689 
                 32.306 
                 16.156 
                 1.00 
                 37.32 
                 C 
               
               
                 ATOM 
                 46 
                 C 
                 THR 
                 A 
                 6 
                 3.048 
                 31.917 
                 18.149 
                 1.00 
                 40.58 
                 C 
               
               
                 ATOM 
                 47 
                 O 
                 THR 
                 A 
                 6 
                 2.734 
                 30.743 
                 18.359 
                 1.00 
                 39.70 
                 O 
               
               
                 ATOM 
                 48 
                 N 
                 PRO 
                 A 
                 7 
                 3.405 
                 32.748 
                 19.163 
                 1.00 
                 41.05 
                 N 
               
               
                 ATOM 
                 49 
                 CA 
                 PRO 
                 A 
                 7 
                 3.870 
                 34.153 
                 19.132 
                 1.00 
                 41.58 
                 C 
               
               
                 ATOM 
                 50 
                 CB 
                 PRO 
                 A 
                 7 
                 3.722 
                 34.616 
                 20.587 
                 1.00 
                 41.21 
                 C 
               
               
                 ATOM 
                 51 
                 CG 
                 PRO 
                 A 
                 7 
                 3.829 
                 33.371 
                 21.381 
                 1.00 
                 42.26 
                 C 
               
               
                 ATOM 
                 52 
                 CD 
                 PRO 
                 A 
                 7 
                 3.378 
                 32.213 
                 20.535 
                 1.00 
                 40.83 
                 C 
               
               
                 ATOM 
                 53 
                 C 
                 PRO 
                 A 
                 7 
                 5.323 
                 34.205 
                 18.715 
                 1.00 
                 41.50 
                 C 
               
               
                 ATOM 
                 54 
                 O 
                 PRO 
                 A 
                 7 
                 5.996 
                 33.179 
                 18.810 
                 1.00 
                 40.92 
                 O 
               
               
                 ATOM 
                 55 
                 N 
                 ARG 
                 A 
                 8 
                 5.782 
                 35.367 
                 18.252 
                 1.00 
                 41.56 
                 N 
               
               
                 ATOM 
                 56 
                 CA 
                 ARG 
                 A 
                 8 
                 7.166 
                 35.551 
                 17.879 
                 1.00 
                 42.59 
                 C 
               
               
                 ATOM 
                 57 
                 CB 
                 ARG 
                 A 
                 8 
                 7.324 
                 36.786 
                 16.982 
                 1.00 
                 43.86 
                 C 
               
               
                 ATOM 
                 58 
                 CG 
                 ARG 
                 A 
                 8 
                 8.768 
                 37.127 
                 16.567 
                 1.00 
                 47.00 
                 C 
               
               
                 ATOM 
                 59 
                 CD 
                 ARG 
                 A 
                 8 
                 9.356 
                 36.117 
                 15.546 
                 1.00 
                 52.83 
                 C 
               
               
                 ATOM 
                 60 
                 NE 
                 ARG 
                 A 
                 8 
                 10.695 
                 35.623 
                 15.908 
                 1.00 
                 54.23 
                 N 
               
               
                 ATOM 
                 61 
                 CZ 
                 ARG 
                 A 
                 8 
                 11.824 
                 36.329 
                 15.838 
                 1.00 
                 55.74 
                 C 
               
               
                 ATOM 
                 62 
                 NH1 
                 ARG 
                 A 
                 8 
                 12.973 
                 35.762 
                 16.189 
                 1.00 
                 55.74 
                 N 
               
               
                 ATOM 
                 63 
                 NH2 
                 ARG 
                 A 
                 8 
                 11.817 
                 37.602 
                 15.438 
                 1.00 
                 55.73 
                 N 
               
               
                 ATOM 
                 64 
                 C 
                 ARG 
                 A 
                 8 
                 8.025 
                 35.667 
                 19.144 
                 1.00 
                 42.90 
                 C 
               
               
                 ATOM 
                 65 
                 O 
                 ARG 
                 A 
                 8 
                 9.165 
                 35.198 
                 19.172 
                 1.00 
                 42.04 
                 O 
               
               
                 ATOM 
                 66 
                 N 
                 ILE 
                 A 
                 9 
                 7.469 
                 36.281 
                 20.193 
                 1.00 
                 42.94 
                 N 
               
               
                 ATOM 
                 67 
                 CA 
                 ILE 
                 A 
                 9 
                 8.171 
                 36.410 
                 21.483 
                 1.00 
                 43.38 
                 C 
               
               
                 ATOM 
                 68 
                 CB 
                 ILE 
                 A 
                 9 
                 8.863 
                 37.808 
                 21.679 
                 1.00 
                 43.29 
                 C 
               
               
                 ATOM 
                 69 
                 CG1 
                 ILE 
                 A 
                 9 
                 7.854 
                 38.897 
                 22.063 
                 1.00 
                 42.77 
                 C 
               
               
                 ATOM 
                 70 
                 CD1 
                 ILE 
                 A 
                 9 
                 7.657 
                 40.025 
                 21.036 
                 1.00 
                 44.86 
                 C 
               
               
                 ATOM 
                 71 
                 CG2 
                 ILE 
                 A 
                 9 
                 9.665 
                 38.186 
                 20.442 
                 1.00 
                 44.36 
                 C 
               
               
                 ATOM 
                 72 
                 C 
                 ILE 
                 A 
                 9 
                 7.211 
                 36.153 
                 22.641 
                 1.00 
                 43.85 
                 C 
               
               
                 ATOM 
                 73 
                 O 
                 ILE 
                 A 
                 9 
                 6.005 
                 36.392 
                 22.529 
                 1.00 
                 43.69 
                 O 
               
               
                 ATOM 
                 74 
                 N 
                 ALA 
                 A 
                 10 
                 7.754 
                 35.682 
                 23.758 
                 1.00 
                 44.25 
                 N 
               
               
                 ATOM 
                 75 
                 CA 
                 ALA 
                 A 
                 10 
                 6.946 
                 35.359 
                 24.930 
                 1.00 
                 44.42 
                 C 
               
               
                 ATOM 
                 76 
                 CB 
                 ALA 
                 A 
                 10 
                 6.407 
                 33.930 
                 24.805 
                 1.00 
                 44.54 
                 C 
               
               
                 ATOM 
                 77 
                 C 
                 ALA 
                 A 
                 10 
                 7.777 
                 35.528 
                 26.215 
                 1.00 
                 44.54 
                 C 
               
               
                 ATOM 
                 78 
                 O 
                 ALA 
                 A 
                 10 
                 8.956 
                 35.154 
                 26.271 
                 1.00 
                 44.06 
                 O 
               
               
                 ATOM 
                 79 
                 N 
                 THR 
                 A 
                 11 
                 7.180 
                 36.136 
                 27.231 
                 1.00 
                 44.75 
                 N 
               
               
                 ATOM 
                 80 
                 CA 
                 THR 
                 A 
                 11 
                 7.803 
                 36.159 
                 28.539 
                 1.00 
                 45.12 
                 C 
               
               
                 ATOM 
                 81 
                 CB 
                 THR 
                 A 
                 11 
                 8.201 
                 37.568 
                 28.982 
                 1.00 
                 45.29 
                 C 
               
               
                 ATOM 
                 82 
                 OG1 
                 THR 
                 A 
                 11 
                 7.042 
                 38.405 
                 28.976 
                 1.00 
                 46.91 
                 O 
               
               
                 ATOM 
                 83 
                 CG2 
                 THR 
                 A 
                 11 
                 9.283 
                 38.154 
                 28.075 
                 1.00 
                 46.06 
                 C 
               
               
                 ATOM 
                 84 
                 C 
                 THR 
                 A 
                 11 
                 6.833 
                 35.565 
                 29.545 
                 1.00 
                 45.16 
                 C 
               
               
                 ATOM 
                 85 
                 O 
                 THR 
                 A 
                 11 
                 5.795 
                 36.146 
                 29.848 
                 1.00 
                 45.26 
                 O 
               
               
                 ATOM 
                 86 
                 N 
                 LYS 
                 A 
                 12 
                 7.203 
                 34.397 
                 30.048 
                 1.00 
                 45.15 
                 N 
               
               
                 ATOM 
                 87 
                 CA 
                 LYS 
                 A 
                 12 
                 6.446 
                 33.666 
                 31.037 
                 1.00 
                 45.46 
                 C 
               
               
                 ATOM 
                 88 
                 CB 
                 LYS 
                 A 
                 12 
                 6.323 
                 32.221 
                 30.584 
                 1.00 
                 45.35 
                 C 
               
               
                 ATOM 
                 89 
                 CG 
                 LYS 
                 A 
                 12 
                 5.099 
                 31.914 
                 29.756 
                 1.00 
                 47.76 
                 C 
               
               
                 ATOM 
                 90 
                 CD 
                 LYS 
                 A 
                 12 
                 4.697 
                 33.007 
                 28.777 
                 1.00 
                 49.69 
                 C 
               
               
                 ATOM 
                 91 
                 CE 
                 LYS 
                 A 
                 12 
                 3.521 
                 32.560 
                 27.920 
                 1.00 
                 49.05 
                 C 
               
               
                 ATOM 
                 92 
                 NZ 
                 LYS 
                 A 
                 12 
                 2.306 
                 32.457 
                 28.739 
                 1.00 
                 49.64 
                 N 
               
               
                 ATOM 
                 93 
                 C 
                 LYS 
                 A 
                 12 
                 7.102 
                 33.718 
                 32.424 
                 1.00 
                 45.30 
                 C 
               
               
                 ATOM 
                 94 
                 O 
                 LYS 
                 A 
                 12 
                 8.283 
                 34.053 
                 32.569 
                 1.00 
                 45.21 
                 O 
               
               
                 ATOM 
                 95 
                 N 
                 GLU 
                 A 
                 13 
                 6.302 
                 33.416 
                 33.442 
                 1.00 
                 45.31 
                 N 
               
               
                 ATOM 
                 96 
                 CA 
                 GLU 
                 A 
                 13 
                 6.776 
                 33.188 
                 34.807 
                 1.00 
                 45.37 
                 C 
               
               
                 ATOM 
                 97 
                 CB 
                 GLU 
                 A 
                 13 
                 5.857 
                 33.935 
                 35.759 
                 1.00 
                 45.85 
                 C 
               
               
                 ATOM 
                 98 
                 CG 
                 GLU 
                 A 
                 13 
                 5.752 
                 35.414 
                 35.367 
                 1.00 
                 48.54 
                 C 
               
               
                 ATOM 
                 99 
                 CD 
                 GLU 
                 A 
                 13 
                 4.509 
                 36.109 
                 35.878 
                 1.00 
                 51.63 
                 C 
               
               
                 ATOM 
                 100 
                 OE1 
                 GLU 
                 A 
                 13 
                 4.402 
                 37.334 
                 35.645 
                 1.00 
                 53.17 
                 O 
               
               
                 ATOM 
                 101 
                 OE2 
                 GLU 
                 A 
                 13 
                 3.646 
                 35.448 
                 36.511 
                 1.00 
                 54.08 
                 O 
               
               
                 ATOM 
                 102 
                 C 
                 GLU 
                 A 
                 13 
                 6.797 
                 31.674 
                 35.096 
                 1.00 
                 44.83 
                 C 
               
               
                 ATOM 
                 103 
                 O 
                 GLU 
                 A 
                 13 
                 6.029 
                 30.902 
                 34.496 
                 1.00 
                 43.74 
                 O 
               
               
                 ATOM 
                 104 
                 N 
                 THR 
                 A 
                 14 
                 7.675 
                 31.229 
                 35.986 
                 1.00 
                 44.58 
                 N 
               
               
                 ATOM 
                 105 
                 CA 
                 THR 
                 A 
                 14 
                 7.792 
                 29.794 
                 36.199 
                 1.00 
                 45.00 
                 C 
               
               
                 ATOM 
                 106 
                 CB 
                 THR 
                 A 
                 14 
                 8.810 
                 29.381 
                 37.292 
                 1.00 
                 45.21 
                 C 
               
               
                 ATOM 
                 107 
                 OG1 
                 THR 
                 A 
                 14 
                 8.341 
                 29.745 
                 38.606 
                 1.00 
                 44.01 
                 O 
               
               
                 ATOM 
                 108 
                 CG2 
                 THR 
                 A 
                 14 
                 10.190 
                 29.968 
                 37.006 
                 1.00 
                 45.34 
                 C 
               
               
                 ATOM 
                 109 
                 C 
                 THR 
                 A 
                 14 
                 6.419 
                 29.253 
                 36.532 
                 1.00 
                 45.37 
                 C 
               
               
                 ATOM 
                 110 
                 O 
                 THR 
                 A 
                 14 
                 5.614 
                 29.949 
                 37.138 
                 1.00 
                 45.15 
                 O 
               
               
                 ATOM 
                 111 
                 N 
                 GLY 
                 A 
                 15 
                 6.141 
                 28.031 
                 36.099 
                 1.00 
                 45.55 
                 N 
               
               
                 ATOM 
                 112 
                 CA 
                 GLY 
                 A 
                 15 
                 4.838 
                 27.446 
                 36.328 
                 1.00 
                 45.89 
                 C 
               
               
                 ATOM 
                 113 
                 C 
                 GLY 
                 A 
                 15 
                 3.778 
                 27.733 
                 35.276 
                 1.00 
                 46.24 
                 C 
               
               
                 ATOM 
                 114 
                 O 
                 GLY 
                 A 
                 15 
                 2.773 
                 27.020 
                 35.217 
                 1.00 
                 47.04 
                 O 
               
               
                 ATOM 
                 115 
                 N 
                 GLU 
                 A 
                 16 
                 3.978 
                 28.754 
                 34.439 
                 1.00 
                 46.01 
                 N 
               
               
                 ATOM 
                 116 
                 CA 
                 GLU 
                 A 
                 16 
                 3.004 
                 29.052 
                 33.376 
                 1.00 
                 45.58 
                 C 
               
               
                 ATOM 
                 117 
                 CB 
                 GLU 
                 A 
                 16 
                 3.171 
                 30.483 
                 32.865 
                 1.00 
                 45.77 
                 C 
               
               
                 ATOM 
                 118 
                 CG 
                 GLU 
                 A 
                 16 
                 2.684 
                 31.561 
                 33.810 
                 1.00 
                 45.94 
                 C 
               
               
                 ATOM 
                 119 
                 CD 
                 GLU 
                 A 
                 16 
                 2.551 
                 32.924 
                 33.137 
                 1.00 
                 46.28 
                 C 
               
               
                 ATOM 
                 120 
                 OE1 
                 GLU 
                 A 
                 16 
                 1.414 
                 33.434 
                 33.026 
                 1.00 
                 48.01 
                 O 
               
               
                 ATOM 
                 121 
                 OE2 
                 GLU 
                 A 
                 16 
                 3.577 
                 33.492 
                 32.719 
                 1.00 
                 46.37 
                 O 
               
               
                 ATOM 
                 122 
                 C 
                 GLU 
                 A 
                 16 
                 3.100 
                 28.042 
                 32.214 
                 1.00 
                 44.90 
                 C 
               
               
                 ATOM 
                 123 
                 O 
                 GLU 
                 A 
                 16 
                 3.937 
                 27.152 
                 32.242 
                 1.00 
                 44.86 
                 O 
               
               
                 ATOM 
                 124 
                 N 
                 SER 
                 A 
                 17 
                 2.217 
                 28.187 
                 31.224 
                 1.00 
                 44.50 
                 N 
               
               
                 ATOM 
                 125 
                 CA 
                 SER 
                 A 
                 17 
                 2.222 
                 27.396 
                 29.989 
                 1.00 
                 44.60 
                 C 
               
               
                 ATOM 
                 126 
                 CB 
                 SER 
                 A 
                 17 
                 0.842 
                 26.775 
                 29.738 
                 1.00 
                 44.45 
                 C 
               
               
                 ATOM 
                 127 
                 OG 
                 SER 
                 A 
                 17 
                 0.453 
                 25.965 
                 30.811 
                 1.00 
                 44.72 
                 O 
               
               
                 ATOM 
                 128 
                 C 
                 SER 
                 A 
                 17 
                 2.523 
                 28.302 
                 28.823 
                 1.00 
                 44.08 
                 C 
               
               
                 ATOM 
                 129 
                 O 
                 SER 
                 A 
                 17 
                 2.185 
                 29.476 
                 28.861 
                 1.00 
                 44.27 
                 O 
               
               
                 ATOM 
                 130 
                 N 
                 LEU 
                 A 
                 18 
                 3.128 
                 27.748 
                 27.783 
                 1.00 
                 44.07 
                 N 
               
               
                 ATOM 
                 131 
                 CA 
                 LEU 
                 A 
                 18 
                 3.221 
                 28.413 
                 26.500 
                 1.00 
                 44.43 
                 C 
               
               
                 ATOM 
                 132 
                 CB 
                 LEU 
                 A 
                 18 
                 4.676 
                 28.794 
                 26.169 
                 1.00 
                 44.33 
                 C 
               
               
                 ATOM 
                 133 
                 CG 
                 LEU 
                 A 
                 18 
                 4.894 
                 29.325 
                 24.724 
                 1.00 
                 45.37 
                 C 
               
               
                 ATOM 
                 134 
                 CD1 
                 LEU 
                 A 
                 18 
                 4.372 
                 30.754 
                 24.566 
                 1.00 
                 46.79 
                 C 
               
               
                 ATOM 
                 135 
                 CD2 
                 LEU 
                 A 
                 18 
                 6.337 
                 29.238 
                 24.266 
                 1.00 
                 44.61 
                 C 
               
               
                 ATOM 
                 136 
                 C 
                 LEU 
                 A 
                 18 
                 2.643 
                 27.515 
                 25.389 
                 1.00 
                 44.31 
                 C 
               
               
                 ATOM 
                 137 
                 O 
                 LEU 
                 A 
                 18 
                 2.907 
                 26.316 
                 25.342 
                 1.00 
                 45.00 
                 O 
               
               
                 ATOM 
                 138 
                 N 
                 THR 
                 A 
                 19 
                 1.845 
                 28.108 
                 24.511 
                 1.00 
                 43.57 
                 N 
               
               
                 ATOM 
                 139 
                 CA 
                 THR 
                 A 
                 19 
                 1.392 
                 27.424 
                 23.329 
                 1.00 
                 42.81 
                 C 
               
               
                 ATOM 
                 140 
                 CB 
                 THR 
                 A 
                 19 
                 −0.133 
                 27.292 
                 23.333 
                 1.00 
                 43.09 
                 C 
               
               
                 ATOM 
                 141 
                 OG1 
                 THR 
                 A 
                 19 
                 −0.529 
                 26.408 
                 24.397 
                 1.00 
                 41.89 
                 O 
               
               
                 ATOM 
                 142 
                 CG2 
                 THR 
                 A 
                 19 
                 −0.661 
                 26.725 
                 22.038 
                 1.00 
                 42.37 
                 C 
               
               
                 ATOM 
                 143 
                 C 
                 THR 
                 A 
                 19 
                 1.956 
                 28.171 
                 22.123 
                 1.00 
                 42.99 
                 C 
               
               
                 ATOM 
                 144 
                 O 
                 THR 
                 A 
                 19 
                 1.816 
                 29.395 
                 21.994 
                 1.00 
                 43.18 
                 O 
               
               
                 ATOM 
                 145 
                 N 
                 ILE 
                 A 
                 20 
                 2.676 
                 27.437 
                 21.289 
                 1.00 
                 42.98 
                 N 
               
               
                 ATOM 
                 146 
                 CA 
                 ILE 
                 A 
                 20 
                 3.236 
                 27.974 
                 20.038 
                 1.00 
                 42.80 
                 C 
               
               
                 ATOM 
                 147 
                 CB 
                 ILE 
                 A 
                 20 
                 4.705 
                 27.584 
                 19.883 
                 1.00 
                 43.04 
                 C 
               
               
                 ATOM 
                 148 
                 CG1 
                 ILE 
                 A 
                 20 
                 5.526 
                 28.107 
                 21.081 
                 1.00 
                 43.37 
                 C 
               
               
                 ATOM 
                 149 
                 CD1 
                 ILE 
                 A 
                 20 
                 6.953 
                 27.570 
                 21.100 
                 1.00 
                 44.96 
                 C 
               
               
                 ATOM 
                 150 
                 CG2 
                 ILE 
                 A 
                 20 
                 5.277 
                 28.026 
                 18.480 
                 1.00 
                 43.19 
                 C 
               
               
                 ATOM 
                 151 
                 C 
                 ILE 
                 A 
                 20 
                 2.446 
                 27.323 
                 18.917 
                 1.00 
                 42.22 
                 C 
               
               
                 ATOM 
                 152 
                 O 
                 ILE 
                 A 
                 20 
                 2.329 
                 26.084 
                 18.880 
                 1.00 
                 41.41 
                 O 
               
               
                 ATOM 
                 153 
                 N 
                 ASN 
                 A 
                 21 
                 1.875 
                 28.159 
                 18.052 
                 1.00 
                 41.71 
                 N 
               
               
                 ATOM 
                 154 
                 CA 
                 ASN 
                 A 
                 21 
                 1.036 
                 27.726 
                 16.926 
                 1.00 
                 42.93 
                 C 
               
               
                 ATOM 
                 155 
                 CB 
                 ASN 
                 A 
                 21 
                 −0.183 
                 28.639 
                 16.820 
                 1.00 
                 42.54 
                 C 
               
               
                 ATOM 
                 156 
                 CG 
                 ASN 
                 A 
                 21 
                 −0.976 
                 28.682 
                 18.083 
                 1.00 
                 44.72 
                 C 
               
               
                 ATOM 
                 157 
                 OD1 
                 ASN 
                 A 
                 21 
                 −1.349 
                 29.757 
                 18.551 
                 1.00 
                 45.71 
                 O 
               
               
                 ATOM 
                 158 
                 ND2 
                 ASN 
                 A 
                 21 
                 −1.219 
                 27.513 
                 18.674 
                 1.00 
                 42.93 
                 N 
               
               
                 ATOM 
                 159 
                 C 
                 ASN 
                 A 
                 21 
                 1.770 
                 27.795 
                 15.592 
                 1.00 
                 43.02 
                 C 
               
               
                 ATOM 
                 160 
                 O 
                 ASN 
                 A 
                 21 
                 2.331 
                 28.828 
                 15.282 
                 1.00 
                 43.10 
                 O 
               
               
                 ATOM 
                 161 
                 N 
                 CYS 
                 A 
                 22 
                 1.766 
                 26.706 
                 14.818 
                 1.00 
                 43.57 
                 N 
               
               
                 ATOM 
                 162 
                 CA 
                 CYS 
                 A 
                 22 
                 2.380 
                 26.727 
                 13.466 
                 1.00 
                 44.69 
                 C 
               
               
                 ATOM 
                 163 
                 CB 
                 CYS 
                 A 
                 22 
                 3.504 
                 25.707 
                 13.321 
                 1.00 
                 44.60 
                 C 
               
               
                 ATOM 
                 164 
                 SG 
                 CYS 
                 A 
                 22 
                 4.986 
                 26.277 
                 14.143 
                 1.00 
                 50.05 
                 S 
               
               
                 ATOM 
                 165 
                 C 
                 CYS 
                 A 
                 22 
                 1.353 
                 26.444 
                 12.415 
                 1.00 
                 43.98 
                 C 
               
               
                 ATOM 
                 166 
                 O 
                 CYS 
                 A 
                 22 
                 0.883 
                 25.306 
                 12.305 
                 1.00 
                 44.31 
                 O 
               
               
                 ATOM 
                 167 
                 N 
                 VAL 
                 A 
                 23 
                 0.991 
                 27.470 
                 11.656 
                 1.00 
                 42.86 
                 N 
               
               
                 ATOM 
                 168 
                 CA 
                 VAL 
                 A 
                 23 
                 0.041 
                 27.309 
                 10.574 
                 1.00 
                 42.98 
                 C 
               
               
                 ATOM 
                 169 
                 CB 
                 VAL 
                 A 
                 23 
                 −1.009 
                 28.482 
                 10.517 
                 1.00 
                 42.82 
                 C 
               
               
                 ATOM 
                 170 
                 CG1 
                 VAL 
                 A 
                 23 
                 −1.749 
                 28.606 
                 11.828 
                 1.00 
                 42.81 
                 C 
               
               
                 ATOM 
                 171 
                 CG2 
                 VAL 
                 A 
                 23 
                 −0.349 
                 29.798 
                 10.236 
                 1.00 
                 43.32 
                 C 
               
               
                 ATOM 
                 172 
                 C 
                 VAL 
                 A 
                 23 
                 0.776 
                 27.117 
                 9.224 
                 1.00 
                 42.77 
                 C 
               
               
                 ATOM 
                 173 
                 O 
                 VAL 
                 A 
                 23 
                 1.634 
                 27.906 
                 8.863 
                 1.00 
                 42.18 
                 O 
               
               
                 ATOM 
                 174 
                 N 
                 LEU 
                 A 
                 24 
                 0.440 
                 26.055 
                 8.498 
                 1.00 
                 43.14 
                 N 
               
               
                 ATOM 
                 175 
                 CA 
                 LEU 
                 A 
                 24 
                 1.036 
                 25.814 
                 7.191 
                 1.00 
                 43.73 
                 C 
               
               
                 ATOM 
                 176 
                 CB 
                 LEU 
                 A 
                 24 
                 1.249 
                 24.329 
                 6.928 
                 1.00 
                 43.14 
                 C 
               
               
                 ATOM 
                 177 
                 CG 
                 LEU 
                 A 
                 24 
                 1.546 
                 23.903 
                 5.485 
                 1.00 
                 43.95 
                 C 
               
               
                 ATOM 
                 178 
                 CD1 
                 LEU 
                 A 
                 24 
                 1.681 
                 22.390 
                 5.387 
                 1.00 
                 43.88 
                 C 
               
               
                 ATOM 
                 179 
                 CD2 
                 LEU 
                 A 
                 24 
                 2.799 
                 24.576 
                 4.951 
                 1.00 
                 41.94 
                 C 
               
               
                 ATOM 
                 180 
                 C 
                 LEU 
                 A 
                 24 
                 0.134 
                 26.444 
                 6.139 
                 1.00 
                 44.52 
                 C 
               
               
                 ATOM 
                 181 
                 O 
                 LEU 
                 A 
                 24 
                 −0.906 
                 25.887 
                 5.749 
                 1.00 
                 44.87 
                 O 
               
               
                 ATOM 
                 182 
                 N 
                 ARG 
                 A 
                 25 
                 0.528 
                 27.626 
                 5.692 
                 1.00 
                 44.92 
                 N 
               
               
                 ATOM 
                 183 
                 CA 
                 ARG 
                 A 
                 25 
                 −0.296 
                 28.383 
                 4.783 
                 1.00 
                 45.81 
                 C 
               
               
                 ATOM 
                 184 
                 CB 
                 ARG 
                 A 
                 25 
                 −0.088 
                 29.882 
                 5.010 
                 1.00 
                 45.82 
                 C 
               
               
                 ATOM 
                 185 
                 CG 
                 ARG 
                 A 
                 25 
                 −0.384 
                 30.338 
                 6.442 
                 1.00 
                 47.76 
                 C 
               
               
                 ATOM 
                 186 
                 CD 
                 ARG 
                 A 
                 25 
                 −1.877 
                 30.620 
                 6.729 
                 1.00 
                 50.07 
                 C 
               
               
                 ATOM 
                 187 
                 NE 
                 ARG 
                 A 
                 25 
                 −2.337 
                 31.949 
                 6.312 
                 1.00 
                 53.50 
                 N 
               
               
                 ATOM 
                 188 
                 CZ 
                 ARG 
                 A 
                 25 
                 −1.548 
                 32.969 
                 5.958 
                 1.00 
                 55.85 
                 C 
               
               
                 ATOM 
                 189 
                 NH1 
                 ARG 
                 A 
                 25 
                 −0.231 
                 32.824 
                 5.983 
                 1.00 
                 56.20 
                 N 
               
               
                 ATOM 
                 190 
                 NH2 
                 ARG 
                 A 
                 25 
                 −2.074 
                 34.141 
                 5.571 
                 1.00 
                 55.64 
                 N 
               
               
                 ATOM 
                 191 
                 C 
                 ARG 
                 A 
                 25 
                 0.043 
                 27.961 
                 3.361 
                 1.00 
                 46.02 
                 C 
               
               
                 ATOM 
                 192 
                 O 
                 ARG 
                 A 
                 25 
                 1.085 
                 28.348 
                 2.822 
                 1.00 
                 45.99 
                 O 
               
               
                 ATOM 
                 193 
                 N 
                 ARP 
                 A 
                 26 
                 −0.843 
                 27.155 
                 2.777 
                 1.00 
                 46.53 
                 N 
               
               
                 ATOM 
                 194 
                 CA 
                 ASP 
                 A 
                 26 
                 −0.624 
                 26.523 
                 1.488 
                 1.00 
                 47.22 
                 C 
               
               
                 ATOM 
                 195 
                 CB 
                 ASP 
                 A 
                 26 
                 0.407 
                 25.390 
                 1.604 
                 1.00 
                 47.06 
                 C 
               
               
                 ATOM 
                 196 
                 CG 
                 ASP 
                 A 
                 26 
                 0.809 
                 24.833 
                 0.248 
                 1.00 
                 46.67 
                 C 
               
               
                 ATOM 
                 197 
                 OD1 
                 ASP 
                 A 
                 26 
                 0.263 
                 25.302 
                 −0.772 
                 1.00 
                 46.55 
                 O 
               
               
                 ATOM 
                 198 
                 OD2 
                 ASP 
                 A 
                 26 
                 1.676 
                 23.946 
                 0.195 
                 1.00 
                 46.05 
                 O 
               
               
                 ATOM 
                 199 
                 C 
                 ASP 
                 A 
                 26 
                 −1.901 
                 25.928 
                 0.953 
                 1.00 
                 47.74 
                 C 
               
               
                 ATOM 
                 200 
                 O 
                 ASP 
                 A 
                 26 
                 −2.360 
                 24.914 
                 1.462 
                 1.00 
                 49.08 
                 O 
               
               
                 ATOM 
                 201 
                 N 
                 THR 
                 A 
                 27 
                 −2.452 
                 26.524 
                 −0.096 
                 1.00 
                 48.30 
                 N 
               
               
                 ATOM 
                 202 
                 CA 
                 THR 
                 A 
                 27 
                 −3.694 
                 26.029 
                 −0.712 
                 1.00 
                 48.55 
                 C 
               
               
                 ATOM 
                 203 
                 CB 
                 THR 
                 A 
                 27 
                 −4.261 
                 27.048 
                 −1.707 
                 1.00 
                 48.30 
                 C 
               
               
                 ATOM 
                 204 
                 OG1 
                 THR 
                 A 
                 27 
                 −3.194 
                 27.563 
                 −2.505 
                 1.00 
                 48.97 
                 O 
               
               
                 ATOM 
                 205 
                 CG2 
                 THR 
                 A 
                 27 
                 −4.952 
                 28.201 
                 −0.984 
                 1.00 
                 48.44 
                 C 
               
               
                 ATOM 
                 206 
                 C 
                 THR 
                 A 
                 27 
                 −3.548 
                 24.685 
                 −1.447 
                 1.00 
                 48.44 
                 C 
               
               
                 ATOM 
                 207 
                 O 
                 THR 
                 A 
                 27 
                 −4.559 
                 24.048 
                 −1.785 
                 1.00 
                 48.34 
                 O 
               
               
                 ATOM 
                 208 
                 N 
                 ALA 
                 A 
                 28 
                 −2.300 
                 24.264 
                 −1.679 
                 1.00 
                 47.65 
                 N 
               
               
                 ATOM 
                 209 
                 CA 
                 ALA 
                 A 
                 28 
                 −2.003 
                 23.004 
                 −2.379 
                 1.00 
                 46.66 
                 C 
               
               
                 ATOM 
                 210 
                 CB 
                 ALA 
                 A 
                 28 
                 −0.974 
                 23.244 
                 −3.482 
                 1.00 
                 46.92 
                 C 
               
               
                 ATOM 
                 211 
                 C 
                 ALA 
                 A 
                 28 
                 −1.610 
                 21.758 
                 −1.522 
                 1.00 
                 46.70 
                 C 
               
               
                 ATOM 
                 212 
                 O 
                 ALA 
                 A 
                 28 
                 −1.761 
                 20.627 
                 −2.016 
                 1.00 
                 46.77 
                 O 
               
               
                 ATOM 
                 213 
                 N 
                 CYS 
                 A 
                 29 
                 −1.129 
                 21.935 
                 −0.279 
                 1.00 
                 45.33 
                 N 
               
               
                 ATOM 
                 214 
                 CA 
                 CYS 
                 A 
                 29 
                 −0.631 
                 20.784 
                 0.521 
                 1.00 
                 44.73 
                 C 
               
               
                 ATOM 
                 215 
                 CB 
                 CYS 
                 A 
                 29 
                 0.909 
                 20.674 
                 0.491 
                 1.00 
                 44.19 
                 C 
               
               
                 ATOM 
                 216 
                 SG 
                 CYS 
                 A 
                 29 
                 1.740 
                 20.865 
                 −1.109 
                 1.00 
                 44.32 
                 S 
               
               
                 ATOM 
                 217 
                 C 
                 CYS 
                 A 
                 29 
                 −1.074 
                 20.722 
                 1.983 
                 1.00 
                 43.81 
                 C 
               
               
                 ATOM 
                 218 
                 O 
                 CYS 
                 A 
                 29 
                 −1.289 
                 21.754 
                 2.630 
                 1.00 
                 43.43 
                 O 
               
               
                 ATOM 
                 219 
                 N 
                 ALA 
                 A 
                 30 
                 −1.164 
                 19.495 
                 2.495 
                 1.00 
                 42.66 
                 N 
               
               
                 ATOM 
                 220 
                 CA 
                 ALA 
                 A 
                 30 
                 −1.505 
                 19.233 
                 3.886 
                 1.00 
                 42.28 
                 C 
               
               
                 ATOM 
                 221 
                 CB 
                 ALA 
                 A 
                 30 
                 −2.285 
                 17.930 
                 3.997 
                 1.00 
                 42.02 
                 C 
               
               
                 ATOM 
                 222 
                 C 
                 ALA 
                 A 
                 30 
                 −0.269 
                 19.154 
                 4.771 
                 1.00 
                 41.62 
                 C 
               
               
                 ATOM 
                 223 
                 O 
                 ALA 
                 A 
                 30 
                 0.712 
                 18.511 
                 4.429 
                 1.00 
                 41.53 
                 O 
               
               
                 ATOM 
                 224 
                 N 
                 LEU 
                 A 
                 31 
                 −0.325 
                 19.794 
                 5.923 
                 1.00 
                 41.91 
                 N 
               
               
                 ATOM 
                 225 
                 CA 
                 LEU 
                 A 
                 31 
                 0.662 
                 19.561 
                 6.967 
                 1.00 
                 42.25 
                 C 
               
               
                 ATOM 
                 226 
                 CB 
                 LEU 
                 A 
                 31 
                 0.404 
                 20.523 
                 8.124 
                 1.00 
                 42.32 
                 C 
               
               
                 ATOM 
                 227 
                 CG 
                 LEU 
                 A 
                 31 
                 1.190 
                 20.318 
                 9.432 
                 1.00 
                 43.10 
                 C 
               
               
                 ATOM 
                 228 
                 CD1 
                 LEU 
                 A 
                 31 
                 0.828 
                 21.343 
                 10.499 
                 1.00 
                 44.14 
                 C 
               
               
                 ATOM 
                 229 
                 CD2 
                 LEU 
                 A 
                 31 
                 2.648 
                 20.360 
                 9.184 
                 1.00 
                 41.11 
                 C 
               
               
                 ATOM 
                 230 
                 C 
                 LEU 
                 A 
                 31 
                 0.556 
                 18.104 
                 7.445 
                 1.00 
                 42.95 
                 C 
               
               
                 ATOM 
                 231 
                 O 
                 LEU 
                 A 
                 31 
                 −0.355 
                 17.764 
                 8.187 
                 1.00 
                 42.73 
                 O 
               
               
                 ATOM 
                 232 
                 N 
                 ASP 
                 A 
                 32 
                 1.461 
                 17.234 
                 7.017 
                 1.00 
                 44.01 
                 N 
               
               
                 ATOM 
                 233 
                 CA 
                 ASP 
                 A 
                 32 
                 1.352 
                 15.832 
                 7.416 
                 1.00 
                 45.57 
                 C 
               
               
                 ATOM 
                 234 
                 CB 
                 ASP 
                 A 
                 32 
                 1.979 
                 14.882 
                 6.399 
                 1.00 
                 45.87 
                 C 
               
               
                 ATOM 
                 235 
                 CG 
                 ASP 
                 A 
                 32 
                 1.289 
                 13.517 
                 6.377 
                 1.00 
                 48.45 
                 C 
               
               
                 ATOM 
                 236 
                 OD1 
                 ASP 
                 A 
                 32 
                 1.974 
                 12.499 
                 6.104 
                 1.00 
                 51.52 
                 O 
               
               
                 ATOM 
                 237 
                 OD2 
                 ASP 
                 A 
                 32 
                 0.056 
                 13.451 
                 6.625 
                 1.00 
                 51.42 
                 O 
               
               
                 ATOM 
                 238 
                 C 
                 ASP 
                 A 
                 32 
                 1.928 
                 15.561 
                 8.799 
                 1.00 
                 46.12 
                 C 
               
               
                 ATOM 
                 239 
                 O 
                 ASP 
                 A 
                 32 
                 1.336 
                 14.820 
                 9.586 
                 1.00 
                 48.01 
                 O 
               
               
                 ATOM 
                 240 
                 N 
                 SER 
                 A 
                 33 
                 3.060 
                 16.168 
                 9.112 
                 1.00 
                 45.67 
                 N 
               
               
                 ATOM 
                 241 
                 CA 
                 SER 
                 A 
                 33 
                 3.754 
                 15.910 
                 10.367 
                 1.00 
                 45.25 
                 C 
               
               
                 ATOM 
                 242 
                 CB 
                 SER 
                 A 
                 33 
                 4.803 
                 14.811 
                 10.179 
                 1.00 
                 45.41 
                 C 
               
               
                 ATOM 
                 243 
                 OG 
                 SER 
                 A 
                 33 
                 4.209 
                 13.522 
                 10.260 
                 1.00 
                 47.47 
                 O 
               
               
                 ATOM 
                 244 
                 C 
                 SER 
                 A 
                 33 
                 4.436 
                 17.192 
                 10.801 
                 1.00 
                 44.88 
                 C 
               
               
                 ATOM 
                 245 
                 O 
                 SER 
                 A 
                 33 
                 4.494 
                 18.142 
                 10.048 
                 1.00 
                 44.07 
                 O 
               
               
                 ATOM 
                 246 
                 N 
                 THR 
                 A 
                 34 
                 4.924 
                 17.211 
                 12.037 
                 1.00 
                 44.87 
                 N 
               
               
                 ATOM 
                 247 
                 CA 
                 THR 
                 A 
                 34 
                 5.688 
                 18.333 
                 12.566 
                 1.00 
                 44.62 
                 C 
               
               
                 ATOM 
                 248 
                 CB 
                 THR 
                 A 
                 34 
                 4.807 
                 19.303 
                 13.360 
                 1.00 
                 44.16 
                 C 
               
               
                 ATOM 
                 249 
                 OG1 
                 THR 
                 A 
                 34 
                 3.591 
                 19.534 
                 12.654 
                 1.00 
                 45.91 
                 O 
               
               
                 ATOM 
                 250 
                 CG2 
                 THR 
                 A 
                 34 
                 5.499 
                 20.667 
                 13.570 
                 1.00 
                 44.99 
                 C 
               
               
                 ATOM 
                 251 
                 C 
                 THR 
                 A 
                 34 
                 6.725 
                 17.760 
                 13.515 
                 1.00 
                 44.44 
                 C 
               
               
                 ATOM 
                 252 
                 O 
                 THR 
                 A 
                 34 
                 6.480 
                 16.725 
                 14.145 
                 1.00 
                 44.41 
                 O 
               
               
                 ATOM 
                 253 
                 N 
                 ASN 
                 A 
                 35 
                 7.886 
                 18.407 
                 13.577 
                 1.00 
                 43.58 
                 N 
               
               
                 ATOM 
                 254 
                 CA 
                 ASN 
                 A 
                 35 
                 8.814 
                 18.241 
                 14.693 
                 1.00 
                 42.87 
                 C 
               
               
                 ATOM 
                 255 
                 CB 
                 ASN 
                 A 
                 35 
                 10.126 
                 17.582 
                 14.245 
                 1.00 
                 45.18 
                 C 
               
               
                 ATOM 
                 256 
                 CG 
                 ASN 
                 A 
                 35 
                 9.995 
                 16.083 
                 13.991 
                 1.00 
                 47.53 
                 C 
               
               
                 ATOM 
                 257 
                 OD1 
                 ASN 
                 A 
                 35 
                 9.134 
                 15.403 
                 14.564 
                 1.00 
                 54.08 
                 O 
               
               
                 ATOM 
                 258 
                 ND2 
                 ASN 
                 A 
                 35 
                 10.873 
                 15.555 
                 13.136 
                 1.00 
                 49.76 
                 N 
               
               
                 ATOM 
                 259 
                 C 
                 ASN 
                 A 
                 35 
                 9.074 
                 19.624 
                 15.301 
                 1.00 
                 41.97 
                 C 
               
               
                 ATOM 
                 260 
                 O 
                 ASN 
                 A 
                 35 
                 8.830 
                 20.677 
                 14.667 
                 1.00 
                 40.57 
                 O 
               
               
                 ATOM 
                 261 
                 N 
                 TRP 
                 A 
                 36 
                 9.528 
                 19.609 
                 16.542 
                 1.00 
                 40.82 
                 N 
               
               
                 ATOM 
                 262 
                 CA 
                 TRP 
                 A 
                 36 
                 9.709 
                 20.808 
                 17.311 
                 1.00 
                 40.85 
                 C 
               
               
                 ATOM 
                 263 
                 CB 
                 TRP 
                 A 
                 36 
                 8.676 
                 20.850 
                 18.471 
                 1.00 
                 41.37 
                 C 
               
               
                 ATOM 
                 264 
                 CG 
                 TRP 
                 A 
                 36 
                 7.177 
                 20.913 
                 17.976 
                 1.00 
                 40.86 
                 C 
               
               
                 ATOM 
                 265 
                 CD1 
                 TRP 
                 A 
                 36 
                 6.334 
                 19.850 
                 17.742 
                 1.00 
                 40.28 
                 C 
               
               
                 ATOM 
                 266 
                 NE1 
                 TRP 
                 A 
                 36 
                 5.096 
                 20.302 
                 17.342 
                 1.00 
                 40.69 
                 N 
               
               
                 ATOM 
                 267 
                 CE2 
                 TRP 
                 A 
                 36 
                 5.132 
                 21.676 
                 17.280 
                 1.00 
                 40.81 
                 C 
               
               
                 ATOM 
                 268 
                 CD2 
                 TRP 
                 A 
                 36 
                 6.426 
                 22.091 
                 17.646 
                 1.00 
                 39.78 
                 C 
               
               
                 ATOM 
                 269 
                 CE3 
                 TRP 
                 A 
                 36 
                 6.709 
                 23.467 
                 17.680 
                 1.00 
                 42.09 
                 C 
               
               
                 ATOM 
                 270 
                 CZ3 
                 TRP 
                 A 
                 36 
                 5.707 
                 24.367 
                 17.335 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 271 
                 CH2 
                 TRP 
                 A 
                 36 
                 4.455 
                 23.918 
                 16.931 
                 1.00 
                 41.78 
                 C 
               
               
                 ATOM 
                 272 
                 CZ2 
                 TRP 
                 A 
                 36 
                 4.136 
                 22.578 
                 16.914 
                 1.00 
                 40.38 
                 C 
               
               
                 ATOM 
                 273 
                 C 
                 TRP 
                 A 
                 36 
                 11.133 
                 20.823 
                 17.820 
                 1.00 
                 40.66 
                 C 
               
               
                 ATOM 
                 274 
                 O 
                 TRP 
                 A 
                 36 
                 11.659 
                 19.781 
                 18.190 
                 1.00 
                 38.51 
                 O 
               
               
                 ATOM 
                 275 
                 N 
                 TYR 
                 A 
                 37 
                 11.749 
                 22.013 
                 17.804 
                 1.00 
                 40.65 
                 N 
               
               
                 ATOM 
                 276 
                 CA 
                 TYR 
                 A 
                 37 
                 13.153 
                 22.209 
                 18.092 
                 1.00 
                 41.40 
                 C 
               
               
                 ATOM 
                 277 
                 CB 
                 TYR 
                 A 
                 37 
                 13.942 
                 22.596 
                 16.813 
                 1.00 
                 42.81 
                 C 
               
               
                 ATOM 
                 278 
                 CG 
                 TYR 
                 A 
                 37 
                 13.855 
                 21.544 
                 15.747 
                 1.00 
                 44.19 
                 C 
               
               
                 ATOM 
                 279 
                 CD1 
                 TYR 
                 A 
                 37 
                 12.811 
                 21.548 
                 14.841 
                 1.00 
                 46.04 
                 C 
               
               
                 ATOM 
                 280 
                 CE1 
                 TYR 
                 A 
                 37 
                 12.690 
                 20.563 
                 13.899 
                 1.00 
                 47.40 
                 C 
               
               
                 ATOM 
                 281 
                 CZ 
                 TYR 
                 A 
                 37 
                 13.604 
                 19.559 
                 13.838 
                 1.00 
                 47.21 
                 C 
               
               
                 ATOM 
                 282 
                 OH 
                 TYR 
                 A 
                 37 
                 13.457 
                 18.596 
                 12.859 
                 1.00 
                 47.93 
                 O 
               
               
                 ATOM 
                 283 
                 CE2 
                 TYR 
                 A 
                 37 
                 14.669 
                 19.518 
                 14.740 
                 1.00 
                 46.59 
                 C 
               
               
                 ATOM 
                 284 
                 CD2 
                 TYR 
                 A 
                 37 
                 14.769 
                 20.499 
                 15.698 
                 1.00 
                 44.56 
                 C 
               
               
                 ATOM 
                 285 
                 C 
                 TYR 
                 A 
                 37 
                 13.333 
                 23.320 
                 19.098 
                 1.00 
                 42.34 
                 C 
               
               
                 ATOM 
                 286 
                 O 
                 TYR 
                 A 
                 37 
                 12.664 
                 24.359 
                 19.009 
                 1.00 
                 42.93 
                 O 
               
               
                 ATOM 
                 287 
                 N 
                 ARG 
                 A 
                 38 
                 14.264 
                 23.110 
                 20.015 
                 1.00 
                 42.19 
                 N 
               
               
                 ATOM 
                 288 
                 CA 
                 ARG 
                 A 
                 38 
                 14.595 
                 24.070 
                 21.025 
                 1.00 
                 42.96 
                 C 
               
               
                 ATOM 
                 289 
                 CB 
                 ARG 
                 A 
                 38 
                 14.270 
                 23.477 
                 22.397 
                 1.00 
                 42.92 
                 C 
               
               
                 ATOM 
                 290 
                 CG 
                 ARG 
                 A 
                 38 
                 14.763 
                 24.313 
                 23.558 
                 1.00 
                 44.39 
                 C 
               
               
                 ATOM 
                 291 
                 CD 
                 ARG 
                 A 
                 38 
                 14.561 
                 23.598 
                 24.854 
                 1.00 
                 44.38 
                 C 
               
               
                 ATOM 
                 292 
                 NE 
                 ARG 
                 A 
                 38 
                 15.527 
                 22.532 
                 25.049 
                 1.00 
                 45.25 
                 N 
               
               
                 ATOM 
                 293 
                 CZ 
                 ARG 
                 A 
                 38 
                 15.442 
                 21.627 
                 26.008 
                 1.00 
                 45.72 
                 C 
               
               
                 ATOM 
                 294 
                 NH1 
                 ARG 
                 A 
                 38 
                 14.428 
                 21.656 
                 26.880 
                 1.00 
                 47.04 
                 N 
               
               
                 ATOM 
                 295 
                 NH2 
                 ARG 
                 A 
                 38 
                 16.370 
                 20.697 
                 26.090 
                 1.00 
                 46.29 
                 N 
               
               
                 ATOM 
                 296 
                 C 
                 ARG 
                 A 
                 38 
                 16.066 
                 24.380 
                 20.947 
                 1.00 
                 42.48 
                 C 
               
               
                 ATOM 
                 297 
                 O 
                 ARG 
                 A 
                 38 
                 16.886 
                 23.480 
                 20.836 
                 1.00 
                 41.77 
                 O 
               
               
                 ATOM 
                 298 
                 N 
                 THR 
                 A 
                 39 
                 16.385 
                 25.665 
                 20.950 
                 1.00 
                 42.48 
                 N 
               
               
                 ATOM 
                 299 
                 CA 
                 THR 
                 A 
                 39 
                 17.734 
                 26.114 
                 21.184 
                 1.00 
                 42.41 
                 C 
               
               
                 ATOM 
                 300 
                 CB 
                 THR 
                 A 
                 39 
                 18.241 
                 27.037 
                 20.048 
                 1.00 
                 42.54 
                 C 
               
               
                 ATOM 
                 301 
                 OG1 
                 THR 
                 A 
                 39 
                 18.228 
                 26.312 
                 18.820 
                 1.00 
                 42.53 
                 O 
               
               
                 ATOM 
                 302 
                 CG2 
                 THR 
                 A 
                 39 
                 19.673 
                 27.527 
                 20.311 
                 1.00 
                 41.06 
                 C 
               
               
                 ATOM 
                 303 
                 C 
                 THR 
                 A 
                 39 
                 17.676 
                 26.873 
                 22.510 
                 1.00 
                 42.92 
                 C 
               
               
                 ATOM 
                 304 
                 O 
                 THR 
                 A 
                 39 
                 17.003 
                 27.900 
                 22.564 
                 1.00 
                 42.88 
                 O 
               
               
                 ATOM 
                 305 
                 N 
                 LYS 
                 A 
                 40 
                 18.365 
                 26.371 
                 23.548 
                 1.00 
                 42.04 
                 N 
               
               
                 ATOM 
                 306 
                 CA 
                 LYS 
                 A 
                 40 
                 18.419 
                 27.030 
                 24.866 
                 1.00 
                 43.09 
                 C 
               
               
                 ATOM 
                 307 
                 CB 
                 LYS 
                 A 
                 40 
                 19.207 
                 26.194 
                 25.881 
                 1.00 
                 42.59 
                 C 
               
               
                 ATOM 
                 308 
                 CG 
                 LYS 
                 A 
                 40 
                 18.404 
                 24.966 
                 26.364 
                 1.00 
                 44.24 
                 C 
               
               
                 ATOM 
                 309 
                 CD 
                 LYS 
                 A 
                 40 
                 19.096 
                 24.238 
                 27.544 
                 1.00 
                 44.63 
                 C 
               
               
                 ATOM 
                 310 
                 CE 
                 LYS 
                 A 
                 40 
                 18.461 
                 22.852 
                 27.732 
                 1.00 
                 48.13 
                 C 
               
               
                 ATOM 
                 311 
                 NZ 
                 LYS 
                 A 
                 40 
                 19.384 
                 21.866 
                 28.429 
                 1.00 
                 50.65 
                 N 
               
               
                 ATOM 
                 312 
                 C 
                 LYS 
                 A 
                 40 
                 19.035 
                 28.410 
                 24.737 
                 1.00 
                 42.81 
                 C 
               
               
                 ATOM 
                 313 
                 O 
                 LYS 
                 A 
                 40 
                 19.920 
                 28.594 
                 23.919 
                 1.00 
                 42.34 
                 O 
               
               
                 ATOM 
                 314 
                 N 
                 LEU 
                 A 
                 41 
                 18.546 
                 29.379 
                 25.510 
                 1.00 
                 43.09 
                 N 
               
               
                 ATOM 
                 315 
                 CA 
                 LEU 
                 A 
                 41 
                 19.033 
                 30.752 
                 25.382 
                 1.00 
                 44.01 
                 C 
               
               
                 ATOM 
                 316 
                 CB 
                 LEU 
                 A 
                 41 
                 18.276 
                 31.698 
                 26.311 
                 1.00 
                 44.25 
                 C 
               
               
                 ATOM 
                 317 
                 CG 
                 LEU 
                 A 
                 41 
                 17.782 
                 33.024 
                 25.744 
                 1.00 
                 43.95 
                 C 
               
               
                 ATOM 
                 318 
                 CD1 
                 LEU 
                 A 
                 41 
                 16.729 
                 32.793 
                 24.645 
                 1.00 
                 46.04 
                 C 
               
               
                 ATOM 
                 319 
                 CD2 
                 LEU 
                 A 
                 41 
                 17.186 
                 33.805 
                 26.889 
                 1.00 
                 42.63 
                 C 
               
               
                 ATOM 
                 320 
                 C 
                 LEU 
                 A 
                 41 
                 20.491 
                 30.797 
                 25.743 
                 1.00 
                 44.32 
                 C 
               
               
                 ATOM 
                 321 
                 O 
                 LEU 
                 A 
                 41 
                 20.875 
                 30.255 
                 26.776 
                 1.00 
                 44.32 
                 O 
               
               
                 ATOM 
                 322 
                 N 
                 GLY 
                 A 
                 42 
                 21.276 
                 31.465 
                 24.894 
                 1.00 
                 44.48 
                 N 
               
               
                 ATOM 
                 323 
                 CA 
                 GLY 
                 A 
                 42 
                 22.724 
                 31.559 
                 25.032 
                 1.00 
                 45.33 
                 C 
               
               
                 ATOM 
                 324 
                 C 
                 GLY 
                 A 
                 42 
                 23.534 
                 30.447 
                 24.379 
                 1.00 
                 45.16 
                 C 
               
               
                 ATOM 
                 325 
                 O 
                 GLY 
                 A 
                 42 
                 24.750 
                 30.546 
                 24.253 
                 1.00 
                 46.05 
                 O 
               
               
                 ATOM 
                 326 
                 N 
                 SER 
                 A 
                 43 
                 22.866 
                 29.382 
                 23.979 
                 1.00 
                 45.58 
                 N 
               
               
                 ATOM 
                 327 
                 CA 
                 SER 
                 A 
                 43 
                 23.513 
                 28.241 
                 23.342 
                 1.00 
                 45.64 
                 C 
               
               
                 ATOM 
                 328 
                 CB 
                 SER 
                 A 
                 43 
                 22.919 
                 26.938 
                 23.886 
                 1.00 
                 45.67 
                 C 
               
               
                 ATOM 
                 329 
                 OG 
                 SER 
                 A 
                 43 
                 23.459 
                 25.792 
                 23.251 
                 1.00 
                 46.70 
                 O 
               
               
                 ATOM 
                 330 
                 C 
                 SER 
                 A 
                 43 
                 23.289 
                 28.358 
                 21.832 
                 1.00 
                 46.16 
                 C 
               
               
                 ATOM 
                 331 
                 O 
                 SER 
                 A 
                 43 
                 22.467 
                 29.164 
                 21.372 
                 1.00 
                 45.71 
                 O 
               
               
                 ATOM 
                 332 
                 N 
                 THR 
                 A 
                 44 
                 24.043 
                 27.569 
                 21.077 
                 1.00 
                 46.22 
                 N 
               
               
                 ATOM 
                 333 
                 CA 
                 THR 
                 A 
                 44 
                 23.942 
                 27.526 
                 19.633 
                 1.00 
                 46.87 
                 C 
               
               
                 ATOM 
                 334 
                 CB 
                 THR 
                 A 
                 44 
                 25.270 
                 27.986 
                 18.993 
                 1.00 
                 47.20 
                 C 
               
               
                 ATOM 
                 335 
                 OG1 
                 THR 
                 A 
                 44 
                 25.567 
                 29.313 
                 19.456 
                 1.00 
                 50.26 
                 O 
               
               
                 ATOM 
                 336 
                 CG2 
                 THR 
                 A 
                 44 
                 25.165 
                 28.027 
                 17.487 
                 1.00 
                 49.30 
                 C 
               
               
                 ATOM 
                 337 
                 C 
                 THR 
                 A 
                 44 
                 23.531 
                 26.104 
                 19.198 
                 1.00 
                 46.11 
                 C 
               
               
                 ATOM 
                 338 
                 O 
                 THR 
                 A 
                 44 
                 23.339 
                 25.840 
                 18.003 
                 1.00 
                 46.05 
                 O 
               
               
                 ATOM 
                 339 
                 N 
                 LYS 
                 A 
                 45 
                 23.348 
                 25.220 
                 20.187 
                 1.00 
                 45.02 
                 N 
               
               
                 ATOM 
                 340 
                 CA 
                 LYS 
                 A 
                 45 
                 22.925 
                 23.823 
                 19.974 
                 1.00 
                 43.74 
                 C 
               
               
                 ATOM 
                 341 
                 CB 
                 LYS 
                 A 
                 45 
                 23.431 
                 22.949 
                 21.138 
                 1.00 
                 44.10 
                 C 
               
               
                 ATOM 
                 342 
                 CG 
                 LYS 
                 A 
                 45 
                 23.218 
                 21.441 
                 20.990 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 343 
                 CD 
                 LYS 
                 A 
                 45 
                 23.748 
                 20.699 
                 22.202 
                 1.00 
                 41.15 
                 C 
               
               
                 ATOM 
                 344 
                 CE 
                 LYS 
                 A 
                 45 
                 23.276 
                 19.255 
                 22.208 
                 1.00 
                 40.36 
                 C 
               
               
                 ATOM 
                 345 
                 NZ 
                 LYS 
                 A 
                 45 
                 24.119 
                 18.427 
                 23.140 
                 1.00 
                 35.82 
                 N 
               
               
                 ATOM 
                 346 
                 C 
                 LYS 
                 A 
                 45 
                 21.406 
                 23.683 
                 19.838 
                 1.00 
                 44.15 
                 C 
               
               
                 ATOM 
                 347 
                 O 
                 LYS 
                 A 
                 45 
                 20.662 
                 23.948 
                 20.788 
                 1.00 
                 43.67 
                 O 
               
               
                 ATOM 
                 348 
                 N 
                 GLU 
                 A 
                 46 
                 20.948 
                 23.234 
                 18.669 
                 1.00 
                 44.10 
                 N 
               
               
                 ATOM 
                 349 
                 CA 
                 GLU 
                 A 
                 46 
                 19.534 
                 22.901 
                 18.453 
                 1.00 
                 44.73 
                 C 
               
               
                 ATOM 
                 350 
                 CB 
                 GLU 
                 A 
                 46 
                 19.187 
                 23.050 
                 16.961 
                 1.00 
                 44.68 
                 C 
               
               
                 ATOM 
                 351 
                 CG 
                 GLU 
                 A 
                 46 
                 17.697 
                 22.939 
                 16.568 
                 1.00 
                 46.37 
                 C 
               
               
                 ATOM 
                 352 
                 CD 
                 GLU 
                 A 
                 46 
                 17.489 
                 23.212 
                 15.065 
                 1.00 
                 46.94 
                 C 
               
               
                 ATOM 
                 353 
                 OE1 
                 GLU 
                 A 
                 46 
                 16.943 
                 24.286 
                 14.702 
                 1.00 
                 51.63 
                 O 
               
               
                 ATOM 
                 354 
                 OE2 
                 GLU 
                 A 
                 46 
                 17.922 
                 22.371 
                 14.253 
                 1.00 
                 48.82 
                 O 
               
               
                 ATOM 
                 355 
                 C 
                 GLU 
                 A 
                 46 
                 19.248 
                 21.467 
                 18.895 
                 1.00 
                 44.02 
                 C 
               
               
                 ATOM 
                 356 
                 O 
                 GLU 
                 A 
                 46 
                 20.008 
                 20.526 
                 18.582 
                 1.00 
                 43.31 
                 O 
               
               
                 ATOM 
                 357 
                 N 
                 GLN 
                 A 
                 47 
                 18.155 
                 21.298 
                 19.629 
                 1.00 
                 44.37 
                 N 
               
               
                 ATOM 
                 358 
                 CA 
                 GLN 
                 A 
                 47 
                 17.669 
                 19.946 
                 19.923 
                 1.00 
                 45.03 
                 C 
               
               
                 ATOM 
                 359 
                 CB 
                 GLN 
                 A 
                 47 
                 17.925 
                 19.522 
                 21.378 
                 1.00 
                 45.59 
                 C 
               
               
                 ATOM 
                 360 
                 CG 
                 GLN 
                 A 
                 47 
                 17.466 
                 20.462 
                 22.441 
                 1.00 
                 47.40 
                 C 
               
               
                 ATOM 
                 361 
                 CD 
                 GLN 
                 A 
                 47 
                 18.514 
                 20.692 
                 23.534 
                 1.00 
                 48.12 
                 C 
               
               
                 ATOM 
                 362 
                 OE1 
                 GLN 
                 A 
                 47 
                 18.640 
                 21.814 
                 24.024 
                 1.00 
                 50.42 
                 O 
               
               
                 ATOM 
                 363 
                 NE2 
                 GLN 
                 A 
                 47 
                 19.275 
                 19.650 
                 23.905 
                 1.00 
                 44.87 
                 N 
               
               
                 ATOM 
                 364 
                 C 
                 GLN 
                 A 
                 47 
                 16.232 
                 19.743 
                 19.520 
                 1.00 
                 44.93 
                 C 
               
               
                 ATOM 
                 365 
                 O 
                 GLN 
                 A 
                 47 
                 15.397 
                 20.664 
                 19.618 
                 1.00 
                 43.86 
                 O 
               
               
                 ATOM 
                 366 
                 N 
                 THR 
                 A 
                 48 
                 15.966 
                 18.539 
                 19.018 
                 1.00 
                 43.69 
                 N 
               
               
                 ATOM 
                 367 
                 CA 
                 THR 
                 A 
                 48 
                 14.612 
                 18.113 
                 18.772 
                 1.00 
                 43.60 
                 C 
               
               
                 ATOM 
                 368 
                 CB 
                 THR 
                 A 
                 48 
                 14.572 
                 16.904 
                 17.840 
                 1.00 
                 43.49 
                 C 
               
               
                 ATOM 
                 369 
                 OG1 
                 THR 
                 A 
                 48 
                 15.501 
                 17.082 
                 16.774 
                 1.00 
                 43.99 
                 O 
               
               
                 ATOM 
                 370 
                 CG2 
                 THR 
                 A 
                 48 
                 13.191 
                 16.705 
                 17.254 
                 1.00 
                 44.57 
                 C 
               
               
                 ATOM 
                 371 
                 C 
                 THR 
                 A 
                 48 
                 13.956 
                 17.716 
                 20.100 
                 1.00 
                 43.88 
                 C 
               
               
                 ATOM 
                 372 
                 O 
                 THR 
                 A 
                 48 
                 14.500 
                 16.890 
                 20.858 
                 1.00 
                 43.41 
                 O 
               
               
                 ATOM 
                 373 
                 N 
                 ILE 
                 A 
                 49 
                 12.763 
                 18.250 
                 20.342 
                 1.00 
                 43.65 
                 N 
               
               
                 ATOM 
                 374 
                 CA 
                 ILE 
                 A 
                 49 
                 11.949 
                 17.867 
                 21.500 
                 1.00 
                 44.19 
                 C 
               
               
                 ATOM 
                 375 
                 CB 
                 ILE 
                 A 
                 49 
                 10.965 
                 18.986 
                 21.860 
                 1.00 
                 44.86 
                 C 
               
               
                 ATOM 
                 376 
                 CG1 
                 ILE 
                 A 
                 49 
                 11.703 
                 20.311 
                 22.079 
                 1.00 
                 44.80 
                 C 
               
               
                 ATOM 
                 377 
                 CD1 
                 ILE 
                 A 
                 49 
                 10.772 
                 21.515 
                 22.217 
                 1.00 
                 45.75 
                 C 
               
               
                 ATOM 
                 378 
                 CG2 
                 ILE 
                 A 
                 49 
                 10.129 
                 18.577 
                 23.090 
                 1.00 
                 44.23 
                 C 
               
               
                 ATOM 
                 379 
                 C 
                 ILE 
                 A 
                 49 
                 11.116 
                 16.609 
                 21.250 
                 1.00 
                 43.80 
                 C 
               
               
                 ATOM 
                 380 
                 O 
                 ILE 
                 A 
                 49 
                 10.322 
                 16.569 
                 20.311 
                 1.00 
                 44.87 
                 O 
               
               
                 ATOM 
                 381 
                 N 
                 SER 
                 A 
                 50 
                 11.268 
                 15.587 
                 22.068 
                 1.00 
                 42.75 
                 N 
               
               
                 ATOM 
                 382 
                 CA 
                 SER 
                 A 
                 50 
                 10.378 
                 14.439 
                 21.955 
                 1.00 
                 44.53 
                 C 
               
               
                 ATOM 
                 383 
                 CB 
                 SER 
                 A 
                 50 
                 11.064 
                 13.151 
                 22.440 
                 1.00 
                 44.13 
                 C 
               
               
                 ATOM 
                 384 
                 OG 
                 SER 
                 A 
                 50 
                 10.155 
                 12.054 
                 22.445 
                 1.00 
                 49.23 
                 O 
               
               
                 ATOM 
                 385 
                 C 
                 SER 
                 A 
                 50 
                 9.055 
                 14.758 
                 22.699 
                 1.00 
                 44.49 
                 C 
               
               
                 ATOM 
                 386 
                 O 
                 SER 
                 A 
                 50 
                 9.050 
                 15.069 
                 23.883 
                 1.00 
                 43.95 
                 O 
               
               
                 ATOM 
                 387 
                 N 
                 ILE 
                 A 
                 51 
                 7.943 
                 14.733 
                 21.953 
                 1.00 
                 44.98 
                 N 
               
               
                 ATOM 
                 388 
                 CA 
                 ILE 
                 A 
                 51 
                 6.609 
                 15.076 
                 22.454 
                 1.00 
                 44.02 
                 C 
               
               
                 ATOM 
                 389 
                 CB 
                 ILE 
                 A 
                 51 
                 5.605 
                 15.221 
                 21.273 
                 1.00 
                 44.92 
                 C 
               
               
                 ATOM 
                 390 
                 CG1 
                 ILE 
                 A 
                 51 
                 6.024 
                 16.366 
                 20.349 
                 1.00 
                 45.18 
                 C 
               
               
                 ATOM 
                 391 
                 CD1 
                 ILE 
                 A 
                 51 
                 6.216 
                 17.701 
                 21.070 
                 1.00 
                 45.42 
                 C 
               
               
                 ATOM 
                 392 
                 CG2 
                 ILE 
                 A 
                 51 
                 4.160 
                 15.429 
                 21.770 
                 1.00 
                 44.94 
                 C 
               
               
                 ATOM 
                 393 
                 C 
                 ILE 
                 A 
                 51 
                 6.070 
                 14.034 
                 23.421 
                 1.00 
                 44.33 
                 C 
               
               
                 ATOM 
                 394 
                 O 
                 ILE 
                 A 
                 51 
                 6.006 
                 12.838 
                 23.094 
                 1.00 
                 43.52 
                 O 
               
               
                 ATOM 
                 395 
                 N 
                 GLY 
                 A 
                 52 
                 5.631 
                 14.507 
                 24.591 
                 1.00 
                 43.39 
                 N 
               
               
                 ATOM 
                 396 
                 CA 
                 GLY 
                 A 
                 52 
                 5.153 
                 13.648 
                 25.669 
                 1.00 
                 42.74 
                 C 
               
               
                 ATOM 
                 397 
                 C 
                 GLY 
                 A 
                 52 
                 5.393 
                 14.348 
                 26.998 
                 1.00 
                 41.31 
                 C 
               
               
                 ATOM 
                 398 
                 O 
                 GLY 
                 A 
                 52 
                 6.109 
                 15.329 
                 27.063 
                 1.00 
                 39.55 
                 O 
               
               
                 ATOM 
                 399 
                 N 
                 GLY 
                 A 
                 53 
                 4.766 
                 13.856 
                 28.052 
                 1.00 
                 41.80 
                 N 
               
               
                 ATOM 
                 400 
                 CA 
                 GLY 
                 A 
                 53 
                 4.940 
                 14.458 
                 29.386 
                 1.00 
                 41.49 
                 C 
               
               
                 ATOM 
                 401 
                 C 
                 GLY 
                 A 
                 53 
                 4.327 
                 15.852 
                 29.367 
                 1.00 
                 41.82 
                 C 
               
               
                 ATOM 
                 402 
                 O 
                 GLY 
                 A 
                 53 
                 3.170 
                 16.016 
                 28.982 
                 1.00 
                 41.84 
                 O 
               
               
                 ATOM 
                 403 
                 N 
                 ARG 
                 A 
                 54 
                 5.098 
                 16.859 
                 29.739 
                 1.00 
                 41.46 
                 N 
               
               
                 ATOM 
                 404 
                 CA 
                 ARG 
                 A 
                 54 
                 4.562 
                 18.215 
                 29.779 
                 1.00 
                 41.94 
                 C 
               
               
                 ATOM 
                 405 
                 CB 
                 ARG 
                 A 
                 54 
                 5.290 
                 19.038 
                 30.821 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 406 
                 CG 
                 ARG 
                 A 
                 54 
                 6.712 
                 19.369 
                 30.492 
                 1.00 
                 41.91 
                 C 
               
               
                 ATOM 
                 407 
                 CD 
                 ARG 
                 A 
                 54 
                 7.432 
                 19.944 
                 31.739 
                 1.00 
                 43.30 
                 C 
               
               
                 ATOM 
                 408 
                 NE 
                 ARG 
                 A 
                 54 
                 8.839 
                 20.155 
                 31.471 
                 1.00 
                 42.80 
                 N 
               
               
                 ATOM 
                 409 
                 CZ 
                 ARG 
                 A 
                 54 
                 9.386 
                 21.335 
                 31.194 
                 1.00 
                 41.93 
                 C 
               
               
                 ATOM 
                 410 
                 NH1 
                 ARG 
                 A 
                 54 
                 10.684 
                 21.405 
                 30.941 
                 1.00 
                 39.03 
                 N 
               
               
                 ATOM 
                 411 
                 NH2 
                 ARG 
                 A 
                 54 
                 8.645 
                 22.441 
                 31.186 
                 1.00 
                 40.55 
                 N 
               
               
                 ATOM 
                 412 
                 C 
                 ARG 
                 A 
                 54 
                 4.659 
                 18.932 
                 28.459 
                 1.00 
                 42.70 
                 C 
               
               
                 ATOM 
                 413 
                 O 
                 ARG 
                 A 
                 54 
                 4.402 
                 20.152 
                 28.406 
                 1.00 
                 42.87 
                 O 
               
               
                 ATOM 
                 414 
                 N 
                 TYR 
                 A 
                 55 
                 5.066 
                 18.196 
                 27.420 
                 1.00 
                 42.17 
                 N 
               
               
                 ATOM 
                 415 
                 CA 
                 TYR 
                 A 
                 55 
                 5.079 
                 18.703 
                 26.062 
                 1.00 
                 43.29 
                 C 
               
               
                 ATOM 
                 416 
                 CB 
                 TYR 
                 A 
                 55 
                 6.420 
                 18.416 
                 25.352 
                 1.00 
                 42.79 
                 C 
               
               
                 ATOM 
                 417 
                 CG 
                 TYR 
                 A 
                 55 
                 7.624 
                 19.132 
                 25.934 
                 1.00 
                 43.35 
                 C 
               
               
                 ATOM 
                 418 
                 CD1 
                 TYR 
                 A 
                 55 
                 8.030 
                 20.364 
                 25.444 
                 1.00 
                 42.33 
                 C 
               
               
                 ATOM 
                 419 
                 CE1 
                 TYR 
                 A 
                 55 
                 9.139 
                 21.026 
                 25.985 
                 1.00 
                 44.73 
                 C 
               
               
                 ATOM 
                 420 
                 CZ 
                 TYR 
                 A 
                 55 
                 9.859 
                 20.423 
                 27.010 
                 1.00 
                 45.08 
                 C 
               
               
                 ATOM 
                 421 
                 OH 
                 TYR 
                 A 
                 55 
                 10.973 
                 21.049 
                 27.536 
                 1.00 
                 44.82 
                 O 
               
               
                 ATOM 
                 422 
                 CE2 
                 TYR 
                 A 
                 55 
                 9.472 
                 19.194 
                 27.498 
                 1.00 
                 42.19 
                 C 
               
               
                 ATOM 
                 423 
                 CD2 
                 TYR 
                 A 
                 55 
                 8.369 
                 18.559 
                 26.963 
                 1.00 
                 44.00 
                 C 
               
               
                 ATOM 
                 424 
                 C 
                 TYR 
                 A 
                 55 
                 3.975 
                 18.027 
                 25.289 
                 1.00 
                 43.41 
                 C 
               
               
                 ATOM 
                 425 
                 O 
                 TYR 
                 A 
                 55 
                 3.931 
                 16.785 
                 25.178 
                 1.00 
                 43.01 
                 O 
               
               
                 ATOM 
                 426 
                 N 
                 SER 
                 A 
                 56 
                 3.073 
                 18.826 
                 24.742 
                 1.00 
                 43.44 
                 N 
               
               
                 ATOM 
                 427 
                 CA 
                 SER 
                 A 
                 56 
                 2.012 
                 18.211 
                 23.977 
                 1.00 
                 44.15 
                 C 
               
               
                 ATOM 
                 428 
                 CB 
                 SER 
                 A 
                 56 
                 0.701 
                 18.153 
                 24.797 
                 1.00 
                 44.77 
                 C 
               
               
                 ATOM 
                 429 
                 OG 
                 SER 
                 A 
                 56 
                 0.143 
                 19.440 
                 25.022 
                 1.00 
                 46.86 
                 O 
               
               
                 ATOM 
                 430 
                 C 
                 SER 
                 A 
                 56 
                 1.840 
                 18.923 
                 22.660 
                 1.00 
                 44.00 
                 C 
               
               
                 ATOM 
                 431 
                 O 
                 SER 
                 A 
                 56 
                 2.180 
                 20.104 
                 22.539 
                 1.00 
                 44.53 
                 O 
               
               
                 ATOM 
                 432 
                 N 
                 GLU 
                 A 
                 57 
                 1.343 
                 18.188 
                 21.669 
                 1.00 
                 43.36 
                 N 
               
               
                 ATOM 
                 433 
                 CA 
                 GLU 
                 A 
                 57 
                 1.042 
                 18.751 
                 20.356 
                 1.00 
                 42.94 
                 C 
               
               
                 ATOM 
                 434 
                 CB 
                 GLU 
                 A 
                 57 
                 1.886 
                 18.064 
                 19.275 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 435 
                 CG 
                 GLU 
                 A 
                 57 
                 1.674 
                 18.580 
                 17.860 
                 1.00 
                 43.65 
                 C 
               
               
                 ATOM 
                 436 
                 CD 
                 GLU 
                 A 
                 57 
                 2.473 
                 17.808 
                 16.828 
                 1.00 
                 43.95 
                 C 
               
               
                 ATOM 
                 437 
                 OE1 
                 GLU 
                 A 
                 57 
                 1.857 
                 17.099 
                 16.011 
                 1.00 
                 48.95 
                 O 
               
               
                 ATOM 
                 438 
                 OE2 
                 GLU 
                 A 
                 57 
                 3.718 
                 17.895 
                 16.815 
                 1.00 
                 45.70 
                 O 
               
               
                 ATOM 
                 439 
                 C 
                 GLU 
                 A 
                 57 
                 −0.426 
                 18.594 
                 20.058 
                 1.00 
                 42.25 
                 C 
               
               
                 ATOM 
                 440 
                 O 
                 GLU 
                 A 
                 57 
                 −0.988 
                 17.502 
                 20.203 
                 1.00 
                 43.26 
                 O 
               
               
                 ATOM 
                 441 
                 N 
                 THR 
                 A 
                 58 
                 −1.062 
                 19.692 
                 19.653 
                 1.00 
                 41.96 
                 N 
               
               
                 ATOM 
                 442 
                 CA 
                 THR 
                 A 
                 58 
                 −2.444 
                 19.661 
                 19.201 
                 1.00 
                 40.98 
                 C 
               
               
                 ATOM 
                 443 
                 CB 
                 THR 
                 A 
                 58 
                 −3.250 
                 20.750 
                 19.963 
                 1.00 
                 41.21 
                 C 
               
               
                 ATOM 
                 444 
                 OG1 
                 THR 
                 A 
                 58 
                 −3.103 
                 20.492 
                 21.360 
                 1.00 
                 43.13 
                 O 
               
               
                 ATOM 
                 445 
                 CG2 
                 THR 
                 A 
                 58 
                 −4.746 
                 20.738 
                 19.612 
                 1.00 
                 40.36 
                 C 
               
               
                 ATOM 
                 446 
                 C 
                 THR 
                 A 
                 58 
                 −2.464 
                 19.839 
                 17.687 
                 1.00 
                 40.68 
                 C 
               
               
                 ATOM 
                 447 
                 O 
                 THR 
                 A 
                 58 
                 −1.796 
                 20.746 
                 17.165 
                 1.00 
                 40.52 
                 O 
               
               
                 ATOM 
                 448 
                 N 
                 VAL 
                 A 
                 59 
                 −3.178 
                 18.958 
                 16.976 
                 1.00 
                 39.94 
                 N 
               
               
                 ATOM 
                 449 
                 CA 
                 VAL 
                 A 
                 59 
                 −3.346 
                 19.089 
                 15.503 
                 1.00 
                 39.87 
                 C 
               
               
                 ATOM 
                 450 
                 CB 
                 VAL 
                 A 
                 59 
                 −3.023 
                 17.778 
                 14.703 
                 1.00 
                 39.05 
                 C 
               
               
                 ATOM 
                 451 
                 CG1 
                 VAL 
                 A 
                 59 
                 −1.591 
                 17.390 
                 14.896 
                 1.00 
                 41.22 
                 C 
               
               
                 ATOM 
                 452 
                 CG2 
                 VAL 
                 A 
                 59 
                 −3.957 
                 16.654 
                 15.094 
                 1.00 
                 39.56 
                 C 
               
               
                 ATOM 
                 453 
                 C 
                 VAL 
                 A 
                 59 
                 −4.741 
                 19.574 
                 15.078 
                 1.00 
                 39.53 
                 C 
               
               
                 ATOM 
                 454 
                 O 
                 VAL 
                 A 
                 59 
                 −5.757 
                 19.092 
                 15.584 
                 1.00 
                 39.08 
                 O 
               
               
                 ATOM 
                 455 
                 N 
                 ASP 
                 A 
                 60 
                 −4.769 
                 20.511 
                 14.138 
                 1.00 
                 40.17 
                 N 
               
               
                 ATOM 
                 456 
                 CA 
                 ASP 
                 A 
                 60 
                 −6.023 
                 20.986 
                 13.552 
                 1.00 
                 41.52 
                 C 
               
               
                 ATOM 
                 457 
                 CB 
                 ASP 
                 A 
                 60 
                 −6.338 
                 22.409 
                 14.018 
                 1.00 
                 41.49 
                 C 
               
               
                 ATOM 
                 458 
                 CG 
                 ASP 
                 A 
                 60 
                 −7.695 
                 22.896 
                 13.549 
                 1.00 
                 44.26 
                 C 
               
               
                 ATOM 
                 459 
                 OD1 
                 ASP 
                 A 
                 60 
                 −8.177 
                 22.474 
                 12.490 
                 1.00 
                 46.98 
                 O 
               
               
                 ATOM 
                 460 
                 OD2 
                 ASP 
                 A 
                 60 
                 −8.294 
                 23.739 
                 14.230 
                 1.00 
                 48.31 
                 O 
               
               
                 ATOM 
                 461 
                 C 
                 ASP 
                 A 
                 60 
                 −5.961 
                 20.849 
                 12.023 
                 1.00 
                 41.63 
                 C 
               
               
                 ATOM 
                 462 
                 O 
                 ASP 
                 A 
                 60 
                 −5.348 
                 21.657 
                 11.308 
                 1.00 
                 41.42 
                 O 
               
               
                 ATOM 
                 463 
                 N 
                 GLU 
                 A 
                 61 
                 −6.583 
                 19.788 
                 11.539 
                 1.00 
                 41.59 
                 N 
               
               
                 ATOM 
                 464 
                 CA 
                 GLU 
                 A 
                 61 
                 −6.643 
                 19.514 
                 10.115 
                 1.00 
                 42.38 
                 C 
               
               
                 ATOM 
                 465 
                 CB 
                 GLU 
                 A 
                 61 
                 −7.324 
                 18.169 
                 9.908 
                 1.00 
                 42.35 
                 C 
               
               
                 ATOM 
                 466 
                 CG 
                 GLU 
                 A 
                 61 
                 −7.387 
                 17.692 
                 8.483 
                 1.00 
                 43.28 
                 C 
               
               
                 ATOM 
                 467 
                 CD 
                 GLU 
                 A 
                 61 
                 −7.987 
                 16.328 
                 8.417 
                 1.00 
                 42.95 
                 C 
               
               
                 ATOM 
                 468 
                 OE1 
                 GLU 
                 A 
                 61 
                 −9.192 
                 16.250 
                 8.170 
                 1.00 
                 40.78 
                 O 
               
               
                 ATOM 
                 469 
                 OE2 
                 GLU 
                 A 
                 61 
                 −7.261 
                 15.343 
                 8.679 
                 1.00 
                 46.17 
                 O 
               
               
                 ATOM 
                 470 
                 C 
                 GLU 
                 A 
                 61 
                 −7.318 
                 20.621 
                 9.273 
                 1.00 
                 42.62 
                 C 
               
               
                 ATOM 
                 471 
                 O 
                 GLU 
                 A 
                 61 
                 −6.886 
                 20.941 
                 8.155 
                 1.00 
                 43.01 
                 O 
               
               
                 ATOM 
                 472 
                 N 
                 GLY 
                 A 
                 62 
                 −8.351 
                 21.235 
                 9.812 
                 1.00 
                 42.12 
                 N 
               
               
                 ATOM 
                 473 
                 CA 
                 GLY 
                 A 
                 62 
                 −9.044 
                 22.254 
                 9.063 
                 1.00 
                 42.47 
                 C 
               
               
                 ATOM 
                 474 
                 C 
                 GLY 
                 A 
                 62 
                 −8.255 
                 23.509 
                 8.831 
                 1.00 
                 42.28 
                 C 
               
               
                 ATOM 
                 475 
                 O 
                 GLY 
                 A 
                 62 
                 −8.454 
                 24.187 
                 7.811 
                 1.00 
                 43.30 
                 O 
               
               
                 ATOM 
                 476 
                 N 
                 SER 
                 A 
                 63 
                 −7.372 
                 23.819 
                 9.775 
                 1.00 
                 41.92 
                 N 
               
               
                 ATOM 
                 477 
                 CA 
                 SER 
                 A 
                 63 
                 −6.541 
                 25.022 
                 9.746 
                 1.00 
                 41.93 
                 C 
               
               
                 ATOM 
                 478 
                 CB 
                 SER 
                 A 
                 63 
                 −6.436 
                 25.625 
                 11.158 
                 1.00 
                 42.03 
                 C 
               
               
                 ATOM 
                 479 
                 OG 
                 SER 
                 A 
                 63 
                 −7.720 
                 25.762 
                 11.737 
                 1.00 
                 45.80 
                 O 
               
               
                 ATOM 
                 480 
                 C 
                 SER 
                 A 
                 63 
                 −5.128 
                 24.761 
                 9.245 
                 1.00 
                 41.03 
                 C 
               
               
                 ATOM 
                 481 
                 O 
                 SER 
                 A 
                 63 
                 −4.339 
                 25.696 
                 9.181 
                 1.00 
                 40.56 
                 O 
               
               
                 ATOM 
                 482 
                 N 
                 ASN 
                 A 
                 64 
                 −4.820 
                 23.501 
                 8.912 
                 1.00 
                 40.57 
                 N 
               
               
                 ATOM 
                 483 
                 CA 
                 ASN 
                 A 
                 64 
                 −3.485 
                 23.079 
                 8.452 
                 1.00 
                 40.70 
                 C 
               
               
                 ATOM 
                 484 
                 CB 
                 ASN 
                 A 
                 64 
                 −3.129 
                 23.764 
                 7.117 
                 1.00 
                 40.66 
                 C 
               
               
                 ATOM 
                 485 
                 CG 
                 ASN 
                 A 
                 64 
                 −2.613 
                 22.788 
                 6.048 
                 1.00 
                 42.06 
                 C 
               
               
                 ATOM 
                 486 
                 OD1 
                 ASN 
                 A 
                 64 
                 −2.632 
                 21.575 
                 6.233 
                 1.00 
                 44.67 
                 O 
               
               
                 ATOM 
                 487 
                 ND2 
                 ASN 
                 A 
                 64 
                 −2.168 
                 23.328 
                 4.916 
                 1.00 
                 38.47 
                 N 
               
               
                 ATOM 
                 488 
                 C 
                 ASN 
                 A 
                 64 
                 −2.456 
                 23.441 
                 9.524 
                 1.00 
                 40.57 
                 C 
               
               
                 ATOM 
                 489 
                 O 
                 ASN 
                 A 
                 64 
                 −1.385 
                 23.971 
                 9.216 
                 1.00 
                 40.25 
                 O 
               
               
                 ATOM 
                 490 
                 N 
                 SER 
                 A 
                 65 
                 −2.791 
                 23.178 
                 10.789 
                 1.00 
                 40.60 
                 N 
               
               
                 ATOM 
                 491 
                 CA 
                 SER 
                 A 
                 65 
                 −1.956 
                 23.646 
                 11.894 
                 1.00 
                 40.94 
                 C 
               
               
                 ATOM 
                 492 
                 CB 
                 SER 
                 A 
                 65 
                 −2.596 
                 24.855 
                 12.605 
                 1.00 
                 41.18 
                 C 
               
               
                 ATOM 
                 493 
                 OG 
                 SER 
                 A 
                 65 
                 −3.789 
                 24.507 
                 13.278 
                 1.00 
                 42.58 
                 O 
               
               
                 ATOM 
                 494 
                 C 
                 SER 
                 A 
                 65 
                 −1.543 
                 22.593 
                 12.895 
                 1.00 
                 41.28 
                 C 
               
               
                 ATOM 
                 495 
                 O 
                 SER 
                 A 
                 65 
                 −2.160 
                 21.526 
                 12.983 
                 1.00 
                 41.22 
                 O 
               
               
                 ATOM 
                 496 
                 N 
                 ALA 
                 A 
                 66 
                 −0.462 
                 22.895 
                 13.627 
                 1.00 
                 42.01 
                 N 
               
               
                 ATOM 
                 497 
                 CA 
                 ALA 
                 A 
                 66 
                 0.009 
                 22.107 
                 14.785 
                 1.00 
                 42.51 
                 C 
               
               
                 ATOM 
                 498 
                 CB 
                 ALA 
                 A 
                 66 
                 1.128 
                 21.099 
                 14.370 
                 1.00 
                 41.63 
                 C 
               
               
                 ATOM 
                 499 
                 C 
                 ALA 
                 A 
                 66 
                 0.533 
                 23.080 
                 15.839 
                 1.00 
                 43.50 
                 C 
               
               
                 ATOM 
                 500 
                 O 
                 ALA 
                 A 
                 66 
                 1.302 
                 24.014 
                 15.501 
                 1.00 
                 44.12 
                 O 
               
               
                 ATOM 
                 501 
                 N 
                 SER 
                 A 
                 67 
                 0.109 
                 22.859 
                 17.089 
                 1.00 
                 43.19 
                 N 
               
               
                 ATOM 
                 502 
                 CA 
                 SER 
                 A 
                 67 
                 0.496 
                 23.663 
                 18.237 
                 1.00 
                 44.12 
                 C 
               
               
                 ATOM 
                 503 
                 CB 
                 SER 
                 A 
                 67 
                 −0.719 
                 24.297 
                 18.894 
                 1.00 
                 43.60 
                 C 
               
               
                 ATOM 
                 504 
                 OG 
                 SER 
                 A 
                 67 
                 −1.213 
                 25.268 
                 17.996 
                 1.00 
                 47.65 
                 O 
               
               
                 ATOM 
                 505 
                 C 
                 SER 
                 A 
                 67 
                 1.242 
                 22.870 
                 19.293 
                 1.00 
                 43.95 
                 C 
               
               
                 ATOM 
                 506 
                 O 
                 SER 
                 A 
                 67 
                 0.873 
                 21.727 
                 19.622 
                 1.00 
                 44.77 
                 O 
               
               
                 ATOM 
                 507 
                 N 
                 LEU 
                 A 
                 68 
                 2.330 
                 23.448 
                 19.769 
                 1.00 
                 42.85 
                 N 
               
               
                 ATOM 
                 508 
                 CA 
                 LEU 
                 A 
                 68 
                 3.042 
                 22.858 
                 20.894 
                 1.00 
                 43.00 
                 C 
               
               
                 ATOM 
                 509 
                 CB 
                 LEU 
                 A 
                 68 
                 4.564 
                 22.921 
                 20.678 
                 1.00 
                 42.58 
                 C 
               
               
                 ATOM 
                 510 
                 CG 
                 LEU 
                 A 
                 68 
                 5.455 
                 22.619 
                 21.891 
                 1.00 
                 42.99 
                 C 
               
               
                 ATOM 
                 511 
                 CD1 
                 LEU 
                 A 
                 68 
                 5.434 
                 21.129 
                 22.244 
                 1.00 
                 40.58 
                 C 
               
               
                 ATOM 
                 512 
                 CD2 
                 LEU 
                 A 
                 68 
                 6.910 
                 23.118 
                 21.663 
                 1.00 
                 41.93 
                 C 
               
               
                 ATOM 
                 513 
                 C 
                 LEU 
                 A 
                 68 
                 2.665 
                 23.549 
                 22.192 
                 1.00 
                 42.19 
                 C 
               
               
                 ATOM 
                 514 
                 O 
                 LEU 
                 A 
                 68 
                 2.829 
                 24.771 
                 22.317 
                 1.00 
                 42.62 
                 O 
               
               
                 ATOM 
                 515 
                 N 
                 THR 
                 A 
                 69 
                 2.163 
                 22.778 
                 23.148 
                 1.00 
                 42.05 
                 N 
               
               
                 ATOM 
                 516 
                 CA 
                 THR 
                 A 
                 69 
                 1.989 
                 23.296 
                 24.507 
                 1.00 
                 42.43 
                 C 
               
               
                 ATOM 
                 517 
                 CB 
                 THR 
                 A 
                 69 
                 0.577 
                 23.016 
                 25.054 
                 1.00 
                 42.69 
                 C 
               
               
                 ATOM 
                 518 
                 OG1 
                 THR 
                 A 
                 69 
                 −0.358 
                 23.689 
                 24.216 
                 1.00 
                 42.54 
                 O 
               
               
                 ATOM 
                 519 
                 CG2 
                 THR 
                 A 
                 69 
                 0.394 
                 23.575 
                 26.498 
                 1.00 
                 42.39 
                 C 
               
               
                 ATOM 
                 520 
                 C 
                 THR 
                 A 
                 69 
                 3.093 
                 22.768 
                 25.430 
                 1.00 
                 42.65 
                 C 
               
               
                 ATOM 
                 521 
                 O 
                 THR 
                 A 
                 69 
                 3.364 
                 21.550 
                 25.466 
                 1.00 
                 42.53 
                 O 
               
               
                 ATOM 
                 522 
                 N 
                 ILE 
                 A 
                 70 
                 3.781 
                 23.689 
                 26.105 
                 1.00 
                 42.73 
                 N 
               
               
                 ATOM 
                 523 
                 CA 
                 ILE 
                 A 
                 70 
                 4.745 
                 23.320 
                 27.168 
                 1.00 
                 43.57 
                 C 
               
               
                 ATOM 
                 524 
                 CB 
                 ILE 
                 A 
                 70 
                 6.118 
                 24.002 
                 26.988 
                 1.00 
                 43.71 
                 C 
               
               
                 ATOM 
                 525 
                 CG1 
                 ILE 
                 A 
                 70 
                 6.679 
                 23.746 
                 25.576 
                 1.00 
                 44.37 
                 C 
               
               
                 ATOM 
                 526 
                 CD1 
                 ILE 
                 A 
                 70 
                 7.838 
                 24.682 
                 25.237 
                 1.00 
                 43.90 
                 C 
               
               
                 ATOM 
                 527 
                 CG2 
                 ILE 
                 A 
                 70 
                 7.092 
                 23.524 
                 28.033 
                 1.00 
                 44.26 
                 C 
               
               
                 ATOM 
                 528 
                 C 
                 ILE 
                 A 
                 70 
                 4.172 
                 23.754 
                 28.501 
                 1.00 
                 43.90 
                 C 
               
               
                 ATOM 
                 529 
                 O 
                 ILE 
                 A 
                 70 
                 3.967 
                 24.947 
                 28.725 
                 1.00 
                 43.83 
                 O 
               
               
                 ATOM 
                 530 
                 N 
                 ARG 
                 A 
                 71 
                 3.893 
                 22.799 
                 29.373 
                 1.00 
                 44.36 
                 N 
               
               
                 ATOM 
                 531 
                 CA 
                 ARG 
                 A 
                 71 
                 3.306 
                 23.110 
                 30.676 
                 1.00 
                 46.05 
                 C 
               
               
                 ATOM 
                 532 
                 CB 
                 ARG 
                 A 
                 71 
                 2.214 
                 22.085 
                 31.036 
                 1.00 
                 46.19 
                 C 
               
               
                 ATOM 
                 533 
                 CG 
                 ARG 
                 A 
                 71 
                 1.045 
                 22.023 
                 30.039 
                 1.00 
                 48.10 
                 C 
               
               
                 ATOM 
                 534 
                 CD 
                 ARG 
                 A 
                 71 
                 0.227 
                 20.724 
                 30.205 
                 1.00 
                 49.51 
                 C 
               
               
                 ATOM 
                 535 
                 NE 
                 ARG 
                 A 
                 71 
                 0.731 
                 19.665 
                 29.316 
                 1.00 
                 54.32 
                 N 
               
               
                 ATOM 
                 536 
                 CZ 
                 ARG 
                 A 
                 71 
                 0.397 
                 18.364 
                 29.365 
                 1.00 
                 55.91 
                 C 
               
               
                 ATOM 
                 537 
                 NH1 
                 ARG 
                 A 
                 71 
                 0.952 
                 17.520 
                 28.489 
                 1.00 
                 53.43 
                 N 
               
               
                 ATOM 
                 538 
                 NH2 
                 ARG 
                 A 
                 71 
                 −0.473 
                 17.893 
                 30.281 
                 1.00 
                 54.28 
                 N 
               
               
                 ATOM 
                 539 
                 C 
                 ARG 
                 A 
                 71 
                 4.391 
                 23.175 
                 31.761 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 540 
                 O 
                 ARG 
                 A 
                 71 
                 5.536 
                 22.769 
                 31.521 
                 1.00 
                 45.67 
                 O 
               
               
                 ATOM 
                 541 
                 N 
                 ASP 
                 A 
                 72 
                 4.026 
                 23.683 
                 32.936 
                 1.00 
                 44.59 
                 N 
               
               
                 ATOM 
                 542 
                 CA 
                 ASP 
                 A 
                 72 
                 4.934 
                 23.834 
                 34.095 
                 1.00 
                 44.37 
                 C 
               
               
                 ATOM 
                 543 
                 CB 
                 ASP 
                 A 
                 72 
                 5.092 
                 22.514 
                 34.876 
                 1.00 
                 43.81 
                 C 
               
               
                 ATOM 
                 544 
                 CG 
                 ASP 
                 A 
                 72 
                 5.939 
                 22.686 
                 36.175 
                 1.00 
                 46.29 
                 C 
               
               
                 ATOM 
                 545 
                 OD1 
                 ASP 
                 A 
                 72 
                 5.735 
                 23.682 
                 36.905 
                 1.00 
                 45.23 
                 O 
               
               
                 ATOM 
                 546 
                 OD2 
                 ASP 
                 A 
                 72 
                 6.825 
                 21.839 
                 36.454 
                 1.00 
                 47.68 
                 O 
               
               
                 ATOM 
                 547 
                 C 
                 ASP 
                 A 
                 72 
                 6.308 
                 24.455 
                 33.780 
                 1.00 
                 43.81 
                 C 
               
               
                 ATOM 
                 548 
                 O 
                 ASP 
                 A 
                 72 
                 7.353 
                 23.849 
                 34.050 
                 1.00 
                 43.52 
                 O 
               
               
                 ATOM 
                 549 
                 N 
                 LEU 
                 A 
                 73 
                 6.304 
                 25.675 
                 33.239 
                 1.00 
                 43.67 
                 N 
               
               
                 ATOM 
                 550 
                 CA 
                 LEU 
                 A 
                 73 
                 7.543 
                 26.258 
                 32.634 
                 1.00 
                 43.28 
                 C 
               
               
                 ATOM 
                 551 
                 CB 
                 LEU 
                 A 
                 73 
                 7.266 
                 27.548 
                 31.842 
                 1.00 
                 42.21 
                 C 
               
               
                 ATOM 
                 552 
                 CG 
                 LEU 
                 A 
                 73 
                 6.698 
                 27.428 
                 30.420 
                 1.00 
                 41.64 
                 C 
               
               
                 ATOM 
                 553 
                 CD1 
                 LEU 
                 A 
                 73 
                 6.099 
                 28.774 
                 29.995 
                 1.00 
                 40.11 
                 C 
               
               
                 ATOM 
                 554 
                 CD2 
                 LEU 
                 A 
                 73 
                 7.740 
                 26.946 
                 29.357 
                 1.00 
                 36.14 
                 C 
               
               
                 ATOM 
                 555 
                 C 
                 LEU 
                 A 
                 73 
                 8.606 
                 26.517 
                 33.668 
                 1.00 
                 43.26 
                 C 
               
               
                 ATOM 
                 556 
                 O 
                 LEU 
                 A 
                 73 
                 8.292 
                 26.835 
                 34.809 
                 1.00 
                 43.51 
                 O 
               
               
                 ATOM 
                 557 
                 N 
                 ARG 
                 A 
                 74 
                 9.860 
                 26.363 
                 33.260 
                 1.00 
                 43.56 
                 N 
               
               
                 ATOM 
                 558 
                 CA 
                 ARG 
                 A 
                 74 
                 11.017 
                 26.486 
                 34.148 
                 1.00 
                 43.52 
                 C 
               
               
                 ATOM 
                 559 
                 CB 
                 ARG 
                 A 
                 74 
                 11.654 
                 25.118 
                 34.295 
                 1.00 
                 43.58 
                 C 
               
               
                 ATOM 
                 560 
                 CG 
                 ARG 
                 A 
                 74 
                 10.699 
                 24.083 
                 34.838 
                 1.00 
                 43.45 
                 C 
               
               
                 ATOM 
                 561 
                 CD 
                 ARG 
                 A 
                 74 
                 10.850 
                 22.733 
                 34.192 
                 1.00 
                 42.00 
                 C 
               
               
                 ATOM 
                 562 
                 NE 
                 ARG 
                 A 
                 74 
                 9.778 
                 21.852 
                 34.646 
                 1.00 
                 43.41 
                 N 
               
               
                 ATOM 
                 563 
                 CZ 
                 ARG 
                 A 
                 74 
                 9.833 
                 20.523 
                 34.615 
                 1.00 
                 44.43 
                 C 
               
               
                 ATOM 
                 564 
                 NH1 
                 ARG 
                 A 
                 74 
                 8.827 
                 19.802 
                 35.075 
                 1.00 
                 41.62 
                 N 
               
               
                 ATOM 
                 565 
                 NH2 
                 ARG 
                 A 
                 74 
                 10.914 
                 19.910 
                 34.152 
                 1.00 
                 46.68 
                 N 
               
               
                 ATOM 
                 566 
                 C 
                 ARG 
                 A 
                 74 
                 12.011 
                 27.437 
                 33.489 
                 1.00 
                 43.68 
                 C 
               
               
                 ATOM 
                 567 
                 O 
                 ARG 
                 A 
                 74 
                 12.044 
                 27.522 
                 32.275 
                 1.00 
                 43.51 
                 O 
               
               
                 ATOM 
                 568 
                 N 
                 VAL 
                 A 
                 75 
                 12.840 
                 28.117 
                 34.272 
                 1.00 
                 44.03 
                 N 
               
               
                 ATOM 
                 569 
                 CA 
                 VAL 
                 A 
                 75 
                 13.843 
                 29.050 
                 33.721 
                 1.00 
                 44.68 
                 C 
               
               
                 ATOM 
                 570 
                 CB 
                 VAL 
                 A 
                 75 
                 14.721 
                 29.674 
                 34.832 
                 1.00 
                 44.80 
                 C 
               
               
                 ATOM 
                 571 
                 CG1 
                 VAL 
                 A 
                 75 
                 15.612 
                 30.776 
                 34.269 
                 1.00 
                 45.53 
                 C 
               
               
                 ATOM 
                 572 
                 CG2 
                 VAL 
                 A 
                 75 
                 13.843 
                 30.232 
                 35.978 
                 1.00 
                 44.80 
                 C 
               
               
                 ATOM 
                 573 
                 C 
                 VAL 
                 A 
                 75 
                 14.709 
                 28.404 
                 32.615 
                 1.00 
                 44.75 
                 C 
               
               
                 ATOM 
                 574 
                 O 
                 VAL 
                 A 
                 75 
                 15.105 
                 29.063 
                 31.660 
                 1.00 
                 43.97 
                 O 
               
               
                 ATOM 
                 575 
                 N 
                 GLU 
                 A 
                 76 
                 14.940 
                 27.099 
                 32.726 
                 1.00 
                 45.06 
                 N 
               
               
                 ATOM 
                 576 
                 CA 
                 GLU 
                 A 
                 76 
                 15.736 
                 26.364 
                 31.737 
                 1.00 
                 45.93 
                 C 
               
               
                 ATOM 
                 577 
                 CB 
                 GLU 
                 A 
                 76 
                 16.321 
                 25.095 
                 32.381 
                 1.00 
                 46.31 
                 C 
               
               
                 ATOM 
                 578 
                 CG 
                 GLU 
                 A 
                 76 
                 15.275 
                 24.161 
                 32.999 
                 1.00 
                 48.76 
                 C 
               
               
                 ATOM 
                 579 
                 CD 
                 GLU 
                 A 
                 76 
                 15.109 
                 24.314 
                 34.520 
                 1.00 
                 51.57 
                 C 
               
               
                 ATOM 
                 580 
                 OE1 
                 GLU 
                 A 
                 76 
                 14.648 
                 23.325 
                 35.150 
                 1.00 
                 52.40 
                 O 
               
               
                 ATOM 
                 581 
                 OE2 
                 GLU 
                 A 
                 76 
                 15.425 
                 25.395 
                 35.082 
                 1.00 
                 50.39 
                 O 
               
               
                 ATOM 
                 582 
                 C 
                 GLU 
                 A 
                 76 
                 14.994 
                 26.043 
                 30.400 
                 1.00 
                 45.85 
                 C 
               
               
                 ATOM 
                 583 
                 O 
                 GLU 
                 A 
                 76 
                 15.585 
                 25.503 
                 29.447 
                 1.00 
                 45.45 
                 O 
               
               
                 ATOM 
                 584 
                 N 
                 ASP 
                 A 
                 77 
                 13.705 
                 26.374 
                 30.341 
                 1.00 
                 45.80 
                 N 
               
               
                 ATOM 
                 585 
                 CA 
                 ASP 
                 A 
                 77 
                 12.942 
                 26.294 
                 29.082 
                 1.00 
                 44.88 
                 C 
               
               
                 ATOM 
                 586 
                 CB 
                 ASP 
                 A 
                 77 
                 11.452 
                 26.083 
                 29.370 
                 1.00 
                 44.95 
                 C 
               
               
                 ATOM 
                 587 
                 CG 
                 ASP 
                 A 
                 77 
                 11.160 
                 24.767 
                 30.081 
                 1.00 
                 46.55 
                 C 
               
               
                 ATOM 
                 588 
                 OD1 
                 ASP 
                 A 
                 77 
                 11.753 
                 23.722 
                 29.728 
                 1.00 
                 46.55 
                 O 
               
               
                 ATOM 
                 589 
                 OD2 
                 ASP 
                 A 
                 77 
                 10.291 
                 24.763 
                 30.975 
                 1.00 
                 47.83 
                 O 
               
               
                 ATOM 
                 590 
                 C 
                 ASP 
                 A 
                 77 
                 13.162 
                 27.535 
                 28.204 
                 1.00 
                 44.03 
                 C 
               
               
                 ATOM 
                 591 
                 O 
                 ASP 
                 A 
                 77 
                 12.911 
                 27.494 
                 26.991 
                 1.00 
                 44.02 
                 O 
               
               
                 ATOM 
                 592 
                 N 
                 SER 
                 A 
                 78 
                 13.660 
                 28.629 
                 28.789 
                 1.00 
                 43.14 
                 N 
               
               
                 ATOM 
                 593 
                 CA 
                 SER 
                 A 
                 78 
                 14.077 
                 29.796 
                 27.985 
                 1.00 
                 42.43 
                 C 
               
               
                 ATOM 
                 594 
                 CB 
                 SER 
                 A 
                 78 
                 14.855 
                 30.811 
                 28.812 
                 1.00 
                 42.27 
                 C 
               
               
                 ATOM 
                 595 
                 OG 
                 SER 
                 A 
                 78 
                 14.061 
                 31.325 
                 29.855 
                 1.00 
                 45.22 
                 O 
               
               
                 ATOM 
                 596 
                 C 
                 SER 
                 A 
                 78 
                 14.916 
                 29.363 
                 26.764 
                 1.00 
                 41.89 
                 C 
               
               
                 ATOM 
                 597 
                 O 
                 SER 
                 A 
                 78 
                 15.849 
                 28.570 
                 26.889 
                 1.00 
                 42.32 
                 O 
               
               
                 ATOM 
                 598 
                 N 
                 GLY 
                 A 
                 79 
                 14.600 
                 29.892 
                 25.591 
                 1.00 
                 41.21 
                 N 
               
               
                 ATOM 
                 599 
                 CA 
                 GLY 
                 A 
                 79 
                 15.205 
                 29.375 
                 24.348 
                 1.00 
                 41.10 
                 C 
               
               
                 ATOM 
                 600 
                 C 
                 GLY 
                 A 
                 79 
                 14.457 
                 29.849 
                 23.125 
                 1.00 
                 41.37 
                 C 
               
               
                 ATOM 
                 601 
                 O 
                 GLY 
                 A 
                 79 
                 13.426 
                 30.528 
                 23.223 
                 1.00 
                 41.44 
                 O 
               
               
                 ATOM 
                 602 
                 N 
                 THR 
                 A 
                 80 
                 15.012 
                 29.556 
                 21.961 
                 1.00 
                 41.26 
                 N 
               
               
                 ATOM 
                 603 
                 CA 
                 THR 
                 A 
                 80 
                 14.302 
                 29.778 
                 20.702 
                 1.00 
                 41.23 
                 C 
               
               
                 ATOM 
                 604 
                 CB 
                 THR 
                 A 
                 80 
                 15.234 
                 30.352 
                 19.639 
                 1.00 
                 40.40 
                 C 
               
               
                 ATOM 
                 605 
                 OG1 
                 THR 
                 A 
                 80 
                 15.748 
                 31.599 
                 20.124 
                 1.00 
                 40.92 
                 O 
               
               
                 ATOM 
                 606 
                 CG2 
                 THR 
                 A 
                 80 
                 14.478 
                 30.616 
                 18.350 
                 1.00 
                 41.08 
                 C 
               
               
                 ATOM 
                 607 
                 C 
                 THR 
                 A 
                 80 
                 13.713 
                 28.441 
                 20.278 
                 1.00 
                 41.52 
                 C 
               
               
                 ATOM 
                 608 
                 O 
                 THR 
                 A 
                 80 
                 14.399 
                 27.396 
                 20.256 
                 1.00 
                 40.53 
                 O 
               
               
                 ATOM 
                 609 
                 N 
                 TYR 
                 A 
                 81 
                 12.427 
                 28.479 
                 19.975 
                 1.00 
                 42.20 
                 N 
               
               
                 ATOM 
                 610 
                 CA 
                 TYR 
                 A 
                 81 
                 11.701 
                 27.273 
                 19.624 
                 1.00 
                 42.88 
                 C 
               
               
                 ATOM 
                 611 
                 CB 
                 TYR 
                 A 
                 81 
                 10.517 
                 27.079 
                 20.576 
                 1.00 
                 42.50 
                 C 
               
               
                 ATOM 
                 612 
                 CG 
                 TYR 
                 A 
                 81 
                 10.876 
                 26.675 
                 21.993 
                 1.00 
                 43.04 
                 C 
               
               
                 ATOM 
                 613 
                 CD1 
                 TYR 
                 A 
                 81 
                 11.258 
                 27.628 
                 22.947 
                 1.00 
                 42.08 
                 C 
               
               
                 ATOM 
                 614 
                 CE1 
                 TYR 
                 A 
                 81 
                 11.591 
                 27.248 
                 24.246 
                 1.00 
                 40.82 
                 C 
               
               
                 ATOM 
                 615 
                 CZ 
                 TYR 
                 A 
                 81 
                 11.540 
                 25.910 
                 24.619 
                 1.00 
                 41.51 
                 C 
               
               
                 ATOM 
                 616 
                 OH 
                 TYR 
                 A 
                 81 
                 11.888 
                 25.530 
                 25.909 
                 1.00 
                 41.77 
                 O 
               
               
                 ATOM 
                 617 
                 CE2 
                 TYR 
                 A 
                 81 
                 11.147 
                 24.957 
                 23.712 
                 1.00 
                 42.75 
                 C 
               
               
                 ATOM 
                 618 
                 CD2 
                 TYR 
                 A 
                 81 
                 10.807 
                 25.338 
                 22.402 
                 1.00 
                 44.77 
                 C 
               
               
                 ATOM 
                 619 
                 C 
                 TYR 
                 A 
                 81 
                 11.244 
                 27.466 
                 18.192 
                 1.00 
                 43.89 
                 C 
               
               
                 ATOM 
                 620 
                 O 
                 TYR 
                 A 
                 81 
                 10.884 
                 28.587 
                 17.784 
                 1.00 
                 44.08 
                 O 
               
               
                 ATOM 
                 621 
                 N 
                 LYS 
                 A 
                 82 
                 11.309 
                 26.390 
                 17.414 
                 1.00 
                 44.31 
                 N 
               
               
                 ATOM 
                 622 
                 CA 
                 LYS 
                 A 
                 82 
                 10.903 
                 26.405 
                 16.020 
                 1.00 
                 44.69 
                 C 
               
               
                 ATOM 
                 623 
                 CB 
                 LYS 
                 A 
                 82 
                 12.116 
                 26.515 
                 15.090 
                 1.00 
                 45.16 
                 C 
               
               
                 ATOM 
                 624 
                 CG 
                 LYS 
                 A 
                 82 
                 12.764 
                 27.870 
                 14.991 
                 1.00 
                 47.79 
                 C 
               
               
                 ATOM 
                 625 
                 CD 
                 LYS 
                 A 
                 82 
                 14.103 
                 27.702 
                 14.313 
                 1.00 
                 50.84 
                 C 
               
               
                 ATOM 
                 626 
                 CE 
                 LYS 
                 A 
                 82 
                 15.117 
                 28.697 
                 14.882 
                 1.00 
                 57.07 
                 C 
               
               
                 ATOM 
                 627 
                 NZ 
                 LYS 
                 A 
                 82 
                 14.749 
                 30.121 
                 14.595 
                 1.00 
                 58.51 
                 N 
               
               
                 ATOM 
                 628 
                 C 
                 LYS 
                 A 
                 82 
                 10.180 
                 25.096 
                 15.722 
                 1.00 
                 44.51 
                 C 
               
               
                 ATOM 
                 629 
                 O 
                 LYS 
                 A 
                 82 
                 10.470 
                 24.057 
                 16.367 
                 1.00 
                 43.69 
                 O 
               
               
                 ATOM 
                 630 
                 N 
                 CYS 
                 A 
                 83 
                 9.252 
                 25.164 
                 14.756 
                 1.00 
                 43.58 
                 N 
               
               
                 ATOM 
                 631 
                 CA 
                 CYS 
                 A 
                 83 
                 8.637 
                 23.975 
                 14.139 
                 1.00 
                 43.92 
                 C 
               
               
                 ATOM 
                 632 
                 CB 
                 CYS 
                 A 
                 83 
                 7.118 
                 24.116 
                 14.069 
                 1.00 
                 44.57 
                 C 
               
               
                 ATOM 
                 633 
                 SG 
                 CYS 
                 A 
                 83 
                 6.599 
                 25.545 
                 13.076 
                 1.00 
                 45.39 
                 S 
               
               
                 ATOM 
                 634 
                 C 
                 CYS 
                 A 
                 83 
                 9.157 
                 23.755 
                 12.711 
                 1.00 
                 43.64 
                 C 
               
               
                 ATOM 
                 635 
                 O 
                 CYS 
                 A 
                 83 
                 9.508 
                 24.712 
                 12.004 
                 1.00 
                 41.71 
                 O 
               
               
                 ATOM 
                 636 
                 N 
                 LYS 
                 A 
                 84 
                 9.227 
                 22.476 
                 12.334 
                 1.00 
                 44.18 
                 N 
               
               
                 ATOM 
                 637 
                 CA 
                 LYS 
                 A 
                 84 
                 9.492 
                 22.022 
                 10.982 
                 1.00 
                 45.42 
                 C 
               
               
                 ATOM 
                 638 
                 CB 
                 LYS 
                 A 
                 84 
                 10.647 
                 21.020 
                 10.957 
                 1.00 
                 46.76 
                 C 
               
               
                 ATOM 
                 639 
                 CG 
                 LYS 
                 A 
                 84 
                 12.060 
                 21.586 
                 10.916 
                 1.00 
                 48.51 
                 C 
               
               
                 ATOM 
                 640 
                 CD 
                 LYS 
                 A 
                 84 
                 12.977 
                 20.615 
                 10.171 
                 1.00 
                 53.46 
                 C 
               
               
                 ATOM 
                 641 
                 CE 
                 LYS 
                 A 
                 84 
                 14.486 
                 20.718 
                 10.553 
                 1.00 
                 53.84 
                 C 
               
               
                 ATOM 
                 642 
                 NZ 
                 LYS 
                 A 
                 84 
                 15.072 
                 22.085 
                 10.793 
                 1.00 
                 53.72 
                 N 
               
               
                 ATOM 
                 643 
                 C 
                 LYS 
                 A 
                 84 
                 8.253 
                 21.275 
                 10.551 
                 1.00 
                 45.80 
                 C 
               
               
                 ATOM 
                 644 
                 O 
                 LYS 
                 A 
                 84 
                 7.891 
                 20.280 
                 11.175 
                 1.00 
                 47.54 
                 O 
               
               
                 ATOM 
                 645 
                 N 
                 ALA 
                 A 
                 85 
                 7.583 
                 21.781 
                 9.522 
                 1.00 
                 45.28 
                 N 
               
               
                 ATOM 
                 646 
                 CA 
                 ALA 
                 A 
                 85 
                 6.374 
                 21.196 
                 8.991 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 647 
                 CB 
                 ALA 
                 A 
                 85 
                 5.403 
                 22.295 
                 8.615 
                 1.00 
                 44.83 
                 C 
               
               
                 ATOM 
                 648 
                 C 
                 ALA 
                 A 
                 85 
                 6.708 
                 20.343 
                 7.787 
                 1.00 
                 45.27 
                 C 
               
               
                 ATOM 
                 649 
                 O 
                 ALA 
                 A 
                 85 
                 7.288 
                 20.831 
                 6.827 
                 1.00 
                 44.57 
                 O 
               
               
                 ATOM 
                 650 
                 N 
                 TYR 
                 A 
                 86 
                 6.363 
                 19.058 
                 7.861 
                 1.00 
                 45.35 
                 N 
               
               
                 ATOM 
                 651 
                 CA 
                 TYR 
                 A 
                 86 
                 6.435 
                 18.160 
                 6.717 
                 1.00 
                 45.77 
                 C 
               
               
                 ATOM 
                 652 
                 CB 
                 TYR 
                 A 
                 86 
                 6.775 
                 16.736 
                 7.174 
                 1.00 
                 46.34 
                 C 
               
               
                 ATOM 
                 653 
                 CG 
                 TYR 
                 A 
                 86 
                 8.056 
                 16.762 
                 7.964 
                 1.00 
                 48.76 
                 C 
               
               
                 ATOM 
                 654 
                 CD1 
                 TYR 
                 A 
                 86 
                 8.038 
                 16.975 
                 9.343 
                 1.00 
                 50.37 
                 C 
               
               
                 ATOM 
                 655 
                 CE1 
                 TYR 
                 A 
                 86 
                 9.214 
                 17.058 
                 10.084 
                 1.00 
                 51.40 
                 C 
               
               
                 ATOM 
                 656 
                 CZ 
                 TYR 
                 A 
                 86 
                 10.427 
                 16.942 
                 9.447 
                 1.00 
                 50.41 
                 C 
               
               
                 ATOM 
                 657 
                 OH 
                 TYR 
                 A 
                 86 
                 11.579 
                 17.012 
                 10.193 
                 1.00 
                 50.04 
                 O 
               
               
                 ATOM 
                 658 
                 CE2 
                 TYR 
                 A 
                 86 
                 10.488 
                 16.746 
                 8.067 
                 1.00 
                 52.75 
                 C 
               
               
                 ATOM 
                 659 
                 CD2 
                 TYR 
                 A 
                 86 
                 9.293 
                 16.660 
                 7.327 
                 1.00 
                 51.59 
                 C 
               
               
                 ATOM 
                 660 
                 C 
                 TYR 
                 A 
                 86 
                 5.110 
                 18.260 
                 5.970 
                 1.00 
                 45.44 
                 C 
               
               
                 ATOM 
                 661 
                 O 
                 TYR 
                 A 
                 86 
                 4.097 
                 18.623 
                 6.568 
                 1.00 
                 45.39 
                 O 
               
               
                 ATOM 
                 662 
                 N 
                 ARG 
                 A 
                 87 
                 5.113 
                 17.970 
                 4.671 
                 1.00 
                 44.88 
                 N 
               
               
                 ATOM 
                 663 
                 CA 
                 ARG 
                 A 
                 87 
                 3.922 
                 18.186 
                 3.839 
                 1.00 
                 45.04 
                 C 
               
               
                 ATOM 
                 664 
                 CB 
                 ARG 
                 A 
                 87 
                 4.082 
                 19.422 
                 2.940 
                 1.00 
                 44.90 
                 C 
               
               
                 ATOM 
                 665 
                 CG 
                 ARG 
                 A 
                 87 
                 4.795 
                 20.547 
                 3.675 
                 1.00 
                 46.39 
                 C 
               
               
                 ATOM 
                 666 
                 CD 
                 ARG 
                 A 
                 87 
                 4.537 
                 21.958 
                 3.168 
                 1.00 
                 46.94 
                 C 
               
               
                 ATOM 
                 667 
                 NE 
                 ARG 
                 A 
                 87 
                 4.855 
                 22.168 
                 1.775 
                 1.00 
                 44.54 
                 N 
               
               
                 ATOM 
                 668 
                 CZ 
                 ARG 
                 A 
                 87 
                 6.063 
                 22.093 
                 1.227 
                 1.00 
                 45.63 
                 C 
               
               
                 ATOM 
                 669 
                 NH1 
                 ARG 
                 A 
                 87 
                 6.192 
                 22.323 
                 −0.071 
                 1.00 
                 41.09 
                 N 
               
               
                 ATOM 
                 670 
                 NH2 
                 ARG 
                 A 
                 87 
                 7.132 
                 21.788 
                 1.955 
                 1.00 
                 48.23 
                 N 
               
               
                 ATOM 
                 671 
                 C 
                 ARG 
                 A 
                 87 
                 3.533 
                 16.958 
                 3.023 
                 1.00 
                 44.92 
                 C 
               
               
                 ATOM 
                 672 
                 O 
                 ARG 
                 A 
                 87 
                 4.366 
                 16.103 
                 2.700 
                 1.00 
                 45.77 
                 O 
               
               
                 ATOM 
                 673 
                 N 
                 ARG 
                 A 
                 88 
                 2.248 
                 16.881 
                 2.721 
                 1.00 
                 44.30 
                 N 
               
               
                 ATOM 
                 674 
                 CA 
                 ARG 
                 A 
                 88 
                 1.668 
                 15.817 
                 1.928 
                 1.00 
                 43.99 
                 C 
               
               
                 ATOM 
                 675 
                 CB 
                 ARG 
                 A 
                 88 
                 0.696 
                 15.000 
                 2.807 
                 1.00 
                 43.99 
                 C 
               
               
                 ATOM 
                 676 
                 CG 
                 ARG 
                 A 
                 88 
                 −0.252 
                 14.029 
                 2.076 
                 1.00 
                 45.06 
                 C 
               
               
                 ATOM 
                 677 
                 CD 
                 ARG 
                 A 
                 88 
                 0.460 
                 12.944 
                 1.277 
                 1.00 
                 47.65 
                 C 
               
               
                 ATOM 
                 678 
                 NE 
                 ARG 
                 A 
                 88 
                 1.605 
                 12.336 
                 1.965 
                 1.00 
                 51.20 
                 N 
               
               
                 ATOM 
                 679 
                 CZ 
                 ARG 
                 A 
                 88 
                 2.387 
                 11.400 
                 1.414 
                 1.00 
                 52.98 
                 C 
               
               
                 ATOM 
                 680 
                 NH1 
                 ARG 
                 A 
                 88 
                 3.420 
                 10.892 
                 2.085 
                 1.00 
                 53.13 
                 N 
               
               
                 ATOM 
                 681 
                 NH2 
                 ARG 
                 A 
                 88 
                 2.132 
                 10.967 
                 0.184 
                 1.00 
                 52.26 
                 N 
               
               
                 ATOM 
                 682 
                 C 
                 ARG 
                 A 
                 88 
                 0.952 
                 16.583 
                 0.837 
                 1.00 
                 43.43 
                 C 
               
               
                 ATOM 
                 683 
                 O 
                 ARG 
                 A 
                 88 
                 0.038 
                 17.364 
                 1.138 
                 1.00 
                 43.15 
                 O 
               
               
                 ATOM 
                 684 
                 N 
                 CYS 
                 A 
                 89 
                 1.415 
                 16.420 
                 −0.415 
                 1.00 
                 43.21 
                 N 
               
               
                 ATOM 
                 685 
                 CA 
                 CYS 
                 A 
                 89 
                 0.884 
                 17.212 
                 −1.507 
                 1.00 
                 42.95 
                 C 
               
               
                 ATOM 
                 686 
                 CB 
                 CYS 
                 A 
                 89 
                 2.000 
                 17.979 
                 −2.229 
                 1.00 
                 42.90 
                 C 
               
               
                 ATOM 
                 687 
                 SG 
                 CYS 
                 A 
                 89 
                 2.955 
                 19.217 
                 −1.275 
                 1.00 
                 43.42 
                 S 
               
               
                 ATOM 
                 688 
                 C 
                 CYS 
                 A 
                 89 
                 0.128 
                 16.305 
                 −2.486 
                 1.00 
                 43.49 
                 C 
               
               
                 ATOM 
                 689 
                 O 
                 CYS 
                 A 
                 89 
                 0.348 
                 15.066 
                 −2.527 
                 1.00 
                 43.18 
                 O 
               
               
                 ATOM 
                 690 
                 N 
                 ALA 
                 A 
                 90 
                 −0.749 
                 16.921 
                 −3.288 
                 1.00 
                 43.77 
                 N 
               
               
                 ATOM 
                 691 
                 CA 
                 ALA 
                 A 
                 90 
                 −1.513 
                 16.151 
                 −4.268 
                 1.00 
                 44.87 
                 C 
               
               
                 ATOM 
                 692 
                 CB 
                 ALA 
                 A 
                 90 
                 −2.429 
                 17.069 
                 −5.090 
                 1.00 
                 44.89 
                 C 
               
               
                 ATOM 
                 693 
                 C 
                 ALA 
                 A 
                 90 
                 −0.644 
                 15.288 
                 −5.199 
                 1.00 
                 45.28 
                 C 
               
               
                 ATOM 
                 694 
                 O 
                 ALA 
                 A 
                 90 
                 −1.169 
                 14.364 
                 −5.833 
                 1.00 
                 45.43 
                 O 
               
               
                 ATOM 
                 695 
                 N 
                 PHE 
                 A 
                 91 
                 0.667 
                 15.576 
                 −5.273 
                 1.00 
                 45.99 
                 N 
               
               
                 ATOM 
                 696 
                 CA 
                 PHE 
                 A 
                 91 
                 1.545 
                 14.830 
                 −6.195 
                 1.00 
                 46.92 
                 C 
               
               
                 ATOM 
                 697 
                 CB 
                 PHE 
                 A 
                 91 
                 2.393 
                 15.747 
                 −7.132 
                 1.00 
                 46.28 
                 C 
               
               
                 ATOM 
                 698 
                 CG 
                 PHE 
                 A 
                 91 
                 2.962 
                 16.963 
                 −6.455 
                 1.00 
                 44.74 
                 C 
               
               
                 ATOM 
                 699 
                 CD1 
                 PHE 
                 A 
                 91 
                 4.151 
                 16.888 
                 −5.738 
                 1.00 
                 44.41 
                 C 
               
               
                 ATOM 
                 700 
                 CE1 
                 PHE 
                 A 
                 91 
                 4.667 
                 18.003 
                 −5.081 
                 1.00 
                 44.69 
                 C 
               
               
                 ATOM 
                 701 
                 CZ 
                 PHE 
                 A 
                 91 
                 3.996 
                 19.211 
                 −5.159 
                 1.00 
                 44.49 
                 C 
               
               
                 ATOM 
                 702 
                 CE2 
                 PHE 
                 A 
                 91 
                 2.809 
                 19.299 
                 −5.898 
                 1.00 
                 44.64 
                 C 
               
               
                 ATOM 
                 703 
                 CD2 
                 PHE 
                 A 
                 91 
                 2.304 
                 18.182 
                 −6.536 
                 1.00 
                 42.85 
                 C 
               
               
                 ATOM 
                 704 
                 C 
                 PHE 
                 A 
                 91 
                 2.414 
                 13.763 
                 −5.536 
                 1.00 
                 48.05 
                 C 
               
               
                 ATOM 
                 705 
                 O 
                 PHE 
                 A 
                 91 
                 2.010 
                 12.597 
                 −5.460 
                 1.00 
                 48.28 
                 O 
               
               
                 ATOM 
                 706 
                 N 
                 ASN 
                 A 
                 92 
                 3.598 
                 14.166 
                 −5.067 
                 1.00 
                 49.62 
                 N 
               
               
                 ATOM 
                 707 
                 CA 
                 ASN 
                 A 
                 92 
                 4.708 
                 13.232 
                 −4.837 
                 1.00 
                 51.06 
                 C 
               
               
                 ATOM 
                 708 
                 CB 
                 ASN 
                 A 
                 92 
                 5.379 
                 12.890 
                 −6.178 
                 1.00 
                 50.88 
                 C 
               
               
                 ATOM 
                 709 
                 CG 
                 ASN 
                 A 
                 92 
                 4.729 
                 11.730 
                 −6.890 
                 1.00 
                 50.22 
                 C 
               
               
                 ATOM 
                 710 
                 OD1 
                 ASN 
                 A 
                 92 
                 4.899 
                 11.570 
                 −8.092 
                 1.00 
                 50.52 
                 O 
               
               
                 ATOM 
                 711 
                 ND2 
                 ASN 
                 A 
                 92 
                 3.991 
                 10.909 
                 −6.156 
                 1.00 
                 49.11 
                 N 
               
               
                 ATOM 
                 712 
                 C 
                 ASN 
                 A 
                 92 
                 5.801 
                 13.698 
                 −3.866 
                 1.00 
                 52.19 
                 C 
               
               
                 ATOM 
                 713 
                 O 
                 ASN 
                 A 
                 92 
                 5.677 
                 14.734 
                 −3.197 
                 1.00 
                 52.40 
                 O 
               
               
                 ATOM 
                 714 
                 N 
                 THR 
                 A 
                 93 
                 6.880 
                 12.914 
                 −3.824 
                 1.00 
                 53.42 
                 N 
               
               
                 ATOM 
                 715 
                 CA 
                 THR 
                 A 
                 93 
                 8.083 
                 13.223 
                 −3.052 
                 1.00 
                 54.60 
                 C 
               
               
                 ATOM 
                 716 
                 CB 
                 THR 
                 A 
                 93 
                 8.994 
                 11.972 
                 −2.916 
                 1.00 
                 54.62 
                 C 
               
               
                 ATOM 
                 717 
                 OG1 
                 THR 
                 A 
                 93 
                 8.874 
                 11.154 
                 −4.091 
                 1.00 
                 53.58 
                 O 
               
               
                 ATOM 
                 718 
                 CG2 
                 THR 
                 A 
                 93 
                 8.596 
                 11.159 
                 −1.685 
                 1.00 
                 54.51 
                 C 
               
               
                 ATOM 
                 719 
                 C 
                 THR 
                 A 
                 93 
                 8.868 
                 14.414 
                 −3.632 
                 1.00 
                 55.41 
                 C 
               
               
                 ATOM 
                 720 
                 O 
                 THR 
                 A 
                 93 
                 9.611 
                 14.280 
                 −4.620 
                 1.00 
                 55.67 
                 O 
               
               
                 ATOM 
                 721 
                 N 
                 GLY 
                 A 
                 94 
                 8.692 
                 15.574 
                 −2.998 
                 1.00 
                 56.30 
                 N 
               
               
                 ATOM 
                 722 
                 CA 
                 GLY 
                 A 
                 94 
                 9.345 
                 16.808 
                 −3.421 
                 1.00 
                 56.84 
                 C 
               
               
                 ATOM 
                 723 
                 C 
                 GLY 
                 A 
                 94 
                 9.800 
                 17.601 
                 −2.212 
                 1.00 
                 57.51 
                 C 
               
               
                 ATOM 
                 724 
                 O 
                 GLY 
                 A 
                 94 
                 9.473 
                 17.239 
                 −1.081 
                 1.00 
                 57.17 
                 O 
               
               
                 ATOM 
                 725 
                 N 
                 VAL 
                 A 
                 95 
                 10.551 
                 18.680 
                 −2.472 
                 1.00 
                 58.10 
                 N 
               
               
                 ATOM 
                 726 
                 CA 
                 VAL 
                 A 
                 95 
                 11.176 
                 19.569 
                 −1.456 
                 1.00 
                 58.30 
                 C 
               
               
                 ATOM 
                 727 
                 CB 
                 VAL 
                 A 
                 95 
                 11.911 
                 20.790 
                 −2.131 
                 1.00 
                 58.41 
                 C 
               
               
                 ATOM 
                 728 
                 CG1 
                 VAL 
                 A 
                 95 
                 13.412 
                 20.494 
                 −2.326 
                 1.00 
                 58.19 
                 C 
               
               
                 ATOM 
                 729 
                 CG2 
                 VAL 
                 A 
                 95 
                 11.712 
                 22.104 
                 −1.347 
                 1.00 
                 58.50 
                 C 
               
               
                 ATOM 
                 730 
                 C 
                 VAL 
                 A 
                 95 
                 10.253 
                 20.029 
                 −0.314 
                 1.00 
                 58.52 
                 C 
               
               
                 ATOM 
                 731 
                 O 
                 VAL 
                 A 
                 95 
                 9.675 
                 21.124 
                 −0.345 
                 1.00 
                 59.14 
                 O 
               
               
                 ATOM 
                 732 
                 N 
                 GLY 
                 A 
                 96 
                 10.150 
                 19.189 
                 0.711 
                 1.00 
                 58.23 
                 N 
               
               
                 ATOM 
                 733 
                 CA 
                 GLY 
                 A 
                 96 
                 9.231 
                 19.439 
                 1.795 
                 1.00 
                 57.55 
                 C 
               
               
                 ATOM 
                 734 
                 C 
                 GLY 
                 A 
                 96 
                 9.904 
                 19.629 
                 3.128 
                 1.00 
                 57.16 
                 C 
               
               
                 ATOM 
                 735 
                 O 
                 GLY 
                 A 
                 96 
                 11.107 
                 19.410 
                 3.291 
                 1.00 
                 57.41 
                 O 
               
               
                 ATOM 
                 736 
                 N 
                 TYR 
                 A 
                 97 
                 9.080 
                 19.986 
                 4.097 
                 1.00 
                 56.75 
                 N 
               
               
                 ATOM 
                 737 
                 CA 
                 TYR 
                 A 
                 97 
                 9.536 
                 20.547 
                 5.355 
                 1.00 
                 55.42 
                 C 
               
               
                 ATOM 
                 738 
                 CB 
                 TYR 
                 A 
                 97 
                 10.632 
                 19.684 
                 6.021 
                 1.00 
                 55.74 
                 C 
               
               
                 ATOM 
                 739 
                 CG 
                 TYR 
                 A 
                 97 
                 11.960 
                 20.312 
                 6.399 
                 1.00 
                 56.10 
                 C 
               
               
                 ATOM 
                 740 
                 CD1 
                 TYR 
                 A 
                 97 
                 12.041 
                 21.541 
                 7.057 
                 1.00 
                 56.27 
                 C 
               
               
                 ATOM 
                 741 
                 CE1 
                 TYR 
                 A 
                 97 
                 13.296 
                 22.095 
                 7.410 
                 1.00 
                 57.14 
                 C 
               
               
                 ATOM 
                 742 
                 CZ 
                 TYR 
                 A 
                 97 
                 14.461 
                 21.387 
                 7.126 
                 1.00 
                 56.83 
                 C 
               
               
                 ATOM 
                 743 
                 OH 
                 TYR 
                 A 
                 97 
                 15.689 
                 21.887 
                 7.473 
                 1.00 
                 55.48 
                 O 
               
               
                 ATOM 
                 744 
                 CE2 
                 TYR 
                 A 
                 97 
                 14.391 
                 20.154 
                 6.503 
                 1.00 
                 57.28 
                 C 
               
               
                 ATOM 
                 745 
                 CD2 
                 TYR 
                 A 
                 97 
                 13.150 
                 19.623 
                 6.149 
                 1.00 
                 56.77 
                 C 
               
               
                 ATOM 
                 746 
                 C 
                 TYR 
                 A 
                 97 
                 9.846 
                 22.013 
                 5.115 
                 1.00 
                 54.29 
                 C 
               
               
                 ATOM 
                 747 
                 O 
                 TYR 
                 A 
                 97 
                 10.748 
                 22.376 
                 4.358 
                 1.00 
                 54.07 
                 O 
               
               
                 ATOM 
                 748 
                 N 
                 LYS 
                 A 
                 98 
                 8.963 
                 22.829 
                 5.671 
                 1.00 
                 52.88 
                 N 
               
               
                 ATOM 
                 749 
                 CA 
                 LYS 
                 A 
                 98 
                 9.117 
                 24.254 
                 5.774 
                 1.00 
                 52.16 
                 C 
               
               
                 ATOM 
                 750 
                 CB 
                 LYS 
                 A 
                 98 
                 7.918 
                 24.963 
                 5.146 
                 1.00 
                 52.30 
                 C 
               
               
                 ATOM 
                 751 
                 CG 
                 LYS 
                 A 
                 98 
                 7.868 
                 24.902 
                 3.594 
                 1.00 
                 51.71 
                 C 
               
               
                 ATOM 
                 752 
                 CD 
                 LYS 
                 A 
                 98 
                 8.873 
                 25.820 
                 2.951 
                 1.00 
                 51.20 
                 C 
               
               
                 ATOM 
                 753 
                 CE 
                 LYS 
                 A 
                 98 
                 9.000 
                 25.574 
                 1.445 
                 1.00 
                 52.94 
                 C 
               
               
                 ATOM 
                 754 
                 NZ 
                 LYS 
                 A 
                 98 
                 7.778 
                 25.938 
                 0.660 
                 1.00 
                 53.22 
                 N 
               
               
                 ATOM 
                 755 
                 C 
                 LYS 
                 A 
                 98 
                 9.216 
                 24.543 
                 7.260 
                 1.00 
                 51.92 
                 C 
               
               
                 ATOM 
                 756 
                 O 
                 LYS 
                 A 
                 98 
                 8.681 
                 23.804 
                 8.070 
                 1.00 
                 50.81 
                 O 
               
               
                 ATOM 
                 757 
                 N 
                 GLU 
                 A 
                 99 
                 9.931 
                 25.603 
                 7.610 
                 1.00 
                 52.28 
                 N 
               
               
                 ATOM 
                 758 
                 CA 
                 GLU 
                 A 
                 99 
                 10.230 
                 25.940 
                 9.000 
                 1.00 
                 53.27 
                 C 
               
               
                 ATOM 
                 759 
                 CB 
                 GLU 
                 A 
                 99 
                 11.721 
                 26.262 
                 9.140 
                 1.00 
                 53.26 
                 C 
               
               
                 ATOM 
                 760 
                 CG 
                 GLU 
                 A 
                 99 
                 12.638 
                 25.140 
                 9.605 
                 1.00 
                 55.49 
                 C 
               
               
                 ATOM 
                 761 
                 CD 
                 GLU 
                 A 
                 99 
                 13.946 
                 25.678 
                 10.221 
                 1.00 
                 56.41 
                 C 
               
               
                 ATOM 
                 762 
                 OE1 
                 GLU 
                 A 
                 99 
                 14.761 
                 24.867 
                 10.720 
                 1.00 
                 60.13 
                 O 
               
               
                 ATOM 
                 763 
                 OE2 
                 GLU 
                 A 
                 99 
                 14.168 
                 26.916 
                 10.214 
                 1.00 
                 60.48 
                 O 
               
               
                 ATOM 
                 764 
                 C 
                 GLU 
                 A 
                 99 
                 9.438 
                 27.174 
                 9.456 
                 1.00 
                 52.61 
                 C 
               
               
                 ATOM 
                 765 
                 O 
                 GLU 
                 A 
                 99 
                 9.172 
                 28.086 
                 8.651 
                 1.00 
                 52.40 
                 O 
               
               
                 ATOM 
                 766 
                 N 
                 GLY 
                 A 
                 100 
                 9.078 
                 27.200 
                 10.741 
                 1.00 
                 51.81 
                 N 
               
               
                 ATOM 
                 767 
                 CA 
                 GLY 
                 A 
                 100 
                 8.580 
                 28.413 
                 11.382 
                 1.00 
                 50.72 
                 C 
               
               
                 ATOM 
                 768 
                 C 
                 GLY 
                 A 
                 100 
                 9.744 
                 29.356 
                 11.618 
                 1.00 
                 50.01 
                 C 
               
               
                 ATOM 
                 769 
                 O 
                 GLY 
                 A 
                 100 
                 10.886 
                 28.903 
                 11.701 
                 1.00 
                 49.52 
                 O 
               
               
                 ATOM 
                 770 
                 N 
                 ALA 
                 A 
                 101 
                 9.466 
                 30.662 
                 11.717 
                 1.00 
                 49.16 
                 N 
               
               
                 ATOM 
                 771 
                 CA 
                 ALA 
                 A 
                 101 
                 10.527 
                 31.661 
                 11.904 
                 1.00 
                 48.33 
                 C 
               
               
                 ATOM 
                 772 
                 CB 
                 ALA 
                 A 
                 101 
                 10.100 
                 33.021 
                 11.324 
                 1.00 
                 48.12 
                 C 
               
               
                 ATOM 
                 773 
                 C 
                 ALA 
                 A 
                 101 
                 11.027 
                 31.803 
                 13.371 
                 1.00 
                 47.76 
                 C 
               
               
                 ATOM 
                 774 
                 O 
                 ALA 
                 A 
                 101 
                 11.992 
                 32.535 
                 13.634 
                 1.00 
                 47.69 
                 O 
               
               
                 ATOM 
                 775 
                 N 
                 GLY 
                 A 
                 102 
                 10.355 
                 31.128 
                 14.305 
                 1.00 
                 47.20 
                 N 
               
               
                 ATOM 
                 776 
                 CA 
                 GLY 
                 A 
                 102 
                 10.790 
                 31.013 
                 15.715 
                 1.00 
                 46.78 
                 C 
               
               
                 ATOM 
                 777 
                 C 
                 GLY 
                 A 
                 102 
                 9.916 
                 31.710 
                 16.745 
                 1.00 
                 46.63 
                 C 
               
               
                 ATOM 
                 778 
                 O 
                 GLY 
                 A 
                 102 
                 9.217 
                 32.681 
                 16.417 
                 1.00 
                 47.73 
                 O 
               
               
                 ATOM 
                 779 
                 N 
                 THR 
                 A 
                 103 
                 9.908 
                 31.178 
                 17.972 
                 1.00 
                 45.85 
                 N 
               
               
                 ATOM 
                 780 
                 CA 
                 THR 
                 A 
                 103 
                 9.426 
                 31.883 
                 19.169 
                 1.00 
                 44.12 
                 C 
               
               
                 ATOM 
                 781 
                 CB 
                 THR 
                 A 
                 103 
                 8.331 
                 31.084 
                 19.922 
                 1.00 
                 44.44 
                 C 
               
               
                 ATOM 
                 782 
                 OG1 
                 THR 
                 A 
                 103 
                 7.235 
                 30.802 
                 19.052 
                 1.00 
                 45.90 
                 O 
               
               
                 ATOM 
                 783 
                 CG2 
                 THR 
                 A 
                 103 
                 7.798 
                 31.873 
                 21.105 
                 1.00 
                 41.87 
                 C 
               
               
                 ATOM 
                 784 
                 C 
                 THR 
                 A 
                 103 
                 10.601 
                 32.067 
                 20.147 
                 1.00 
                 43.84 
                 C 
               
               
                 ATOM 
                 785 
                 O 
                 THR 
                 A 
                 103 
                 11.257 
                 31.085 
                 20.507 
                 1.00 
                 42.90 
                 O 
               
               
                 ATOM 
                 786 
                 N 
                 VAL 
                 A 
                 104 
                 10.862 
                 33.304 
                 20.589 
                 1.00 
                 42.99 
                 N 
               
               
                 ATOM 
                 787 
                 CA 
                 VAL 
                 A 
                 104 
                 11.821 
                 33.546 
                 21.693 
                 1.00 
                 42.66 
                 C 
               
               
                 ATOM 
                 788 
                 CB 
                 VAL 
                 A 
                 104 
                 12.627 
                 34.863 
                 21.516 
                 1.00 
                 42.32 
                 C 
               
               
                 ATOM 
                 789 
                 CG1 
                 VAL 
                 A 
                 104 
                 13.729 
                 34.905 
                 22.549 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 790 
                 CG2 
                 VAL 
                 A 
                 104 
                 13.198 
                 34.982 
                 20.109 
                 1.00 
                 42.86 
                 C 
               
               
                 ATOM 
                 791 
                 C 
                 VAL 
                 A 
                 104 
                 11.141 
                 33.568 
                 23.098 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 792 
                 O 
                 VAL 
                 A 
                 104 
                 10.465 
                 34.543 
                 23.488 
                 1.00 
                 41.37 
                 O 
               
               
                 ATOM 
                 793 
                 N 
                 LEU 
                 A 
                 105 
                 11.360 
                 32.509 
                 23.866 
                 1.00 
                 42.08 
                 N 
               
               
                 ATOM 
                 794 
                 CA 
                 LEU 
                 A 
                 105 
                 10.746 
                 32.396 
                 25.173 
                 1.00 
                 42.02 
                 C 
               
               
                 ATOM 
                 795 
                 CB 
                 LEU 
                 A 
                 105 
                 10.134 
                 30.985 
                 25.370 
                 1.00 
                 41.41 
                 C 
               
               
                 ATOM 
                 796 
                 CG 
                 LEU 
                 A 
                 105 
                 9.750 
                 30.627 
                 26.814 
                 1.00 
                 40.79 
                 C 
               
               
                 ATOM 
                 797 
                 CD1 
                 LEU 
                 A 
                 105 
                 8.484 
                 31.377 
                 27.340 
                 1.00 
                 37.83 
                 C 
               
               
                 ATOM 
                 798 
                 CD2 
                 LEU 
                 A 
                 105 
                 9.593 
                 29.131 
                 26.998 
                 1.00 
                 40.33 
                 C 
               
               
                 ATOM 
                 799 
                 C 
                 LEU 
                 A 
                 105 
                 11.753 
                 32.736 
                 26.272 
                 1.00 
                 42.74 
                 C 
               
               
                 ATOM 
                 800 
                 O 
                 LEU 
                 A 
                 105 
                 12.894 
                 32.248 
                 26.274 
                 1.00 
                 42.12 
                 O 
               
               
                 ATOM 
                 801 
                 N 
                 THR 
                 A 
                 106 
                 11.323 
                 33.587 
                 27.203 
                 1.00 
                 43.70 
                 N 
               
               
                 ATOM 
                 802 
                 CA 
                 THR 
                 A 
                 106 
                 12.051 
                 33.796 
                 28.459 
                 1.00 
                 44.17 
                 C 
               
               
                 ATOM 
                 803 
                 CB 
                 THR 
                 A 
                 106 
                 12.621 
                 35.232 
                 28.590 
                 1.00 
                 44.10 
                 C 
               
               
                 ATOM 
                 804 
                 OG1 
                 THR 
                 A 
                 106 
                 13.521 
                 35.493 
                 27.512 
                 1.00 
                 43.79 
                 O 
               
               
                 ATOM 
                 805 
                 CG2 
                 THR 
                 A 
                 106 
                 13.399 
                 35.362 
                 29.872 
                 1.00 
                 43.32 
                 C 
               
               
                 ATOM 
                 806 
                 C 
                 THR 
                 A 
                 106 
                 11.154 
                 33.465 
                 29.666 
                 1.00 
                 45.05 
                 C 
               
               
                 ATOM 
                 807 
                 O 
                 THR 
                 A 
                 106 
                 10.015 
                 33.942 
                 29.770 
                 1.00 
                 45.24 
                 O 
               
               
                 ATOM 
                 808 
                 N 
                 VAL 
                 A 
                 107 
                 11.679 
                 32.648 
                 30.574 
                 1.00 
                 45.71 
                 N 
               
               
                 ATOM 
                 809 
                 CA 
                 VAL 
                 A 
                 107 
                 10.946 
                 32.265 
                 31.780 
                 1.00 
                 46.23 
                 C 
               
               
                 ATOM 
                 810 
                 CB 
                 VAL 
                 A 
                 107 
                 10.790 
                 30.730 
                 31.916 
                 1.00 
                 45.95 
                 C 
               
               
                 ATOM 
                 811 
                 CG1 
                 VAL 
                 A 
                 107 
                 9.747 
                 30.402 
                 32.993 
                 1.00 
                 45.73 
                 C 
               
               
                 ATOM 
                 812 
                 CG2 
                 VAL 
                 A 
                 107 
                 10.394 
                 30.105 
                 30.561 
                 1.00 
                 44.60 
                 C 
               
               
                 ATOM 
                 813 
                 C 
                 VAL 
                 A 
                 107 
                 11.618 
                 32.850 
                 33.016 
                 1.00 
                 47.10 
                 C 
               
               
                 ATOM 
                 814 
                 O 
                 VAL 
                 A 
                 107 
                 12.778 
                 32.556 
                 33.301 
                 1.00 
                 46.92 
                 O 
               
               
                 ATOM 
                 815 
                 N 
                 LYS 
                 A 
                 108 
                 10.840 
                 33.668 
                 33.727 
                 1.00 
                 48.46 
                 N 
               
               
                 ATOM 
                 816 
                 CA 
                 LYS 
                 A 
                 108 
                 11.258 
                 34.453 
                 34.889 
                 1.00 
                 49.58 
                 C 
               
               
                 ATOM 
                 817 
                 CB 
                 LYS 
                 A 
                 108 
                 11.515 
                 33.576 
                 36.110 
                 1.00 
                 49.94 
                 C 
               
               
                 ATOM 
                 818 
                 CG 
                 LYS 
                 A 
                 108 
                 10.246 
                 33.322 
                 36.937 
                 1.00 
                 49.89 
                 C 
               
               
                 ATOM 
                 819 
                 CD 
                 LYS 
                 A 
                 108 
                 10.037 
                 34.370 
                 38.058 
                 1.00 
                 48.87 
                 C 
               
               
                 ATOM 
                 820 
                 CE 
                 LYS 
                 A 
                 108 
                 11.008 
                 34.151 
                 39.197 
                 1.00 
                 49.35 
                 C 
               
               
                 ATOM 
                 821 
                 NZ 
                 LYS 
                 A 
                 108 
                 11.300 
                 32.697 
                 39.377 
                 1.00 
                 47.83 
                 N 
               
               
                 ATOM 
                 822 
                 C 
                 LYS 
                 A 
                 108 
                 12.435 
                 35.340 
                 34.583 
                 1.00 
                 50.70 
                 C 
               
               
                 ATOM 
                 823 
                 O 
                 LYS 
                 A 
                 108 
                 12.374 
                 36.115 
                 33.626 
                 1.00 
                 52.01 
                 O 
               
               
                 ATOM 
                 824 
                 O 
                 HOH 
                 W 
                 1 
                 10.564 
                 12.981 
                 15.180 
                 1.00 
                 57.87 
                 O 
               
               
                 ATOM 
                 825 
                 O 
                 HOH 
                 W 
                 2 
                 4.884 
                 38.038 
                 19.422 
                 1.00 
                 39.09 
                 O 
               
               
                 ATOM 
                 826 
                 O 
                 HOH 
                 W 
                 3 
                 18.831 
                 30.006 
                 11.592 
                 1.00 
                 61.93 
                 O 
               
               
                 ATOM 
                 827 
                 O 
                 HOH 
                 W 
                 4 
                 1.789 
                 33.404 
                 36.744 
                 1.00 
                 54.79 
                 O 
               
               
                 ATOM 
                 828 
                 O 
                 HOH 
                 W 
                 5 
                 8.978 
                 32.010 
                 7.686 
                 1.00 
                 56.85 
                 O 
               
               
                 ATOM 
                 829 
                 O 
                 HOH 
                 W 
                 6 
                 6.845 
                 33.982 
                 8.593 
                 1.00 
                 71.15 
                 O 
               
               
                 ATOM 
                 830 
                 O 
                 HOH 
                 W 
                 7 
                 10.498 
                 39.946 
                 15.695 
                 1.00 
                 65.23 
                 O 
               
               
                 ATOM 
                 831 
                 O 
                 HOH 
                 W 
                 8 
                 13.932 
                 22.652 
                 30.685 
                 1.00 
                 42.16 
                 O 
               
               
                 ATOM 
                 832 
                 O 
                 HOH 
                 W 
                 9 
                 −3.165 
                 18.770 
                 8.538 
                 1.00 
                 39.40 
                 O 
               
               
                 ATOM 
                 833 
                 O 
                 HOH 
                 W 
                 10 
                 18.047 
                 27.608 
                 16.064 
                 1.00 
                 55.15 
                 O 
               
               
                 ATOM 
                 834 
                 O 
                 HOH 
                 W 
                 11 
                 −11.674 
                 22.619 
                 11.921 
                 1.00 
                 63.53 
                 O 
               
               
                 ATOM 
                 835 
                 O 
                 HOH 
                 W 
                 12 
                 12.389 
                 9.964 
                 5.651 
                 1.00 
                 63.77 
                 O 
               
               
                 ATOM 
                 836 
                 O 
                 HOH 
                 W 
                 13 
                 −2.440 
                 23.895 
                 28.901 
                 1.00 
                 65.10 
                 O 
               
               
                 ATOM 
                 837 
                 O 
                 HOH 
                 W 
                 14 
                 1.615 
                 35.824 
                 29.148 
                 1.00 
                 52.11 
                 O 
               
               
                 ATOM 
                 838 
                 O 
                 HOH 
                 W 
                 15 
                 21.110 
                 27.208 
                 16.490 
                 1.00 
                 52.35 
                 O 
               
               
                 ATOM 
                 839 
                 O 
                 HOH 
                 W 
                 16 
                 0.817 
                 32.375 
                 23.701 
                 1.00 
                 50.69 
                 O 
               
               
                 ATOM 
                 840 
                 O 
                 HOH 
                 W 
                 17 
                 0.234 
                 31.767 
                 1.378 
                 1.00 
                 58.08 
                 O 
               
               
                 ATOM 
                 841 
                 O 
                 HOH 
                 W 
                 18 
                 15.129 
                 33.987 
                 33.625 
                 1.00 
                 67.94 
                 O 
               
               
                 ATOM 
                 842 
                 O 
                 HOH 
                 W 
                 19 
                 9.080 
                 35.304 
                 2.554 
                 1.00 
                 48.79 
                 O 
               
               
                 ATOM 
                 843 
                 O 
                 HOH 
                 W 
                 20 
                 15.507 
                 38.561 
                 33.060 
                 1.00 
                 40.13 
                 O 
               
               
                 ATOM 
                 844 
                 O 
                 HOH 
                 W 
                 21 
                 14.043 
                 19.259 
                 27.586 
                 1.00 
                 56.30 
                 O 
               
               
                 ATOM 
                 845 
                 O 
                 HOH 
                 W 
                 22 
                 11.011 
                 38.760 
                 11.090 
                 1.00 
                 52.13 
                 O 
               
               
                 ATOM 
                 846 
                 O 
                 HOH 
                 W 
                 23 
                 19.096 
                 19.513 
                 27.600 
                 1.00 
                 45.11 
                 O 
               
               
                 ATOM 
                 847 
                 O 
                 HOH 
                 W 
                 24 
                 8.529 
                 10.231 
                 23.841 
                 1.00 
                 54.09 
                 O 
               
               
                 ATOM 
                 848 
                 O 
                 HOH 
                 W 
                 25 
                 18.602 
                 28.055 
                 41.400 
                 1.00 
                 44.05 
                 O 
               
               
                 ATOM 
                 849 
                 O 
                 HOH 
                 W 
                 26 
                 −0.858 
                 32.893 
                 −3.524 
                 1.00 
                 48.46 
                 O 
               
               
                 ATOM 
                 850 
                 O 
                 HOH 
                 W 
                 27 
                 6.490 
                 13.377 
                 4.108 
                 1.00 
                 66.62 
                 O 
               
               
                 ATOM 
                 851 
                 O 
                 HOH 
                 W 
                 28 
                 3.930 
                 14.910 
                 13.874 
                 1.00 
                 30.35 
                 O 
               
               
                 ATOM 
                 852 
                 O 
                 HOH 
                 W 
                 29 
                 −8.350 
                 27.041 
                 7.152 
                 1.00 
                 64.13 
                 O 
               
               
                 ATOM 
                 853 
                 O 
                 HOH 
                 W 
                 30 
                 19.016 
                 32.914 
                 41.473 
                 1.00 
                 53.57 
                 O 
               
               
                 ATOM 
                 854 
                 O 
                 HOH 
                 W 
                 31 
                 7.643 
                 36.456 
                 8.441 
                 1.00 
                 49.74 
                 O 
               
               
                 ATOM 
                 855 
                 O 
                 HOH 
                 W 
                 32 
                 0.695 
                 30.653 
                 25.517 
                 1.00 
                 40.63 
                 O 
               
               
                 ATOM 
                 856 
                 O 
                 HOH 
                 W 
                 33 
                 7.361 
                 13.425 
                 13.040 
                 1.00 
                 56.27 
                 O 
               
               
                 ATOM 
                 857 
                 O 
                 HOH 
                 W 
                 34 
                 16.881 
                 31.557 
                 10.306 
                 1.00 
                 60.57 
                 O 
               
               
                 ATOM 
                 858 
                 O 
                 HOH 
                 W 
                 35 
                 8.287 
                 13.597 
                 10.547 
                 1.00 
                 57.02 
                 O 
               
               
                 ATOM 
                 859 
                 O 
                 HOH 
                 W 
                 36 
                 8.039 
                 13.358 
                 19.018 
                 1.00 
                 34.10 
                 O 
               
               
                 ATOM 
                 860 
                 O 
                 HOH 
                 W 
                 37 
                 11.473 
                 14.810 
                 5.085 
                 1.00 
                 72.98 
                 O 
               
               
                 ATOM 
                 861 
                 O 
                 HOH 
                 W 
                 38 
                 18.961 
                 23.256 
                 8.032 
                 1.00 
                 45.71 
                 O 
               
               
                 ATOM 
                 862 
                 O 
                 HOH 
                 W 
                 39 
                 7.350 
                 25.517 
                 37.490 
                 1.00 
                 57.94 
                 O 
               
               
                 ATOM 
                 863 
                 O 
                 HOH 
                 W 
                 40 
                 0.871 
                 15.567 
                 22.621 
                 1.00 
                 36.05 
                 O 
               
               
                 ATOM 
                 864 
                 O 
                 HOH 
                 W 
                 41 
                 9.259 
                 29.560 
                 4.060 
                 1.00 
                 45.31 
                 O 
               
               
                 ATOM 
                 865 
                 O 
                 HOH 
                 W 
                 42 
                 15.495 
                 16.208 
                 13.522 
                 1.00 
                 48.14 
                 O 
               
               
                 ATOM 
                 866 
                 O 
                 HOH 
                 W 
                 43 
                 −6.942 
                 25.812 
                 16.028 
                 1.00 
                 49.25 
                 O 
               
               
                 ATOM 
                 867 
                 O 
                 HOH 
                 W 
                 44 
                 8.961 
                 33.009 
                 1.653 
                 1.00 
                 58.96 
                 O 
               
               
                 ATOM 
                 868 
                 O 
                 HOH 
                 W 
                 45 
                 8.820 
                 29.722 
                 1.693 
                 1.00 
                 55.31 
                 O 
               
               
                 ATOM 
                 869 
                 O 
                 HOH 
                 W 
                 46 
                 0.934 
                 10.101 
                 7.881 
                 1.00 
                 46.26 
                 O 
               
               
                 ATOM 
                 870 
                 O 
                 HOH 
                 W 
                 47 
                 9.394 
                 17.052 
                 17.564 
                 1.00 
                 40.92 
                 O 
               
               
                 ATOM 
                 871 
                 O 
                 HOH 
                 W 
                 48 
                 15.096 
                 33.948 
                 15.334 
                 1.00 
                 51.10 
                 O 
               
               
                 ATOM 
                 872 
                 O 
                 HOH 
                 W 
                 49 
                 2.093 
                 24.026 
                 37.059 
                 1.00 
                 57.99 
                 O 
               
               
                 ATOM 
                 873 
                 O 
                 HOH 
                 W 
                 50 
                 −0.613 
                 16.821 
                 11.553 
                 1.00 
                 40.82 
                 O 
               
               
                 ATOM 
                 874 
                 O 
                 HOH 
                 W 
                 51 
                 2.378 
                 35.855 
                 32.307 
                 1.00 
                 57.82 
                 O 
               
               
                 ATOM 
                 875 
                 O 
                 HOH 
                 W 
                 52 
                 10.646 
                 16.132 
                 25.937 
                 1.00 
                 28.33 
                 O 
               
               
                 ATOM 
                 876 
                 O 
                 HOH 
                 W 
                 53 
                 7.810 
                 15.199 
                 17.107 
                 1.00 
                 35.66 
                 O 
               
               
                 ATOM 
                 877 
                 O 
                 HOH 
                 W 
                 54 
                 7.946 
                 10.228 
                 19.423 
                 1.00 
                 58.71 
                 O 
               
               
                 ATOM 
                 878 
                 O 
                 HOH 
                 W 
                 55 
                 −5.087 
                 21.855 
                 29.858 
                 1.00 
                 52.92 
                 O 
               
               
                 ATOM 
                 879 
                 O 
                 HOH 
                 W 
                 56 
                 −2.460 
                 30.063 
                 −6.344 
                 1.00 
                 63.51 
                 O 
               
               
                 ATOM 
                 880 
                 O 
                 HOH 
                 W 
                 57 
                 −9.940 
                 27.200 
                 4.714 
                 1.00 
                 62.80 
                 O 
               
               
                 ATOM 
                 881 
                 O 
                 HOH 
                 W 
                 58 
                 7.680 
                 43.303 
                 24.786 
                 1.00 
                 54.95 
                 O 
               
               
                 ATOM 
                 882 
                 O 
                 HOH 
                 W 
                 59 
                 18.234 
                 20.029 
                 14.184 
                 1.00 
                 44.17 
                 O 
               
               
                 ATOM 
                 883 
                 O 
                 HOH 
                 W 
                 60 
                 −8.225 
                 25.875 
                 −4.166 
                 1.00 
                 54.98 
                 O 
               
               
                 ATOM 
                 884 
                 O 
                 HOH 
                 W 
                 61 
                 16.874 
                 18.265 
                 12.498 
                 1.00 
                 68.89 
                 O 
               
               
                 ATOM 
                 885 
                 O 
                 HOH 
                 W 
                 62 
                 7.892 
                 14.001 
                 1.905 
                 1.00 
                 65.53 
                 O 
               
               
                 ATOM 
                 886 
                 O 
                 HOH 
                 W 
                 63 
                 −0.782 
                 37.111 
                 37.382 
                 1.00 
                 63.57 
                 O 
               
               
                 ATOM 
                 887 
                 O 
                 HOH 
                 W 
                 64 
                 22.498 
                 23.044 
                 16.311 
                 1.00 
                 36.02 
                 O 
               
               
                 ATOM 
                 888 
                 O 
                 HOH 
                 W 
                 65 
                 12.976 
                 40.341 
                 37.741 
                 1.00 
                 48.78 
                 O 
               
               
                 ATOM 
                 889 
                 O 
                 HOH 
                 W 
                 66 
                 20.503 
                 26.080 
                 31.957 
                 1.00 
                 53.38 
                 O 
               
               
                 ATOM 
                 890 
                 O 
                 HOH 
                 W 
                 67 
                 5.796 
                 9.451 
                 26.499 
                 1.00 
                 70.39 
                 O 
               
               
                 ATOM 
                 891 
                 O 
                 HOH 
                 W 
                 68 
                 −1.275 
                 15.214 
                 −8.910 
                 1.00 
                 52.06 
                 O 
               
               
                 ATOM 
                 892 
                 O 
                 HOH 
                 W 
                 69 
                 14.525 
                 15.403 
                 8.537 
                 1.00 
                 65.82 
                 O 
               
               
                 ATOM 
                 893 
                 O 
                 HOH 
                 W 
                 70 
                 12.969 
                 42.361 
                 34.897 
                 1.00 
                 82.78 
                 O 
               
               
                 ATOM 
                 894 
                 O 
                 HOH 
                 W 
                 71 
                 16.514 
                 20.813 
                 35.521 
                 1.00 
                 77.73 
                 O 
               
               
                 ATOM 
                 895 
                 O 
                 HOH 
                 W 
                 72 
                 9.910 
                 10.781 
                 13.915 
                 1.00 
                 58.26 
                 O 
               
               
                 ATOM 
                 896 
                 O 
                 HOH 
                 W 
                 73 
                 12.437 
                 24.710 
                 1.893 
                 1.00 
                 64.10 
                 O 
               
               
                 ATOM 
                 897 
                 O 
                 HOH 
                 W 
                 74 
                 20.747 
                 31.422 
                 22.103 
                 1.00 
                 41.64 
                 O 
               
               
                 ATOM 
                 898 
                 O 
                 HOH 
                 W 
                 75 
                 15.721 
                 36.144 
                 32.861 
                 1.00 
                 62.03 
                 O 
               
               
                 ATOM 
                 899 
                 O 
                 HOH 
                 W 
                 76 
                 0.635 
                 31.352 
                 13.751 
                 1.00 
                 31.08 
                 O 
               
               
                 ATOM 
                 900 
                 O 
                 HOH 
                 W 
                 77 
                 22.337 
                 23.558 
                 24.955 
                 1.00 
                 40.08 
                 O 
               
               
                 ATOM 
                 901 
                 O 
                 HOH 
                 W 
                 78 
                 7.932 
                 13.265 
                 7.088 
                 1.00 
                 67.66 
                 O 
               
               
                 ATOM 
                 902 
                 O 
                 HOH 
                 W 
                 79 
                 20.517 
                 29.057 
                 29.548 
                 1.00 
                 52.12 
                 O 
               
               
                 ATOM 
                 903 
                 O 
                 HOH 
                 W 
                 80 
                 15.259 
                 17.514 
                 0.795 
                 1.00 
                 60.37 
                 O 
               
               
                 ATOM 
                 904 
                 O 
                 HOH 
                 W 
                 81 
                 −15.805 
                 25.833 
                 10.294 
                 1.00 
                 53.42 
                 O 
               
               
                 ATOM 
                 905 
                 O 
                 HOH 
                 W 
                 82 
                 3.946 
                 10.765 
                 28.247 
                 1.00 
                 71.57 
                 O 
               
               
                 ATOM 
                 906 
                 O 
                 HOH 
                 W 
                 83 
                 −5.175 
                 28.237 
                 13.448 
                 1.00 
                 54.99 
                 O 
               
               
                 ATOM 
                 907 
                 O 
                 HOH 
                 W 
                 84 
                 5.447 
                 39.199 
                 25.619 
                 1.00 
                 52.76 
                 O 
               
               
                 ATOM 
                 908 
                 O 
                 HOH 
                 W 
                 85 
                 16.383 
                 26.315 
                 43.672 
                 1.00 
                 52.39 
                 O 
               
               
                 ATOM 
                 909 
                 O 
                 HOH 
                 W 
                 86 
                 8.064 
                 40.405 
                 25.323 
                 1.00 
                 54.14 
                 O 
               
               
                 ATOM 
                 910 
                 O 
                 HOH 
                 W 
                 87 
                 13.597 
                 39.136 
                 30.408 
                 1.00 
                 59.39 
                 O 
               
               
                 ATOM 
                 911 
                 O 
                 HOH 
                 W 
                 88 
                 7.974 
                 10.662 
                 16.213 
                 1.00 
                 48.90 
                 O 
               
               
                 ATOM 
                 912 
                 O 
                 HOH 
                 W 
                 89 
                 3.093 
                 11.244 
                 9.567 
                 1.00 
                 53.95 
                 O 
               
               
                 ATOM 
                 913 
                 O 
                 HOH 
                 W 
                 90 
                 11.935 
                 23.245 
                 26.965 
                 1.00 
                 25.98 
                 O 
               
               
                 ATOM 
                 914 
                 O 
                 HOH 
                 W 
                 91 
                 15.676 
                 17.694 
                 31.366 
                 1.00 
                 49.77 
                 O 
               
               
                 ATOM 
                 915 
                 O 
                 HOH 
                 W 
                 92 
                 1.434 
                 28.589 
                 −1.853 
                 1.00 
                 61.65 
                 O 
               
               
                 ATOM 
                 916 
                 O 
                 HOH 
                 W 
                 93 
                 −0.967 
                 31.873 
                 18.174 
                 1.00 
                 28.83 
                 O 
               
               
                 ATOM 
                 917 
                 O 
                 HOH 
                 W 
                 94 
                 3.569 
                 19.724 
                 15.627 
                 1.00 
                 69.29 
                 O 
               
               
                 ATOM 
                 918 
                 O 
                 HOH 
                 W 
                 95 
                 16.027 
                 26.116 
                 17.619 
                 1.00 
                 41.37 
                 O 
               
               
                 ATOM 
                 919 
                 O 
                 HOH 
                 W 
                 96 
                 −3.179 
                 23.176 
                 16.288 
                 1.00 
                 35.67 
                 O 
               
               
                 ATOM 
                 920 
                 O 
                 HOH 
                 W 
                 97 
                 11.378 
                 36.643 
                 24.903 
                 1.00 
                 38.26 
                 O 
               
               
                 ATOM 
                 921 
                 O 
                 HOH 
                 W 
                 98 
                 11.275 
                 12.570 
                 12.614 
                 1.00 
                 61.05 
                 O 
               
               
                 ATOM 
                 922 
                 O 
                 HOH 
                 W 
                 99 
                 0.392 
                 37.579 
                 30.346 
                 1.00 
                 63.86 
                 O 
               
               
                 ATOM 
                 923 
                 O 
                 HOH 
                 W 
                 100 
                 3.615 
                 36.054 
                 27.042 
                 1.00 
                 52.83 
                 O 
               
               
                 ATOM 
                 924 
                 O 
                 HOH 
                 W 
                 101 
                 19.917 
                 24.030 
                 23.404 
                 1.00 
                 33.13 
                 O 
               
               
                 ATOM 
                 925 
                 O 
                 HOH 
                 W 
                 102 
                 25.442 
                 22.459 
                 25.169 
                 1.00 
                 52.27 
                 O 
               
               
                 ATOM 
                 926 
                 O 
                 HOH 
                 W 
                 103 
                 13.667 
                 17.731 
                 8.904 
                 1.00 
                 57.13 
                 O 
               
               
                 ATOM 
                 927 
                 O 
                 HOH 
                 W 
                 104 
                 12.838 
                 33.231 
                 16.397 
                 1.00 
                 49.03 
                 O 
               
               
                 ATOM 
                 928 
                 O 
                 HOH 
                 W 
                 105 
                 −4.419 
                 19.850 
                 7.056 
                 1.00 
                 48.59 
                 O 
               
               
                 ATOM 
                 929 
                 O 
                 HOH 
                 W 
                 106 
                 2.163 
                 14.571 
                 24.878 
                 1.00 
                 58.28 
                 O 
               
               
                 ATOM 
                 930 
                 O 
                 HOH 
                 W 
                 107 
                 12.110 
                 41.016 
                 26.077 
                 1.00 
                 43.46 
                 O 
               
               
                 ATOM 
                 931 
                 O 
                 HOH 
                 W 
                 108 
                 −6.767 
                 22.389 
                 4.829 
                 1.00 
                 51.02 
                 O 
               
               
                 ATOM 
                 932 
                 O 
                 HOH 
                 W 
                 109 
                 −9.391 
                 28.696 
                 0.532 
                 1.00 
                 56.17 
                 O 
               
               
                 ATOM 
                 933 
                 O 
                 HOH 
                 W 
                 110 
                 12.664 
                 12.157 
                 15.211 
                 1.00 
                 69.74 
                 O 
               
               
                 ATOM 
                 934 
                 O 
                 HOH 
                 W 
                 111 
                 14.219 
                 30.759 
                 11.453 
                 1.00 
                 54.75 
                 O 
               
               
                 ATOM 
                 935 
                 O 
                 HOH 
                 W 
                 112 
                 22.000 
                 34.294 
                 19.285 
                 1.00 
                 54.23 
                 O 
               
               
                 ATOM 
                 936 
                 O 
                 HOH 
                 W 
                 113 
                 −6.324 
                 17.895 
                 4.472 
                 1.00 
                 42.42 
                 O 
               
               
                 ATOM 
                 937 
                 O 
                 HOH 
                 W 
                 114 
                 26.863 
                 26.038 
                 22.840 
                 1.00 
                 52.75 
                 O 
               
               
                 ATOM 
                 938 
                 O 
                 HOH 
                 W 
                 115 
                 18.802 
                 30.472 
                 41.476 
                 1.00 
                 43.99 
                 O 
               
               
                 ATOM 
                 939 
                 O 
                 HOH 
                 W 
                 116 
                 7.804 
                 8.898 
                 −3.753 
                 1.00 
                 69.67 
                 O 
               
               
                 ATOM 
                 940 
                 O 
                 HOH 
                 W 
                 117 
                 7.387 
                 14.592 
                 −7.052 
                 1.00 
                 46.13 
                 O 
               
               
                 ATOM 
                 941 
                 O 
                 HOH 
                 W 
                 118 
                 −0.533 
                 19.834 
                 −3.700 
                 1.00 
                 61.81 
                 O 
               
               
                 ATOM 
                 942 
                 O 
                 HOH 
                 W 
                 119 
                 6.983 
                 18.009 
                 0.417 
                 1.00 
                 58.96 
                 O 
               
               
                 ATOM 
                 943 
                 O 
                 HOH 
                 W 
                 120 
                 7.436 
                 17.165 
                 3.342 
                 1.00 
                 61.89 
                 O 
               
               
                 ATOM 
                 944 
                 O 
                 HOH 
                 W 
                 121 
                 20.944 
                 31.648 
                 43.363 
                 1.00 
                 53.31 
                 O 
               
               
                 ATOM 
                 945 
                 O 
                 HOH 
                 W 
                 122 
                 21.826 
                 26.911 
                 29.579 
                 1.00 
                 67.75 
                 O 
               
               
                 ATOM 
                 946 
                 O 
                 HOH 
                 W 
                 123 
                 9.097 
                 11.465 
                 3.849 
                 1.00 
                 62.13 
                 O 
               
               
                 ATOM 
                 947 
                 O 
                 HOH 
                 W 
                 124 
                 −1.826 
                 21.461 
                 28.064 
                 1.00 
                 60.67 
                 O 
               
               
                 ATOM 
                 948 
                 O 
                 HOH 
                 W 
                 125 
                 18.975 
                 22.373 
                 10.462 
                 1.00 
                 47.51 
                 O 
               
               
                 ATOM 
                 949 
                 O 
                 HOH 
                 W 
                 126 
                 −10.791 
                 27.326 
                 7.417 
                 1.00 
                 58.06 
                 O 
               
               
                 ATOM 
                 950 
                 O 
                 HOH 
                 W 
                 127 
                 2.269 
                 11.384 
                 25.458 
                 1.00 
                 60.73 
                 O 
               
               
                 ATOM 
                 951 
                 O 
                 HOH 
                 W 
                 128 
                 9.714 
                 36.832 
                 6.517 
                 1.00 
                 60.04 
                 O 
               
               
                 ATOM 
                 952 
                 O 
                 HOH 
                 W 
                 129 
                 17.055 
                 32.219 
                 15.352 
                 1.00 
                 41.93 
                 O 
               
               
                 ATOM 
                 953 
                 O 
                 HOH 
                 W 
                 130 
                 1.590 
                 20.061 
                 27.434 
                 1.00 
                 37.17 
                 O 
               
               
                 ATOM 
                 954 
                 O 
                 HOH 
                 W 
                 131 
                 13.830 
                 21.020 
                 33.287 
                 1.00 
                 50.68 
                 O 
               
               
                 ATOM 
                 955 
                 O 
                 HOH 
                 W 
                 132 
                 −6.693 
                 16.372 
                 13.047 
                 1.00 
                 45.15 
                 O 
               
               
                 ATOM 
                 956 
                 O 
                 HOH 
                 W 
                 133 
                 8.383 
                 36.910 
                 33.042 
                 1.00 
                 65.33 
                 O 
               
               
                 ATOM 
                 957 
                 O 
                 HOH 
                 W 
                 134 
                 11.374 
                 41.068 
                 32.503 
                 1.00 
                 54.93 
                 O 
               
               
                 ATOM 
                 958 
                 O 
                 HOH 
                 W 
                 135 
                 6.316 
                 40.823 
                 31.658 
                 1.00 
                 68.39 
                 O 
               
               
                 ATOM 
                 959 
                 O 
                 HOH 
                 W 
                 136 
                 12.324 
                 14.149 
                 2.727 
                 1.00 
                 67.01 
                 O 
               
               
                 ATOM 
                 960 
                 O 
                 HOH 
                 W 
                 137 
                 −5.787 
                 27.138 
                 −4.125 
                 1.00 
                 65.52 
                 O 
               
               
                 ATOM 
                 961 
                 O 
                 HOH 
                 W 
                 138 
                 −9.802 
                 27.322 
                 11.236 
                 1.00 
                 60.08 
                 O 
               
               
                 ATOM 
                 962 
                 O 
                 HOH 
                 W 
                 139 
                 −3.759 
                 28.863 
                 −4.521 
                 1.00 
                 62.40 
                 O 
               
               
                 ATOM 
                 963 
                 O 
                 HOH 
                 W 
                 140 
                 −2.672 
                 19.413 
                 11.260 
                 1.00 
                 45.75 
                 O 
               
               
                   
               
            
           
         
       
     
     
       
         
           
               
               
               
             
               
                 APPENDIX I(d) 
               
               
                   
               
             
            
               
                 HEADER 
                   
                  1A-7 
               
               
                 COMPND 
                   
                  1A-7 
               
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  REFINEMENT. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  PROGRAM 
                 : REFMAC 5.2.0011 
               
               
                 REMARK 
                 3 
                  AUTHORS 
                 : MURSHUDOV,VAGIN,DODSON 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 REFINEMENT TARGET : MAXIMUM LIKELIHOOD 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  RESOLUTION RANGE HIGH 
                 (ANGSTROMS) 
                 : 
                  2.71 
               
               
                 REMARK 
                 3 
                  RESOLUTION RANGE LOW 
                 (ANGSTROMS) 
                 : 
                  21.57 
               
               
                 REMARK 
                 3 
                  DATA CUTOFF 
                  (SIGMA(F)) 
                 : 
                 NONE 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPLETENESS FOR RANGE 
                 (%) 
                 : 
                  95.14 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF REFLECTIONS 
                 : 
                   18372 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 FIT TO DATA USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  CROSS-VALIDATION METHOD 
                 : 
                 THROUGHOUT 
               
               
                 REMARK 
                 3 
                  FREE R VALUE TEST SET SELECTION 
                 : 
                 RANDOM 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  R VALUE 
                 (WORKING + TEST SET) 
                 : 
                 0.18041 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  R VALUE 
                 (WORKING SET) 
                 : 
                  0.17586 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  FREE R VALUE 
                 : 
                  0.26495 
               
               
                 REMARK 
                 3 
                  FREE R VALUE TEST SET SIZE (%) 
                 : 
                  5.1 
               
               
                 REMARK 
                 3 
                  FREE R VALUE TEST SET COUNT 
                 : 
                  982 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  FIT IN THE HIGHEST RESOLUTION BIN. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  TOTAL NUMBER OF BINS USED 
                 : 
                  20 
               
               
                 REMARK 
                 3 
                  BIN RESOLUTION RANGE HIGH 
                 : 
                 2.709 
               
               
                 REMARK 
                 3 
                  BIN RESOLUTION RANGE LOW 
                 : 
                 2.778 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  REFLECTION IN BIN 
                 (WORKING SET) 
                 : 
                  1089 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BIN COMPLETENESS (WORKING+TEST) (%) 
                 : 
                 78.87 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BIN R VALUE 
                 (WORKING SET) 
                 : 
                 0.327 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BIN FREE R VALUE SET COUNT 
                 : 
                   46 
               
               
                 REMARK 
                 3 
                  BIN FREE R VALUE 
                 : 
                 0.328 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ALL ATOMS 
                 : 
                 3765 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 B VALUES. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  FROM WILSON PLOT 
                 (A**2) 
                 : NULL 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  MEAN B VALUE 
                 (OVERALL, A**2) 
                 : 43.346 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  OVERALL ANISOTROPIC B VALUE. 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 B11 (A**2) : 
                  4.16 
               
               
                 REMARK 
                 3 
                 B22 (A**2) : 
                 −2.46 
               
               
                 REMARK 
                 3 
                 B33 (A**2) : 
                 −1.70 
               
               
                 REMARK 
                 3 
                 B12 (A**2) : 
                  0.00 
               
               
                 REMARK 
                 3 
                 B13 (A**2) : 
                  0.00 
               
               
                 REMARK 
                 3 
                 B23 (A**2) : 
                  0.00 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 ESTIMATED OVERALL COORDINATE ERROR. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ESU BASED ON R VALUE 
                    (A): 
                  0.525 
               
               
                 REMARK 
                 3 
                  ESU BASED ON FREE R VALUE 
                    (A): 
                  0.336 
               
               
                 REMARK 
                 3 
                  ESU BASED ON MAXIMUM LIKELIHOOD 
                    (A): 
                  0.258 
               
               
                 REMARK 
                 3 
                  ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD 
                 (A**2): 
                 22.695 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  CORRELATION COEFFICIENTS. 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  CORRELATION COEFFICIENT FO-FC 
                 : 
                 0.950 
               
               
                 REMARK 
                 3 
                  CORRELATION COEFFICIENT FO-FC FREE 
                 : 
                 0.878 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 RMS DEVIATIONS FROM IDEAL VALUES 
                 COUNT 
                 RMS 
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  BOND LENGTHS REFINED ATOMS 
                 (A): 
                 3328 ; 
                  0.012 ; 
                  0.022 
               
               
                 REMARK 
                 3 
                  BOND ANGLES REFINED ATOMS 
                 (DEGREES): 
                 4492 ; 
                  1.453 ; 
                  1.954 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 1 
                 (DEGREES): 
                  418 ; 
                  6.864 ; 
                  5.000 
               
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 2 
                 (DEGREES): 
                  144 ; 
                 32.750 ; 
                 23.611 
               
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 3 
                 (DEGREES): 
                  586 ; 
                 20.512 ; 
                 15.000 
               
               
                 REMARK 
                 3 
                 TORSION ANGLES, PERIOD 4 
                 (DEGREES): 
                  28 ; 
                 20.012 ; 
                 15.000 
               
               
                 REMARK 
                 3 
                 CHIRAL-CENTER RESTRAINTS 
                 (A**3): 
                  506 ; 
                  0.102 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 GENERAL PLANES REFINED ATOMS 
                 (A): 
                 2460 ; 
                  0.004 ; 
                  0.020 
               
               
                 REMARK 
                 3 
                 NON-BONDED CONTACTS REFINED ATOMS 
                 (A): 
                 1638 ; 
                  0.235 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 NON-BONDED TORSION REFINED ATOMS 
                 (A): 
                 2185 ; 
                  0.308 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 H-BOND (X...Y) REFINED ATOMS 
                 (A): 
                  309 ; 
                  0.191 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 SYMMETRY VDW REFINED ATOMS 
                 (A): 
                  72 ; 
                  0.270 ; 
                  0.200 
               
               
                 REMARK 
                 3 
                 SYMMETRY H-BOND REFINED ATOMS 
                 (A): 
                  30 ; 
                  0.292 ; 
                  0.200 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ISOTROPIC THERMAL FACTOR RESTRAINTS. 
                 COUNT 
                 RMS 
                 WEIGHT 
               
            
           
           
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 MAIN-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                 2116 ; 
                  0.565 ; 
                  1.500 
               
               
                 REMARK 
                 3 
                 MAIN-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                 3350 ; 
                  1.077 ; 
                  2.000 
               
               
                 REMARK 
                 3 
                 SIDE-CHAIN BOND REFINED ATOMS 
                 (A**2): 
                 1368 ; 
                  1.619 ; 
                  3.000 
               
               
                 REMARK 
                 3 
                 SIDE-CHAIN ANGLE REFINED ATOMS 
                 (A**2): 
                 1142 ; 
                  2.840 ; 
                  4.500 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  NCS RESTRAINTS STATISTICS 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 NUMBER OF NCS GROUPS : NULL 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  TLS DETAILS 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 NUMBER OF TLS GROUPS : 
                 4 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 ATOM RECORD CONTAINS RESIDUAL B FACTORS ONLY 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 TLS GROUP : 
                 1 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF COMPONENTS GROUP : 
                 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                 3 
                  RESIDUE RANGE : 
                 A 
                  1 
                   
                 A 
                  111 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ORIGIN FOR THE GROUP (A): 
                 42.6420 
                 2.7110 
                 11.2850 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  T11: 
                 −0.0556 
                 T22: 
                 −0.1040 
               
               
                 REMARK 
                 3 
                  T33: 
                 −0.1287 
                 T12: 
                 −0.0331 
               
               
                 REMARK 
                 3 
                  T13: 
                  0.0426 
                 T23: 
                 −0.0163 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  L11: 
                  6.4349 
                 L22: 
                  8.9791 
               
               
                 REMARK 
                 3 
                  L33: 
                  4.6108 
                 L12: 
                 −2.9273 
               
               
                 REMARK 
                 3 
                  L13: 
                 −0.1563 
                 L23: 
                 −1.8520 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  S11: 
                 −0.2306 
                 S12: 
                 −0.0310 
                 S13: 
                 −0.3199 
               
               
                 REMARK 
                 3 
                  S21: 
                  0.4291 
                 S22: 
                  0.2316 
                 S23: 
                  0.0525 
               
               
                 REMARK 
                 3 
                  S31: 
                  0.4464 
                 S32: 
                  0.0357 
                 S33: 
                 −0.0010 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 TLS GROUP : 
                 2 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF COMPONENTS GROUP : 
                 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                 3 
                  RESIDUE RANGE : 
                 B 
                  1 
                   
                 B 
                  111 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ORIGIN FOR THE GROUP (A): 
                 57.2880 
                 23.2710 
                 9.5550 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  T11: 
                 −0.1637 
                 T22: 
                 −0.0898 
               
               
                 REMARK 
                 3 
                  T33: 
                 −0.0233 
                 T12: 
                  0.0302 
               
               
                 REMARK 
                 3 
                  T13: 
                 −0.0125 
                 T23: 
                 −0.0400 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  L11: 
                  2.6012 
                 L22: 
                  6.9682 
               
               
                 REMARK 
                 3 
                  L33: 
                  3.5725 
                 L12: 
                  2.9543 
               
               
                 REMARK 
                 3 
                  L13: 
                 −1.1259 
                 L23: 
                 −1.8219 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  S11: 
                  0.1344 
                 S12: 
                 −0.0679 
                 S13: 
                 −0.0673 
               
               
                 REMARK 
                 3 
                  S21: 
                  0.3029 
                 S22: 
                  0.0152 
                 S23: 
                 −0.1821 
               
               
                 REMARK 
                 3 
                  S31: 
                  0.2191 
                 S32: 
                 −0.1304 
                 S33: 
                 −0.1496 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 TLS GROUP : 
                 3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF COMPONENTS GROUP : 
                 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSSEQI 
               
               
                 REMARK 
                 3 
                  RESIDUE RANGE : 
                 C 
                  1 
                   
                 C 
                  111 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ORIGIN FOR THE GROUP (A): 
                 25.8060 
                 22.8210 
                 23.0520 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  T11: 
                 −0.2263 
                 T22: 
                 −0.1090 
               
               
                 REMARK 
                 3 
                  T33: 
                 −0.0650 
                 T12: 
                  0.0097 
               
               
                 REMARK 
                 3 
                  T13: 
                 −0.0073 
                 T23: 
                  0.0251 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  L11: 
                  3.4989 
                 L22: 
                  7.7019 
               
               
                 REMARK 
                 3 
                  L33: 
                  6.6253 
                 L12: 
                  0.2165 
               
               
                 REMARK 
                 3 
                  L13: 
                 −0.5468 
                 L23: 
                  2.4276 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  S11: 
                 −0.0280 
                 S12: 
                 −0.0752 
                 S13: 
                  0.2877 
               
               
                 REMARK 
                 3 
                  S21: 
                  0.1903 
                 S22: 
                  0.2318 
                 S23: 
                 −0.2761 
               
               
                 REMARK 
                 3 
                  S31: 
                 −0.2228 
                 S32: 
                  0.2336 
                 S33: 
                 −0.2038 
               
            
           
           
               
               
            
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                 TLS GROUP : 
                 4 
               
            
           
           
               
               
               
               
            
               
                 REMARK 
                 3 
                  NUMBER OF COMPONENTS GROUP : 
                 1 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  COMPONENTS 
                 C 
                 SSSEQI 
                 TO 
                 C 
                 SSEQI 
               
               
                 REMARK 
                 3 
                  RESIDUE RANGE : 
                 D 
                  1 
                   
                 D 
                  111 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  ORIGIN FOR THE GROUP (A): 
                 19.7280 
                 2.5210 
                 36.8750 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  T TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  T11: 
                 −0.1365 
                 T22: 
                 −0.0747 
               
               
                 REMARK 
                 3 
                  T33: 
                 −0.1289 
                 T12: 
                  0.0351 
               
               
                 REMARK 
                 3 
                  T13: 
                  0.0176 
                 T23: 
                  0.0351 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  L TENSOR 
               
            
           
           
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  L11: 
                  3.3426 
                 L22: 
                  9.8078 
               
               
                 REMARK 
                 3 
                  L33: 
                  4.5159 
                 L12: 
                  0.8691 
               
               
                 REMARK 
                 3 
                  L13: 
                 −0.2683 
                 L23: 
                 −2.7373 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                  S TENSOR 
               
            
           
           
               
               
               
               
               
               
               
               
            
               
                 REMARK 
                 3 
                  S11: 
                 −0.1963 
                 S12: 
                  0.1431 
                 S13: 
                 −0.0334 
               
               
                 REMARK 
                 3 
                  S21: 
                  0.2425 
                 S22: 
                  0.2293 
                 S23: 
                 −0.2122 
               
               
                 REMARK 
                 3 
                  S31: 
                 −0.1809 
                 S32: 
                 −0.0589 
                 S33: 
                 −0.0330 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  BULK SOLVENT MODELLING. 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                 METHOD USED : BABINET MODEL WITH MASK 
               
               
                 REMARK 
                 3 
                 PARAMETERS FOR MASK CALCULATION 
               
            
           
           
               
               
               
               
               
            
               
                 REMARK 
                 3 
                 VDW PROBE RADIUS 
                 : 
                 1.20 
               
               
                 REMARK 
                 3 
                 ION PROBE RADIUS 
                 : 
                 0.80 
               
               
                 REMARK 
                 3 
                 SHRINKAGE RADIUS 
                 : 
                 0.80 
               
            
           
           
               
               
               
            
               
                 REMARK 
                 3 
                   
               
               
                 REMARK 
                 3 
                  OTHER REFINEMENT REMARKS: 
               
               
                 REMARK 
                 3 
                  HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS 
               
               
                 REMARK 
                 3 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 SSBOND 
                 1 
                 CYS 
                 A 
                 22 
                 CYS 
                 A 
                 83 
                   
               
               
                 SSBOND 
                 2 
                 CYS 
                 B 
                 22 
                 CYS 
                 B 
                 83 
                   
               
               
                 SSBOND 
                 3 
                 CYS 
                 C 
                 22 
                 CYS 
                 C 
                 83 
                   
               
               
                 SSBOND 
                 4 
                 CYS 
                 D 
                 22 
                 CYS 
                 D 
                 83 
                   
               
               
                 CISPEP 
                 1 
                 THR 
                 A 
                  6 
                 PRO 
                 A 
                  7 
                 0.00 
               
               
                 CISPEP 
                 2 
                 THR 
                 B 
                  6 
                 PRO 
                 B 
                  7 
                 0.00 
               
            
           
           
               
               
               
               
            
               
                 LINK 
                 SER B 88 
                 PRO B 99 
                 gap 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 CISPEP 
                 3 
                 THR 
                 C 
                  6 
                 PRO 
                 C 
                  7 
                 0.00 
               
               
                 CISPEP 
                 4 
                 THR 
                 D 
                  6 
                 PRO 
                 D 
                  7 
                 0.00 
               
            
           
           
               
               
               
               
            
               
                 LINK 
                 SER D 88 
                 PRO D 99 
                 gap 
               
            
           
           
               
               
               
               
               
               
               
               
               
            
               
                 CRYST1 
                 80.498 
                 88.661 
                 101.754 
                 90.00 
                 90.00 
                 90.00 
                 P 21 
                 21 21 
               
            
           
           
               
               
               
               
               
            
               
                 SCALE1 
                  0.012423 
                 0.000000 
                 0.000000 
                 0.00000 
               
               
                 SCALE2 
                  0.000000 
                 0.011279 
                 0.000000 
                 0.00000 
               
               
                 SCALE3 
                  0.000000 
                 0.000000 
                 0.009828 
                 0.00000 
               
            
           
           
               
               
               
               
               
               
               
               
               
               
               
               
            
               
                 ATOM 
                 1 
                 N 
                 ALA 
                 A 
                 1 
                 30.011 
                 14.284 
                 9.406 
                 1.00 
                 34.46 
                 N 
               
               
                 ATOM 
                 2 
                 CA 
                 ALA 
                 A 
                 1 
                 31.036 
                 13.509 
                 8.624 
                 1.00 
                 35.28 
                 C 
               
               
                 ATOM 
                 3 
                 CB 
                 ALA 
                 A 
                 1 
                 32.437 
                 14.034 
                 8.888 
                 1.00 
                 34.84 
                 C 
               
               
                 ATOM 
                 4 
                 C 
                 ALA 
                 A 
                 1 
                 30.972 
                 11.997 
                 8.877 
                 1.00 
                 35.65 
                 C 
               
               
                 ATOM 
                 5 
                 O 
                 ALA 
                 A 
                 1 
                 30.119 
                 11.520 
                 9.642 
                 1.00 
                 35.76 
                 O 
               
               
                 ATOM 
                 6 
                 N 
                 TRP 
                 A 
                 2 
                 31.857 
                 11.254 
                 8.206 
                 1.00 
                 35.69 
                 N 
               
               
                 ATOM 
                 7 
                 CA 
                 TRP 
                 A 
                 2 
                 31.947 
                 9.799 
                 8.343 
                 1.00 
                 36.00 
                 C 
               
               
                 ATOM 
                 8 
                 CB 
                 TRP 
                 A 
                 2 
                 30.700 
                 9.112 
                 7.776 
                 1.00 
                 35.89 
                 C 
               
               
                 ATOM 
                 9 
                 CG 
                 TRP 
                 A 
                 2 
                 30.730 
                 8.902 
                 6.299 
                 1.00 
                 35.28 
                 C 
               
               
                 ATOM 
                 10 
                 CD1 
                 TRP 
                 A 
                 2 
                 31.303 
                 7.856 
                 5.637 
                 1.00 
                 35.33 
                 C 
               
               
                 ATOM 
                 11 
                 NE1 
                 TRP 
                 A 
                 2 
                 31.147 
                 8.010 
                 4.281 
                 1.00 
                 35.24 
                 N 
               
               
                 ATOM 
                 12 
                 CE2 
                 TRP 
                 A 
                 2 
                 30.442 
                 9.158 
                 4.042 
                 1.00 
                 34.88 
                 C 
               
               
                 ATOM 
                 13 
                 CD2 
                 TRP 
                 A 
                 2 
                 30.168 
                 9.753 
                 5.293 
                 1.00 
                 34.55 
                 C 
               
               
                 ATOM 
                 14 
                 CE3 
                 TRP 
                 A 
                 2 
                 29.451 
                 10.952 
                 5.327 
                 1.00 
                 34.74 
                 C 
               
               
                 ATOM 
                 15 
                 CZ3 
                 TRP 
                 A 
                 2 
                 29.043 
                 11.525 
                 4.115 
                 1.00 
                 36.01 
                 C 
               
               
                 ATOM 
                 16 
                 CH2 
                 TRP 
                 A 
                 2 
                 29.341 
                 10.911 
                 2.884 
                 1.00 
                 35.59 
                 C 
               
               
                 ATOM 
                 17 
                 CZ2 
                 TRP 
                 A 
                 2 
                 30.026 
                 9.724 
                 2.830 
                 1.00 
                 35.60 
                 C 
               
               
                 ATOM 
                 18 
                 C 
                 TRP 
                 A 
                 2 
                 33.206 
                 9.286 
                 7.641 
                 1.00 
                 36.83 
                 C 
               
               
                 ATOM 
                 19 
                 O 
                 TRP 
                 A 
                 2 
                 33.787 
                 9.979 
                 6.789 
                 1.00 
                 37.05 
                 O 
               
               
                 ATOM 
                 20 
                 N 
                 VAL 
                 A 
                 3 
                 33.620 
                 8.068 
                 7.986 
                 1.00 
                 37.68 
                 N 
               
               
                 ATOM 
                 21 
                 CA 
                 VAL 
                 A 
                 3 
                 34.802 
                 7.463 
                 7.390 
                 1.00 
                 38.15 
                 C 
               
               
                 ATOM 
                 22 
                 CB 
                 VAL 
                 A 
                 3 
                 35.768 
                 7.048 
                 8.463 
                 1.00 
                 37.97 
                 C 
               
               
                 ATOM 
                 23 
                 CG1 
                 VAL 
                 A 
                 3 
                 36.981 
                 6.394 
                 7.857 
                 1.00 
                 38.96 
                 C 
               
               
                 ATOM 
                 24 
                 CG2 
                 VAL 
                 A 
                 3 
                 36.190 
                 8.253 
                 9.265 
                 1.00 
                 37.45 
                 C 
               
               
                 ATOM 
                 25 
                 C 
                 VAL 
                 A 
                 3 
                 34.433 
                 6.260 
                 6.529 
                 1.00 
                 39.32 
                 C 
               
               
                 ATOM 
                 26 
                 O 
                 VAL 
                 A 
                 3 
                 33.522 
                 5.496 
                 6.865 
                 1.00 
                 39.40 
                 O 
               
               
                 ATOM 
                 27 
                 N 
                 ASP 
                 A 
                 4 
                 35.127 
                 6.129 
                 5.398 
                 1.00 
                 40.83 
                 N 
               
               
                 ATOM 
                 28 
                 CA 
                 ASP 
                 A 
                 4 
                 35.007 
                 4.981 
                 4.485 
                 1.00 
                 42.50 
                 C 
               
               
                 ATOM 
                 29 
                 CB 
                 ASP 
                 A 
                 4 
                 35.128 
                 5.449 
                 3.040 
                 1.00 
                 42.10 
                 C 
               
               
                 ATOM 
                 30 
                 CG 
                 ASP 
                 A 
                 4 
                 33.831 
                 5.916 
                 2.470 
                 1.00 
                 44.06 
                 C 
               
               
                 ATOM 
                 31 
                 OD1 
                 ASP 
                 A 
                 4 
                 33.877 
                 6.414 
                 1.321 
                 1.00 
                 46.56 
                 O 
               
               
                 ATOM 
                 32 
                 OD2 
                 ASP 
                 A 
                 4 
                 32.771 
                 5.783 
                 3.148 
                 1.00 
                 45.25 
                 O 
               
               
                 ATOM 
                 33 
                 C 
                 ASP 
                 A 
                 4 
                 36.143 
                 3.997 
                 4.705 
                 1.00 
                 43.53 
                 C 
               
               
                 ATOM 
                 34 
                 O 
                 ASP 
                 A 
                 4 
                 37.294 
                 4.316 
                 4.382 
                 1.00 
                 44.43 
                 O 
               
               
                 ATOM 
                 35 
                 N 
                 GLN 
                 A 
                 5 
                 35.864 
                 2.805 
                 5.217 
                 1.00 
                 44.07 
                 N 
               
               
                 ATOM 
                 36 
                 CA 
                 GLN 
                 A 
                 5 
                 36.966 
                 1.882 
                 5.436 
                 1.00 
                 44.76 
                 C 
               
               
                 ATOM 
                 37 
                 CB 
                 GLN 
                 A 
                 5 
                 36.924 
                 1.313 
                 6.842 
                 1.00 
                 45.18 
                 C 
               
               
                 ATOM 
                 38 
                 CG 
                 GLN 
                 A 
                 5 
                 38.195 
                 0.608 
                 7.266 
                 1.00 
                 47.01 
                 C 
               
               
                 ATOM 
                 39 
                 CD 
                 GLN 
                 A 
                 5 
                 38.183 
                 0.219 
                 8.737 
                 1.00 
                 49.42 
                 C 
               
               
                 ATOM 
                 40 
                 OE1 
                 GLN 
                 A 
                 5 
                 37.411 
                 0.760 
                 9.527 
                 1.00 
                 49.45 
                 O 
               
               
                 ATOM 
                 41 
                 NE2 
                 GLN 
                 A 
                 5 
                 39.043 
                 −0.724 
                 9.108 
                 1.00 
                 50.74 
                 N 
               
               
                 ATOM 
                 42 
                 C 
                 GLN 
                 A 
                 5 
                 36.945 
                 0.779 
                 4.411 
                 1.00 
                 44.79 
                 C 
               
               
                 ATOM 
                 43 
                 O 
                 GLN 
                 A 
                 5 
                 35.876 
                 0.276 
                 4.067 
                 1.00 
                 45.27 
                 O 
               
               
                 ATOM 
                 44 
                 N 
                 THR 
                 A 
                 6 
                 38.129 
                 0.398 
                 3.937 
                 1.00 
                 44.76 
                 N 
               
               
                 ATOM 
                 45 
                 CA 
                 THR 
                 A 
                 6 
                 38.278 
                 −0.648 
                 2.915 
                 1.00 
                 44.58 
                 C 
               
               
                 ATOM 
                 46 
                 CB 
                 THR 
                 A 
                 6 
                 38.436 
                 0.011 
                 1.541 
                 1.00 
                 44.58 
                 C 
               
               
                 ATOM 
                 47 
                 OG1 
                 THR 
                 A 
                 6 
                 37.159 
                 0.471 
                 1.104 
                 1.00 
                 44.70 
                 O 
               
               
                 ATOM 
                 48 
                 CG2 
                 THR 
                 A 
                 6 
                 38.953 
                 −0.954 
                 0.529 
                 1.00 
                 45.30 
                 C 
               
               
                 ATOM 
                 49 
                 C 
                 THR 
                 A 
                 6 
                 39.488 
                 −1.551 
                 3.205 
                 1.00 
                 44.30 
                 C 
               
               
                 ATOM 
                 50 
                 O 
                 THR 
                 A 
                 6 
                 40.572 
                 −1.043 
                 3.535 
                 1.00 
                 44.75 
                 O 
               
               
                 ATOM 
                 51 
                 N 
                 PRO 
                 A 
                 7 
                 39.318 
                 −2.886 
                 3.115 
                 1.00 
                 43.66 
                 N 
               
               
                 ATOM 
                 52 
                 CA 
                 PRO 
                 A 
                 7 
                 38.111 
                 −3.683 
                 2.896 
                 1.00 
                 43.45 
                 C 
               
               
                 ATOM 
                 53 
                 CB 
                 PRO 
                 A 
                 7 
                 38.670 
                 −5.030 
                 2.455 
                 1.00 
                 43.29 
                 C 
               
               
                 ATOM 
                 54 
                 CG 
                 PRO 
                 A 
                 7 
                 39.953 
                 −5.128 
                 3.166 
                 1.00 
                 43.32 
                 C 
               
               
                 ATOM 
                 55 
                 CD 
                 PRO 
                 A 
                 7 
                 40.513 
                 −3.742 
                 3.203 
                 1.00 
                 43.44 
                 C 
               
               
                 ATOM 
                 56 
                 C 
                 PRO 
                 A 
                 7 
                 37.274 
                 −3.903 
                 4.145 
                 1.00 
                 43.07 
                 C 
               
               
                 ATOM 
                 57 
                 O 
                 PRO 
                 A 
                 7 
                 37.737 
                 −3.660 
                 5.254 
                 1.00 
                 42.77 
                 O 
               
               
                 ATOM 
                 58 
                 N 
                 ARG 
                 A 
                 8 
                 36.059 
                 −4.400 
                 3.948 
                 1.00 
                 42.89 
                 N 
               
               
                 ATOM 
                 59 
                 CA 
                 ARG 
                 A 
                 8 
                 35.144 
                 −4.642 
                 5.056 
                 1.00 
                 42.68 
                 C 
               
               
                 ATOM 
                 60 
                 CB 
                 ARG 
                 A 
                 8 
                 33.701 
                 −4.386 
                 4.626 
                 1.00 
                 42.94 
                 C 
               
               
                 ATOM 
                 61 
                 CG 
                 ARG 
                 A 
                 8 
                 33.474 
                 −2.897 
                 4.307 
                 1.00 
                 44.84 
                 C 
               
               
                 ATOM 
                 62 
                 CD 
                 ARG 
                 A 
                 8 
                 33.522 
                 −2.011 
                 5.573 
                 1.00 
                 46.18 
                 C 
               
               
                 ATOM 
                 63 
                 NE 
                 ARG 
                 A 
                 8 
                 32.191 
                 −1.984 
                 6.180 
                 1.00 
                 49.33 
                 N 
               
               
                 ATOM 
                 64 
                 CZ 
                 ARG 
                 A 
                 8 
                 31.770 
                 −2.747 
                 7.193 
                 1.00 
                 49.53 
                 C 
               
               
                 ATOM 
                 65 
                 NH1 
                 ARG 
                 A 
                 8 
                 32.579 
                 −3.612 
                 7.796 
                 1.00 
                 50.15 
                 N 
               
               
                 ATOM 
                 66 
                 NH2 
                 ARG 
                 A 
                 8 
                 30.520 
                 −2.623 
                 7.616 
                 1.00 
                 49.55 
                 N 
               
               
                 ATOM 
                 67 
                 C 
                 ARG 
                 A 
                 8 
                 35.336 
                 −6.007 
                 5.690 
                 1.00 
                 42.02 
                 C 
               
               
                 ATOM 
                 68 
                 O 
                 ARG 
                 A 
                 8 
                 35.204 
                 −6.143 
                 6.907 
                 1.00 
                 41.82 
                 O 
               
               
                 ATOM 
                 69 
                 N 
                 SER 
                 A 
                 9 
                 35.653 
                 −7.007 
                 4.869 
                 1.00 
                 41.36 
                 N 
               
               
                 ATOM 
                 70 
                 CA 
                 SER 
                 A 
                 9 
                 36.221 
                 −8.258 
                 5.372 
                 1.00 
                 40.81 
                 C 
               
               
                 ATOM 
                 71 
                 CB 
                 SER 
                 A 
                 9 
                 35.140 
                 −9.293 
                 5.702 
                 1.00 
                 40.66 
                 C 
               
               
                 ATOM 
                 72 
                 OG 
                 SER 
                 A 
                 9 
                 34.610 
                 −9.877 
                 4.533 
                 1.00 
                 41.34 
                 O 
               
               
                 ATOM 
                 73 
                 C 
                 SER 
                 A 
                 9 
                 37.244 
                 −8.811 
                 4.386 
                 1.00 
                 40.42 
                 C 
               
               
                 ATOM 
                 74 
                 O 
                 SER 
                 A 
                 9 
                 37.171 
                 −8.528 
                 3.186 
                 1.00 
                 40.20 
                 O 
               
               
                 ATOM 
                 75 
                 N 
                 VAL 
                 A 
                 10 
                 38.196 
                 −9.593 
                 4.897 
                 1.00 
                 39.89 
                 N 
               
               
                 ATOM 
                 76 
                 CA 
                 VAL 
                 A 
                 10 
                 39.313 
                 −10.077 
                 4.095 
                 1.00 
                 39.33 
                 C 
               
               
                 ATOM 
                 77 
                 CB 
                 VAL 
                 A 
                 10 
                 40.314 
                 −8.932 
                 3.746 
                 1.00 
                 39.54 
                 C 
               
               
                 ATOM 
                 78 
                 CG1 
                 VAL 
                 A 
                 10 
                 41.033 
                 −8.411 
                 4.992 
                 1.00 
                 39.50 
                 C 
               
               
                 ATOM 
                 79 
                 CG2 
                 VAL 
                 A 
                 10 
                 41.309 
                 −9.365 
                 2.663 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 80 
                 C 
                 VAL 
                 A 
                 10 
                 40.054 
                 −11.205 
                 4.782 
                 1.00 
                 39.05 
                 C 
               
               
                 ATOM 
                 81 
                 O 
                 VAL 
                 A 
                 10 
                 40.350 
                 −11.144 
                 5.977 
                 1.00 
                 38.79 
                 O 
               
               
                 ATOM 
                 82 
                 N 
                 THR 
                 A 
                 11 
                 40.337 
                 −12.241 
                 3.999 
                 1.00 
                 38.97 
                 N 
               
               
                 ATOM 
                 83 
                 CA 
                 THR 
                 A 
                 11 
                 41.137 
                 −13.381 
                 4.431 
                 1.00 
                 38.52 
                 C 
               
               
                 ATOM 
                 84 
                 CB 
                 THR 
                 A 
                 11 
                 40.544 
                 −14.672 
                 3.897 
                 1.00 
                 38.36 
                 C 
               
               
                 ATOM 
                 85 
                 OG1 
                 THR 
                 A 
                 11 
                 39.128 
                 −14.618 
                 4.075 
                 1.00 
                 38.78 
                 O 
               
               
                 ATOM 
                 86 
                 CG2 
                 THR 
                 A 
                 11 
                 41.095 
                 −15.879 
                 4.643 
                 1.00 
                 38.38 
                 C 
               
               
                 ATOM 
                 87 
                 C 
                 THR 
                 A 
                 11 
                 42.542 
                 −13.197 
                 3.890 
                 1.00 
                 38.21 
                 C 
               
               
                 ATOM 
                 88 
                 O 
                 THR 
                 A 
                 11 
                 42.723 
                 −12.656 
                 2.802 
                 1.00 
                 38.36 
                 O 
               
               
                 ATOM 
                 89 
                 N 
                 LYS 
                 A 
                 12 
                 43.539 
                 −13.631 
                 4.650 
                 1.00 
                 37.69 
                 N 
               
               
                 ATOM 
                 90 
                 CA 
                 LYS 
                 A 
                 12 
                 44.915 
                 −13.447 
                 4.235 
                 1.00 
                 37.08 
                 C 
               
               
                 ATOM 
                 91 
                 CB 
                 LYS 
                 A 
                 12 
                 45.442 
                 −12.123 
                 4.774 
                 1.00 
                 36.91 
                 C 
               
               
                 ATOM 
                 92 
                 CG 
                 LYS 
                 A 
                 12 
                 46.038 
                 −11.223 
                 3.713 
                 1.00 
                 37.12 
                 C 
               
               
                 ATOM 
                 93 
                 CD 
                 LYS 
                 A 
                 12 
                 44.965 
                 −10.364 
                 3.059 
                 1.00 
                 37.36 
                 C 
               
               
                 ATOM 
                 94 
                 CE 
                 LYS 
                 A 
                 12 
                 45.533 
                 −9.095 
                 2.396 
                 1.00 
                 37.20 
                 C 
               
               
                 ATOM 
                 95 
                 NZ 
                 LYS 
                 A 
                 12 
                 46.627 
                 −9.346 
                 1.416 
                 1.00 
                 36.82 
                 N 
               
               
                 ATOM 
                 96 
                 C 
                 LYS 
                 A 
                 12 
                 45.779 
                 −14.600 
                 4.710 
                 1.00 
                 36.74 
                 C 
               
               
                 ATOM 
                 97 
                 O 
                 LYS 
                 A 
                 12 
                 45.567 
                 −15.138 
                 5.790 
                 1.00 
                 36.56 
                 O 
               
               
                 ATOM 
                 98 
                 N 
                 GLU 
                 A 
                 13 
                 46.748 
                 −14.983 
                 3.890 
                 1.00 
                 36.65 
                 N 
               
               
                 ATOM 
                 99 
                 CA 
                 GLU 
                 A 
                 13 
                 47.662 
                 −16.063 
                 4.223 
                 1.00 
                 36.63 
                 C 
               
               
                 ATOM 
                 100 
                 CB 
                 GLU 
                 A 
                 13 
                 48.443 
                 −16.476 
                 2.982 
                 1.00 
                 36.88 
                 C 
               
               
                 ATOM 
                 101 
                 CG 
                 GLU 
                 A 
                 13 
                 48.852 
                 −17.943 
                 2.921 
                 1.00 
                 37.05 
                 C 
               
               
                 ATOM 
                 102 
                 CD 
                 GLU 
                 A 
                 13 
                 47.914 
                 −18.746 
                 2.053 
                 1.00 
                 37.80 
                 C 
               
               
                 ATOM 
                 103 
                 OE1 
                 GLU 
                 A 
                 13 
                 48.375 
                 −19.718 
                 1.409 
                 1.00 
                 36.95 
                 O 
               
               
                 ATOM 
                 104 
                 OE2 
                 GLU 
                 A 
                 13 
                 46.712 
                 −18.387 
                 2.008 
                 1.00 
                 38.61 
                 O 
               
               
                 ATOM 
                 105 
                 C 
                 GLU 
                 A 
                 13 
                 48.640 
                 −15.558 
                 5.257 
                 1.00 
                 36.50 
                 C 
               
               
                 ATOM 
                 106 
                 O 
                 GLU 
                 A 
                 13 
                 48.973 
                 −14.381 
                 5.267 
                 1.00 
                 36.57 
                 O 
               
               
                 ATOM 
                 107 
                 N 
                 THR 
                 A 
                 14 
                 49.104 
                 −16.454 
                 6.119 
                 1.00 
                 36.57 
                 N 
               
               
                 ATOM 
                 108 
                 CA 
                 THR 
                 A 
                 14 
                 50.154 
                 −16.149 
                 7.087 
                 1.00 
                 36.76 
                 C 
               
               
                 ATOM 
                 109 
                 CB 
                 THR 
                 A 
                 14 
                 50.468 
                 −17.390 
                 7.993 
                 1.00 
                 37.06 
                 C 
               
               
                 ATOM 
                 110 
                 OG1 
                 THR 
                 A 
                 14 
                 49.284 
                 −18.190 
                 8.178 
                 1.00 
                 37.72 
                 O 
               
               
                 ATOM 
                 111 
                 CG2 
                 THR 
                 A 
                 14 
                 51.006 
                 −16.970 
                 9.359 
                 1.00 
                 37.11 
                 C 
               
               
                 ATOM 
                 112 
                 C 
                 THR 
                 A 
                 14 
                 51.421 
                 −15.708 
                 6.338 
                 1.00 
                 36.68 
                 C 
               
               
                 ATOM 
                 113 
                 O 
                 THR 
                 A 
                 14 
                 51.878 
                 −16.394 
                 5.419 
                 1.00 
                 36.83 
                 O 
               
               
                 ATOM 
                 114 
                 N 
                 GLY 
                 A 
                 15 
                 51.973 
                 −14.562 
                 6.724 
                 1.00 
                 36.57 
                 N 
               
               
                 ATOM 
                 115 
                 CA 
                 GLY 
                 A 
                 15 
                 53.222 
                 −14.066 
                 6.142 
                 1.00 
                 36.88 
                 C 
               
               
                 ATOM 
                 116 
                 C 
                 GLY 
                 A 
                 15 
                 52.988 
                 −12.938 
                 5.160 
                 1.00 
                 37.24 
                 C 
               
               
                 ATOM 
                 117 
                 O 
                 GLY 
                 A 
                 15 
                 53.925 
                 −12.306 
                 4.684 
                 1.00 
                 37.22 
                 O 
               
               
                 ATOM 
                 118 
                 N 
                 GLU 
                 A 
                 16 
                 51.719 
                 −12.680 
                 4.876 
                 1.00 
                 37.60 
                 N 
               
               
                 ATOM 
                 119 
                 CA 
                 GLU 
                 A 
                 16 
                 51.313 
                 −11.686 
                 3.901 
                 1.00 
                 38.12 
                 C 
               
               
                 ATOM 
                 120 
                 CB 
                 GLU 
                 A 
                 16 
                 50.036 
                 −12.178 
                 3.221 
                 1.00 
                 38.52 
                 C 
               
               
                 ATOM 
                 121 
                 CG 
                 GLU 
                 A 
                 16 
                 50.043 
                 −12.115 
                 1.696 
                 1.00 
                 39.20 
                 C 
               
               
                 ATOM 
                 122 
                 CD 
                 GLU 
                 A 
                 16 
                 49.133 
                 −13.160 
                 1.081 
                 1.00 
                 38.58 
                 C 
               
               
                 ATOM 
                 123 
                 OE1 
                 GLU 
                 A 
                 16 
                 47.934 
                 −13.224 
                 1.446 
                 1.00 
                 37.91 
                 O 
               
               
                 ATOM 
                 124 
                 OE2 
                 GLU 
                 A 
                 16 
                 49.631 
                 −13.922 
                 0.231 
                 1.00 
                 39.94 
                 O 
               
               
                 ATOM 
                 125 
                 C 
                 GLU 
                 A 
                 16 
                 51.078 
                 −10.307 
                 4.545 
                 1.00 
                 38.27 
                 C 
               
               
                 ATOM 
                 126 
                 O 
                 GLU 
                 A 
                 16 
                 51.211 
                 −10.149 
                 5.766 
                 1.00 
                 38.17 
                 O 
               
               
                 ATOM 
                 127 
                 N 
                 SER 
                 A 
                 17 
                 50.733 
                 −9.319 
                 3.718 
                 1.00 
                 38.22 
                 N 
               
               
                 ATOM 
                 128 
                 CA 
                 SER 
                 A 
                 17 
                 50.527 
                 −7.952 
                 4.181 
                 1.00 
                 38.25 
                 C 
               
               
                 ATOM 
                 129 
                 CB 
                 SER 
                 A 
                 17 
                 51.468 
                 −7.012 
                 3.449 
                 1.00 
                 38.04 
                 C 
               
               
                 ATOM 
                 130 
                 OG 
                 SER 
                 A 
                 17 
                 52.526 
                 −6.633 
                 4.292 
                 1.00 
                 38.21 
                 O 
               
               
                 ATOM 
                 131 
                 C 
                 SER 
                 A 
                 17 
                 49.100 
                 −7.463 
                 4.016 
                 1.00 
                 38.42 
                 C 
               
               
                 ATOM 
                 132 
                 O 
                 SER 
                 A 
                 17 
                 48.468 
                 −7.715 
                 3.001 
                 1.00 
                 38.73 
                 O 
               
               
                 ATOM 
                 133 
                 N 
                 LEU 
                 A 
                 18 
                 48.585 
                 −6.763 
                 5.017 
                 1.00 
                 38.75 
                 N 
               
               
                 ATOM 
                 134 
                 CA 
                 LEU 
                 A 
                 18 
                 47.270 
                 −6.156 
                 4.874 
                 1.00 
                 39.12 
                 C 
               
               
                 ATOM 
                 135 
                 CB 
                 LEU 
                 A 
                 18 
                 46.353 
                 −6.572 
                 6.022 
                 1.00 
                 39.04 
                 C 
               
               
                 ATOM 
                 136 
                 CG 
                 LEU 
                 A 
                 18 
                 44.806 
                 −6.512 
                 6.021 
                 1.00 
                 38.73 
                 C 
               
               
                 ATOM 
                 137 
                 CD1 
                 LEU 
                 A 
                 18 
                 44.328 
                 −5.643 
                 7.149 
                 1.00 
                 39.79 
                 C 
               
               
                 ATOM 
                 138 
                 CD2 
                 LEU 
                 A 
                 18 
                 44.103 
                 −6.155 
                 4.705 
                 1.00 
                 37.22 
                 C 
               
               
                 ATOM 
                 139 
                 C 
                 LEU 
                 A 
                 18 
                 47.373 
                 −4.634 
                 4.760 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 140 
                 O 
                 LEU 
                 A 
                 18 
                 48.245 
                 −4.003 
                 5.382 
                 1.00 
                 39.45 
                 O 
               
               
                 ATOM 
                 141 
                 N 
                 THR 
                 A 
                 19 
                 46.495 
                 −4.073 
                 3.928 
                 1.00 
                 39.47 
                 N 
               
               
                 ATOM 
                 142 
                 CA 
                 THR 
                 A 
                 19 
                 46.365 
                 −2.639 
                 3.747 
                 1.00 
                 39.18 
                 C 
               
               
                 ATOM 
                 143 
                 CB 
                 THR 
                 A 
                 19 
                 46.900 
                 −2.192 
                 2.371 
                 1.00 
                 39.41 
                 C 
               
               
                 ATOM 
                 144 
                 OG1 
                 THR 
                 A 
                 19 
                 48.101 
                 −2.914 
                 2.076 
                 1.00 
                 39.32 
                 O 
               
               
                 ATOM 
                 145 
                 CG2 
                 THR 
                 A 
                 19 
                 47.174 
                 −0.670 
                 2.324 
                 1.00 
                 38.20 
                 C 
               
               
                 ATOM 
                 146 
                 C 
                 THR 
                 A 
                 19 
                 44.892 
                 −2.293 
                 3.868 
                 1.00 
                 39.18 
                 C 
               
               
                 ATOM 
                 147 
                 O 
                 THR 
                 A 
                 19 
                 44.060 
                 −2.770 
                 3.091 
                 1.00 
                 38.41 
                 O 
               
               
                 ATOM 
                 148 
                 N 
                 ILE 
                 A 
                 20 
                 44.597 
                 −1.478 
                 4.876 
                 1.00 
                 39.56 
                 N 
               
               
                 ATOM 
                 149 
                 CA 
                 ILE 
                 A 
                 20 
                 43.260 
                 −0.955 
                 5.138 
                 1.00 
                 39.76 
                 C 
               
               
                 ATOM 
                 150 
                 CB 
                 ILE 
                 A 
                 20 
                 42.903 
                 −1.040 
                 6.652 
                 1.00 
                 39.03 
                 C 
               
               
                 ATOM 
                 151 
                 CG1 
                 ILE 
                 A 
                 20 
                 42.854 
                 −2.492 
                 7.109 
                 1.00 
                 37.40 
                 C 
               
               
                 ATOM 
                 152 
                 CD1 
                 ILE 
                 A 
                 20 
                 42.677 
                 −2.673 
                 8.576 
                 1.00 
                 34.93 
                 C 
               
               
                 ATOM 
                 153 
                 CG2 
                 ILE 
                 A 
                 20 
                 41.561 
                 −0.422 
                 6.915 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 154 
                 C 
                 ILE 
                 A 
                 20 
                 43.270 
                 0.502 
                 4.705 
                 1.00 
                 40.70 
                 C 
               
               
                 ATOM 
                 155 
                 O 
                 ILE 
                 A 
                 20 
                 44.093 
                 1.289 
                 5.200 
                 1.00 
                 41.44 
                 O 
               
               
                 ATOM 
                 156 
                 N 
                 ASN 
                 A 
                 21 
                 42.378 
                 0.865 
                 3.784 
                 1.00 
                 41.34 
                 N 
               
               
                 ATOM 
                 157 
                 CA 
                 ASN 
                 A 
                 21 
                 42.217 
                 2.277 
                 3.388 
                 1.00 
                 41.97 
                 C 
               
               
                 ATOM 
                 158 
                 CB 
                 ASN 
                 A 
                 21 
                 41.958 
                 2.394 
                 1.892 
                 1.00 
                 41.90 
                 C 
               
               
                 ATOM 
                 159 
                 CG 
                 ASN 
                 A 
                 21 
                 43.155 
                 1.947 
                 1.059 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 160 
                 OD1 
                 ASN 
                 A 
                 21 
                 43.117 
                 0.905 
                 0.407 
                 1.00 
                 43.46 
                 O 
               
               
                 ATOM 
                 161 
                 ND2 
                 ASN 
                 A 
                 21 
                 44.224 
                 2.730 
                 1.085 
                 1.00 
                 43.18 
                 N 
               
               
                 ATOM 
                 162 
                 C 
                 ASN 
                 A 
                 21 
                 41.136 
                 2.997 
                 4.190 
                 1.00 
                 42.22 
                 C 
               
               
                 ATOM 
                 163 
                 O 
                 ASN 
                 A 
                 21 
                 40.226 
                 2.370 
                 4.705 
                 1.00 
                 43.14 
                 O 
               
               
                 ATOM 
                 164 
                 N 
                 CYS 
                 A 
                 22 
                 41.260 
                 4.305 
                 4.327 
                 1.00 
                 42.28 
                 N 
               
               
                 ATOM 
                 165 
                 CA 
                 CYS 
                 A 
                 22 
                 40.265 
                 5.101 
                 5.027 
                 1.00 
                 42.84 
                 C 
               
               
                 ATOM 
                 166 
                 CB 
                 CYS 
                 A 
                 22 
                 40.554 
                 5.158 
                 6.527 
                 1.00 
                 43.14 
                 C 
               
               
                 ATOM 
                 167 
                 SG 
                 CYS 
                 A 
                 22 
                 40.171 
                 3.613 
                 7.438 
                 1.00 
                 48.94 
                 S 
               
               
                 ATOM 
                 168 
                 C 
                 CYS 
                 A 
                 22 
                 40.209 
                 6.508 
                 4.455 
                 1.00 
                 41.89 
                 C 
               
               
                 ATOM 
                 169 
                 O 
                 CYS 
                 A 
                 22 
                 41.239 
                 7.124 
                 4.182 
                 1.00 
                 42.35 
                 O 
               
               
                 ATOM 
                 170 
                 N 
                 ALA 
                 A 
                 23 
                 39.005 
                 7.014 
                 4.260 
                 1.00 
                 40.70 
                 N 
               
               
                 ATOM 
                 171 
                 CA 
                 ALA 
                 A 
                 23 
                 38.848 
                 8.380 
                 3.803 
                 1.00 
                 39.76 
                 C 
               
               
                 ATOM 
                 172 
                 CB 
                 ALA 
                 A 
                 23 
                 38.526 
                 8.399 
                 2.357 
                 1.00 
                 39.71 
                 C 
               
               
                 ATOM 
                 173 
                 C 
                 ALA 
                 A 
                 23 
                 37.762 
                 9.084 
                 4.612 
                 1.00 
                 39.14 
                 C 
               
               
                 ATOM 
                 174 
                 O 
                 ALA 
                 A 
                 23 
                 36.691 
                 8.519 
                 4.843 
                 1.00 
                 38.80 
                 O 
               
               
                 ATOM 
                 175 
                 N 
                 LEU 
                 A 
                 24 
                 38.076 
                 10.305 
                 5.056 
                 1.00 
                 38.04 
                 N 
               
               
                 ATOM 
                 176 
                 CA 
                 LEU 
                 A 
                 24 
                 37.170 
                 11.133 
                 5.840 
                 1.00 
                 37.40 
                 C 
               
               
                 ATOM 
                 177 
                 CB 
                 LEU 
                 A 
                 24 
                 37.981 
                 12.023 
                 6.793 
                 1.00 
                 37.06 
                 C 
               
               
                 ATOM 
                 178 
                 CG 
                 LEU 
                 A 
                 24 
                 37.310 
                 13.044 
                 7.730 
                 1.00 
                 37.11 
                 C 
               
               
                 ATOM 
                 179 
                 CD1 
                 LEU 
                 A 
                 24 
                 38.333 
                 13.654 
                 8.690 
                 1.00 
                 34.67 
                 C 
               
               
                 ATOM 
                 180 
                 CD2 
                 LEU 
                 A 
                 24 
                 36.106 
                 12.470 
                 8.501 
                 1.00 
                 35.66 
                 C 
               
               
                 ATOM 
                 181 
                 C 
                 LEU 
                 A 
                 24 
                 36.265 
                 11.952 
                 4.897 
                 1.00 
                 37.29 
                 C 
               
               
                 ATOM 
                 182 
                 O 
                 LEU 
                 A 
                 24 
                 36.746 
                 12.790 
                 4.117 
                 1.00 
                 36.95 
                 O 
               
               
                 ATOM 
                 183 
                 N 
                 LYS 
                 A 
                 25 
                 34.959 
                 11.695 
                 4.951 
                 1.00 
                 36.83 
                 N 
               
               
                 ATOM 
                 184 
                 CA 
                 LYS 
                 A 
                 25 
                 34.046 
                 12.329 
                 4.008 
                 1.00 
                 36.82 
                 C 
               
               
                 ATOM 
                 185 
                 CB 
                 LYS 
                 A 
                 25 
                 33.225 
                 11.273 
                 3.268 
                 1.00 
                 36.56 
                 C 
               
               
                 ATOM 
                 186 
                 CG 
                 LYS 
                 A 
                 25 
                 34.044 
                 10.153 
                 2.595 
                 1.00 
                 37.16 
                 C 
               
               
                 ATOM 
                 187 
                 CD 
                 LYS 
                 A 
                 25 
                 34.408 
                 10.422 
                 1.143 
                 1.00 
                 37.46 
                 C 
               
               
                 ATOM 
                 188 
                 CE 
                 LYS 
                 A 
                 25 
                 35.722 
                 11.217 
                 1.064 
                 1.00 
                 41.41 
                 C 
               
               
                 ATOM 
                 189 
                 NZ 
                 LYS 
                 A 
                 25 
                 36.517 
                 11.096 
                 −0.229 
                 1.00 
                 41.89 
                 N 
               
               
                 ATOM 
                 190 
                 C 
                 LYS 
                 A 
                 25 
                 33.137 
                 13.322 
                 4.709 
                 1.00 
                 36.75 
                 C 
               
               
                 ATOM 
                 191 
                 O 
                 LYS 
                 A 
                 25 
                 32.758 
                 13.096 
                 5.854 
                 1.00 
                 37.04 
                 O 
               
               
                 ATOM 
                 192 
                 N 
                 ASN 
                 A 
                 26 
                 32.798 
                 14.420 
                 4.027 
                 1.00 
                 36.84 
                 N 
               
               
                 ATOM 
                 193 
                 CA 
                 ASN 
                 A 
                 26 
                 31.808 
                 15.399 
                 4.510 
                 1.00 
                 37.02 
                 C 
               
               
                 ATOM 
                 194 
                 CB 
                 ASN 
                 A 
                 26 
                 30.454 
                 14.723 
                 4.775 
                 1.00 
                 37.06 
                 C 
               
               
                 ATOM 
                 195 
                 CG 
                 ASN 
                 A 
                 26 
                 29.262 
                 15.664 
                 4.557 
                 1.00 
                 39.15 
                 C 
               
               
                 ATOM 
                 196 
                 OD1 
                 ASN 
                 A 
                 26 
                 28.344 
                 15.755 
                 5.390 
                 1.00 
                 39.26 
                 O 
               
               
                 ATOM 
                 197 
                 ND2 
                 ASN 
                 A 
                 26 
                 29.265 
                 16.361 
                 3.422 
                 1.00 
                 41.33 
                 N 
               
               
                 ATOM 
                 198 
                 C 
                 ASN 
                 A 
                 26 
                 32.254 
                 16.157 
                 5.759 
                 1.00 
                 37.24 
                 C 
               
               
                 ATOM 
                 199 
                 O 
                 ASN 
                 A 
                 26 
                 31.420 
                 16.589 
                 6.551 
                 1.00 
                 37.14 
                 O 
               
               
                 ATOM 
                 200 
                 N 
                 ALA 
                 A 
                 27 
                 33.567 
                 16.296 
                 5.941 
                 1.00 
                 37.46 
                 N 
               
               
                 ATOM 
                 201 
                 CA 
                 ALA 
                 A 
                 27 
                 34.131 
                 17.028 
                 7.069 
                 1.00 
                 37.86 
                 C 
               
               
                 ATOM 
                 202 
                 CB 
                 ALA 
                 A 
                 27 
                 35.300 
                 16.289 
                 7.631 
                 1.00 
                 37.64 
                 C 
               
               
                 ATOM 
                 203 
                 C 
                 ALA 
                 A 
                 27 
                 34.557 
                 18.443 
                 6.673 
                 1.00 
                 38.63 
                 C 
               
               
                 ATOM 
                 204 
                 O 
                 ALA 
                 A 
                 27 
                 35.473 
                 18.630 
                 5.839 
                 1.00 
                 39.12 
                 O 
               
               
                 ATOM 
                 205 
                 N 
                 ALA 
                 A 
                 28 
                 33.894 
                 19.425 
                 7.286 
                 1.00 
                 38.74 
                 N 
               
               
                 ATOM 
                 206 
                 CA 
                 ALA 
                 A 
                 28 
                 34.201 
                 20.846 
                 7.127 
                 1.00 
                 38.77 
                 C 
               
               
                 ATOM 
                 207 
                 CB 
                 ALA 
                 A 
                 28 
                 33.266 
                 21.675 
                 7.969 
                 1.00 
                 38.26 
                 C 
               
               
                 ATOM 
                 208 
                 C 
                 ALA 
                 A 
                 28 
                 35.650 
                 21.212 
                 7.468 
                 1.00 
                 39.27 
                 C 
               
               
                 ATOM 
                 209 
                 O 
                 ALA 
                 A 
                 28 
                 36.238 
                 22.075 
                 6.800 
                 1.00 
                 39.84 
                 O 
               
               
                 ATOM 
                 210 
                 N 
                 ASP 
                 A 
                 29 
                 36.227 
                 20.579 
                 8.495 
                 1.00 
                 39.15 
                 N 
               
               
                 ATOM 
                 211 
                 CA 
                 ASP 
                 A 
                 29 
                 37.529 
                 21.012 
                 9.011 
                 1.00 
                 39.27 
                 C 
               
               
                 ATOM 
                 212 
                 CB 
                 ASP 
                 A 
                 29 
                 37.435 
                 21.193 
                 10.516 
                 1.00 
                 39.55 
                 C 
               
               
                 ATOM 
                 213 
                 CG 
                 ASP 
                 A 
                 29 
                 36.715 
                 22.467 
                 10.909 
                 1.00 
                 40.83 
                 C 
               
               
                 ATOM 
                 214 
                 OD1 
                 ASP 
                 A 
                 29 
                 36.915 
                 23.522 
                 10.253 
                 1.00 
                 40.47 
                 O 
               
               
                 ATOM 
                 215 
                 OD2 
                 ASP 
                 A 
                 29 
                 35.946 
                 22.409 
                 11.894 
                 1.00 
                 43.52 
                 O 
               
               
                 ATOM 
                 216 
                 C 
                 ASP 
                 A 
                 29 
                 38.697 
                 20.092 
                 8.639 
                 1.00 
                 39.04 
                 C 
               
               
                 ATOM 
                 217 
                 O 
                 ASP 
                 A 
                 29 
                 38.481 
                 19.056 
                 8.035 
                 1.00 
                 39.18 
                 O 
               
               
                 ATOM 
                 218 
                 N 
                 ASP 
                 A 
                 30 
                 39.929 
                 20.464 
                 8.996 
                 1.00 
                 38.80 
                 N 
               
               
                 ATOM 
                 219 
                 CA 
                 ASP 
                 A 
                 30 
                 41.115 
                 19.660 
                 8.628 
                 1.00 
                 38.39 
                 C 
               
               
                 ATOM 
                 220 
                 CB 
                 ASP 
                 A 
                 30 
                 42.418 
                 20.435 
                 8.838 
                 1.00 
                 38.50 
                 C 
               
               
                 ATOM 
                 221 
                 CG 
                 ASP 
                 A 
                 30 
                 42.507 
                 21.699 
                 7.991 
                 1.00 
                 40.29 
                 C 
               
               
                 ATOM 
                 222 
                 OD1 
                 ASP 
                 A 
                 30 
                 43.012 
                 22.709 
                 8.523 
                 1.00 
                 42.73 
                 O 
               
               
                 ATOM 
                 223 
                 OD2 
                 ASP 
                 A 
                 30 
                 42.080 
                 21.708 
                 6.808 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 224 
                 C 
                 ASP 
                 A 
                 30 
                 41.210 
                 18.370 
                 9.419 
                 1.00 
                 37.92 
                 C 
               
               
                 ATOM 
                 225 
                 O 
                 ASP 
                 A 
                 30 
                 40.802 
                 18.325 
                 10.584 
                 1.00 
                 37.68 
                 O 
               
               
                 ATOM 
                 226 
                 N 
                 LEU 
                 A 
                 31 
                 41.751 
                 17.332 
                 8.774 
                 1.00 
                 37.28 
                 N 
               
               
                 ATOM 
                 227 
                 CA 
                 LEU 
                 A 
                 31 
                 42.173 
                 16.113 
                 9.441 
                 1.00 
                 36.52 
                 C 
               
               
                 ATOM 
                 228 
                 CB 
                 LEU 
                 A 
                 31 
                 42.727 
                 15.118 
                 8.438 
                 1.00 
                 36.34 
                 C 
               
               
                 ATOM 
                 229 
                 CG 
                 LEU 
                 A 
                 31 
                 42.508 
                 13.612 
                 8.605 
                 1.00 
                 35.92 
                 C 
               
               
                 ATOM 
                 230 
                 CD1 
                 LEU 
                 A 
                 31 
                 42.219 
                 13.184 
                 10.047 
                 1.00 
                 35.84 
                 C 
               
               
                 ATOM 
                 231 
                 CD2 
                 LEU 
                 A 
                 31 
                 43.676 
                 12.876 
                 8.037 
                 1.00 
                 35.02 
                 C 
               
               
                 ATOM 
                 232 
                 C 
                 LEU 
                 A 
                 31 
                 43.304 
                 16.505 
                 10.330 
                 1.00 
                 36.82 
                 C 
               
               
                 ATOM 
                 233 
                 O 
                 LEU 
                 A 
                 31 
                 44.265 
                 17.147 
                 9.883 
                 1.00 
                 36.89 
                 O 
               
               
                 ATOM 
                 234 
                 N 
                 GLU 
                 A 
                 32 
                 43.213 
                 16.090 
                 11.583 
                 1.00 
                 37.16 
                 N 
               
               
                 ATOM 
                 235 
                 CA 
                 GLU 
                 A 
                 32 
                 44.153 
                 16.520 
                 12.603 
                 1.00 
                 37.77 
                 C 
               
               
                 ATOM 
                 236 
                 CB 
                 GLU 
                 A 
                 32 
                 43.443 
                 17.502 
                 13.557 
                 1.00 
                 37.94 
                 C 
               
               
                 ATOM 
                 237 
                 CG 
                 GLU 
                 A 
                 32 
                 44.338 
                 18.432 
                 14.370 
                 1.00 
                 40.70 
                 C 
               
               
                 ATOM 
                 238 
                 CD 
                 GLU 
                 A 
                 32 
                 45.128 
                 19.438 
                 13.530 
                 1.00 
                 43.57 
                 C 
               
               
                 ATOM 
                 239 
                 OE1 
                 GLU 
                 A 
                 32 
                 46.360 
                 19.572 
                 13.769 
                 1.00 
                 43.94 
                 O 
               
               
                 ATOM 
                 240 
                 OE2 
                 GLU 
                 A 
                 32 
                 44.521 
                 20.097 
                 12.649 
                 1.00 
                 44.41 
                 O 
               
               
                 ATOM 
                 241 
                 C 
                 GLU 
                 A 
                 32 
                 44.820 
                 15.312 
                 13.319 
                 1.00 
                 37.53 
                 C 
               
               
                 ATOM 
                 242 
                 O 
                 GLU 
                 A 
                 32 
                 46.000 
                 15.347 
                 13.645 
                 1.00 
                 37.47 
                 O 
               
               
                 ATOM 
                 243 
                 N 
                 ARG 
                 A 
                 33 
                 44.089 
                 14.228 
                 13.514 
                 1.00 
                 37.63 
                 N 
               
               
                 ATOM 
                 244 
                 CA 
                 ARG 
                 A 
                 33 
                 44.650 
                 13.069 
                 14.176 
                 1.00 
                 38.59 
                 C 
               
               
                 ATOM 
                 245 
                 CB 
                 ARG 
                 A 
                 33 
                 44.330 
                 13.124 
                 15.668 
                 1.00 
                 38.27 
                 C 
               
               
                 ATOM 
                 246 
                 CG 
                 ARG 
                 A 
                 33 
                 45.405 
                 12.524 
                 16.561 
                 1.00 
                 39.74 
                 C 
               
               
                 ATOM 
                 247 
                 CD 
                 ARG 
                 A 
                 33 
                 44.978 
                 12.402 
                 18.023 
                 1.00 
                 40.86 
                 C 
               
               
                 ATOM 
                 248 
                 NE 
                 ARG 
                 A 
                 33 
                 43.765 
                 11.591 
                 18.189 
                 1.00 
                 48.81 
                 N 
               
               
                 ATOM 
                 249 
                 CZ 
                 ARG 
                 A 
                 33 
                 42.619 
                 12.005 
                 18.751 
                 1.00 
                 51.82 
                 C 
               
               
                 ATOM 
                 250 
                 NH1 
                 ARG 
                 A 
                 33 
                 42.484 
                 13.241 
                 19.247 
                 1.00 
                 50.95 
                 N 
               
               
                 ATOM 
                 251 
                 NH2 
                 ARG 
                 A 
                 33 
                 41.589 
                 11.161 
                 18.828 
                 1.00 
                 54.87 
                 N 
               
               
                 ATOM 
                 252 
                 C 
                 ARG 
                 A 
                 33 
                 44.081 
                 11.800 
                 13.573 
                 1.00 
                 38.68 
                 C 
               
               
                 ATOM 
                 253 
                 O 
                 ARG 
                 A 
                 33 
                 42.887 
                 11.731 
                 13.269 
                 1.00 
                 38.65 
                 O 
               
               
                 ATOM 
                 254 
                 N 
                 THR 
                 A 
                 34 
                 44.924 
                 10.790 
                 13.392 
                 1.00 
                 39.54 
                 N 
               
               
                 ATOM 
                 255 
                 CA 
                 THR 
                 A 
                 34 
                 44.442 
                 9.476 
                 12.933 
                 1.00 
                 40.35 
                 C 
               
               
                 ATOM 
                 256 
                 CB 
                 THR 
                 A 
                 34 
                 44.987 
                 9.118 
                 11.559 
                 1.00 
                 40.18 
                 C 
               
               
                 ATOM 
                 257 
                 OG1 
                 THR 
                 A 
                 34 
                 46.414 
                 9.263 
                 11.560 
                 1.00 
                 39.67 
                 O 
               
               
                 ATOM 
                 258 
                 CG2 
                 THR 
                 A 
                 34 
                 44.382 
                 10.023 
                 10.501 
                 1.00 
                 40.31 
                 C 
               
               
                 ATOM 
                 259 
                 C 
                 THR 
                 A 
                 34 
                 44.827 
                 8.383 
                 13.927 
                 1.00 
                 41.31 
                 C 
               
               
                 ATOM 
                 260 
                 O 
                 THR 
                 A 
                 34 
                 45.953 
                 8.373 
                 14.447 
                 1.00 
                 41.94 
                 O 
               
               
                 ATOM 
                 261 
                 N 
                 ASP 
                 A 
                 35 
                 43.891 
                 7.478 
                 14.210 
                 1.00 
                 41.83 
                 N 
               
               
                 ATOM 
                 262 
                 CA 
                 ASP 
                 A 
                 35 
                 44.126 
                 6.393 
                 15.161 
                 1.00 
                 42.20 
                 C 
               
               
                 ATOM 
                 263 
                 CB 
                 ASP 
                 A 
                 35 
                 43.274 
                 6.571 
                 16.421 
                 1.00 
                 42.42 
                 C 
               
               
                 ATOM 
                 264 
                 CG 
                 ASP 
                 A 
                 35 
                 43.737 
                 7.747 
                 17.302 
                 1.00 
                 46.01 
                 C 
               
               
                 ATOM 
                 265 
                 OD1 
                 ASP 
                 A 
                 35 
                 42.966 
                 8.226 
                 18.195 
                 1.00 
                 47.52 
                 O 
               
               
                 ATOM 
                 266 
                 OD2 
                 ASP 
                 A 
                 35 
                 44.892 
                 8.195 
                 17.112 
                 1.00 
                 50.48 
                 O 
               
               
                 ATOM 
                 267 
                 C 
                 ASP 
                 A 
                 35 
                 43.762 
                 5.095 
                 14.470 
                 1.00 
                 42.09 
                 C 
               
               
                 ATOM 
                 268 
                 O 
                 ASP 
                 A 
                 35 
                 43.012 
                 5.105 
                 13.485 
                 1.00 
                 41.93 
                 O 
               
               
                 ATOM 
                 269 
                 N 
                 TRP 
                 A 
                 36 
                 44.322 
                 3.985 
                 14.959 
                 1.00 
                 42.03 
                 N 
               
               
                 ATOM 
                 270 
                 CA 
                 TRP 
                 A 
                 36 
                 43.935 
                 2.646 
                 14.501 
                 1.00 
                 41.95 
                 C 
               
               
                 ATOM 
                 271 
                 CB 
                 TRP 
                 A 
                 36 
                 44.964 
                 2.073 
                 13.553 
                 1.00 
                 41.75 
                 C 
               
               
                 ATOM 
                 272 
                 CG 
                 TRP 
                 A 
                 36 
                 45.116 
                 2.870 
                 12.337 
                 1.00 
                 41.84 
                 C 
               
               
                 ATOM 
                 273 
                 CD1 
                 TRP 
                 A 
                 36 
                 45.928 
                 3.949 
                 12.162 
                 1.00 
                 41.60 
                 C 
               
               
                 ATOM 
                 274 
                 NE1 
                 TRP 
                 A 
                 36 
                 45.799 
                 4.440 
                 10.884 
                 1.00 
                 42.39 
                 N 
               
               
                 ATOM 
                 275 
                 CE2 
                 TRP 
                 A 
                 36 
                 44.890 
                 3.669 
                 10.210 
                 1.00 
                 42.33 
                 C 
               
               
                 ATOM 
                 276 
                 CD2 
                 TRP 
                 A 
                 36 
                 44.428 
                 2.677 
                 11.105 
                 1.00 
                 41.80 
                 C 
               
               
                 ATOM 
                 277 
                 CE3 
                 TRP 
                 A 
                 36 
                 43.487 
                 1.749 
                 10.660 
                 1.00 
                 40.90 
                 C 
               
               
                 ATOM 
                 278 
                 CZ3 
                 TRP 
                 A 
                 36 
                 43.037 
                 1.839 
                 9.374 
                 1.00 
                 41.85 
                 C 
               
               
                 ATOM 
                 279 
                 CH2 
                 TRP 
                 A 
                 36 
                 43.520 
                 2.840 
                 8.497 
                 1.00 
                 42.44 
                 C 
               
               
                 ATOM 
                 280 
                 CZ2 
                 TRP 
                 A 
                 36 
                 44.442 
                 3.758 
                 8.900 
                 1.00 
                 41.87 
                 C 
               
               
                 ATOM 
                 281 
                 C 
                 TRP 
                 A 
                 36 
                 43.767 
                 1.722 
                 15.680 
                 1.00 
                 42.21 
                 C 
               
               
                 ATOM 
                 282 
                 O 
                 TRP 
                 A 
                 36 
                 44.588 
                 1.736 
                 16.604 
                 1.00 
                 42.22 
                 O 
               
               
                 ATOM 
                 283 
                 N 
                 TYR 
                 A 
                 37 
                 42.706 
                 0.918 
                 15.632 
                 1.00 
                 42.73 
                 N 
               
               
                 ATOM 
                 284 
                 CA 
                 TYR 
                 A 
                 37 
                 42.263 
                 0.091 
                 16.763 
                 1.00 
                 43.04 
                 C 
               
               
                 ATOM 
                 285 
                 CB 
                 TYR 
                 A 
                 37 
                 40.951 
                 0.612 
                 17.329 
                 1.00 
                 42.85 
                 C 
               
               
                 ATOM 
                 286 
                 CG 
                 TYR 
                 A 
                 37 
                 41.021 
                 2.037 
                 17.776 
                 1.00 
                 43.46 
                 C 
               
               
                 ATOM 
                 287 
                 CD1 
                 TYR 
                 A 
                 37 
                 41.456 
                 2.361 
                 19.068 
                 1.00 
                 43.11 
                 C 
               
               
                 ATOM 
                 288 
                 CE1 
                 TYR 
                 A 
                 37 
                 41.548 
                 3.664 
                 19.490 
                 1.00 
                 41.58 
                 C 
               
               
                 ATOM 
                 289 
                 CZ 
                 TYR 
                 A 
                 37 
                 41.189 
                 4.677 
                 18.626 
                 1.00 
                 43.27 
                 C 
               
               
                 ATOM 
                 290 
                 OH 
                 TYR 
                 A 
                 37 
                 41.261 
                 5.989 
                 19.050 
                 1.00 
                 44.70 
                 O 
               
               
                 ATOM 
                 291 
                 CE2 
                 TYR 
                 A 
                 37 
                 40.746 
                 4.390 
                 17.333 
                 1.00 
                 43.92 
                 C 
               
               
                 ATOM 
                 292 
                 CD2 
                 TYR 
                 A 
                 37 
                 40.671 
                 3.070 
                 16.914 
                 1.00 
                 43.64 
                 C 
               
               
                 ATOM 
                 293 
                 C 
                 TYR 
                 A 
                 37 
                 42.029 
                 −1.325 
                 16.317 
                 1.00 
                 43.46 
                 C 
               
               
                 ATOM 
                 294 
                 O 
                 TYR 
                 A 
                 37 
                 41.591 
                 −1.566 
                 15.187 
                 1.00 
                 44.17 
                 O 
               
               
                 ATOM 
                 295 
                 N 
                 ARG 
                 A 
                 38 
                 42.312 
                 −2.259 
                 17.206 
                 1.00 
                 43.57 
                 N 
               
               
                 ATOM 
                 296 
                 CA 
                 ARG 
                 A 
                 38 
                 42.024 
                 −3.648 
                 16.947 
                 1.00 
                 44.06 
                 C 
               
               
                 ATOM 
                 297 
                 CB 
                 ARG 
                 A 
                 38 
                 43.299 
                 −4.422 
                 16.565 
                 1.00 
                 44.12 
                 C 
               
               
                 ATOM 
                 298 
                 CG 
                 ARG 
                 A 
                 38 
                 44.193 
                 −4.794 
                 17.743 
                 1.00 
                 45.46 
                 C 
               
               
                 ATOM 
                 299 
                 CD 
                 ARG 
                 A 
                 38 
                 45.022 
                 −6.017 
                 17.472 
                 1.00 
                 48.46 
                 C 
               
               
                 ATOM 
                 300 
                 NE 
                 ARG 
                 A 
                 38 
                 46.019 
                 −5.760 
                 16.436 
                 1.00 
                 51.96 
                 N 
               
               
                 ATOM 
                 301 
                 CZ 
                 ARG 
                 A 
                 38 
                 46.772 
                 −6.693 
                 15.850 
                 1.00 
                 53.24 
                 C 
               
               
                 ATOM 
                 302 
                 NH1 
                 ARG 
                 A 
                 38 
                 47.654 
                 −6.345 
                 14.908 
                 1.00 
                 52.53 
                 N 
               
               
                 ATOM 
                 303 
                 NH2 
                 ARG 
                 A 
                 38 
                 46.645 
                 −7.970 
                 16.203 
                 1.00 
                 54.34 
                 N 
               
               
                 ATOM 
                 304 
                 C 
                 ARG 
                 A 
                 38 
                 41.370 
                 −4.276 
                 18.164 
                 1.00 
                 44.18 
                 C 
               
               
                 ATOM 
                 305 
                 O 
                 ARG 
                 A 
                 38 
                 41.730 
                 −3.980 
                 19.313 
                 1.00 
                 43.93 
                 O 
               
               
                 ATOM 
                 306 
                 N 
                 THR 
                 A 
                 39 
                 40.383 
                 −5.122 
                 17.903 
                 1.00 
                 44.59 
                 N 
               
               
                 ATOM 
                 307 
                 CA 
                 THR 
                 A 
                 39 
                 39.980 
                 −6.125 
                 18.879 
                 1.00 
                 44.78 
                 C 
               
               
                 ATOM 
                 308 
                 CB 
                 THR 
                 A 
                 39 
                 38.506 
                 −5.944 
                 19.441 
                 1.00 
                 44.80 
                 C 
               
               
                 ATOM 
                 309 
                 OG1 
                 THR 
                 A 
                 39 
                 37.647 
                 −6.999 
                 18.988 
                 1.00 
                 45.17 
                 O 
               
               
                 ATOM 
                 310 
                 CG2 
                 THR 
                 A 
                 39 
                 37.902 
                 −4.568 
                 19.101 
                 1.00 
                 44.19 
                 C 
               
               
                 ATOM 
                 311 
                 C 
                 THR 
                 A 
                 39 
                 40.241 
                 −7.490 
                 18.222 
                 1.00 
                 44.86 
                 C 
               
               
                 ATOM 
                 312 
                 O 
                 THR 
                 A 
                 39 
                 39.614 
                 −7.850 
                 17.217 
                 1.00 
                 44.92 
                 O 
               
               
                 ATOM 
                 313 
                 N 
                 THR 
                 A 
                 40 
                 41.211 
                 −8.218 
                 18.763 
                 1.00 
                 44.69 
                 N 
               
               
                 ATOM 
                 314 
                 CA 
                 THR 
                 A 
                 40 
                 41.535 
                 −9.535 
                 18.250 
                 1.00 
                 44.78 
                 C 
               
               
                 ATOM 
                 315 
                 CB 
                 THR 
                 A 
                 40 
                 42.888 
                 −10.006 
                 18.768 
                 1.00 
                 44.70 
                 C 
               
               
                 ATOM 
                 316 
                 OG1 
                 THR 
                 A 
                 40 
                 43.112 
                 −9.450 
                 20.065 
                 1.00 
                 43.69 
                 O 
               
               
                 ATOM 
                 317 
                 CG2 
                 THR 
                 A 
                 40 
                 43.997 
                 −9.535 
                 17.823 
                 1.00 
                 44.71 
                 C 
               
               
                 ATOM 
                 318 
                 C 
                 THR 
                 A 
                 40 
                 40.429 
                 −10.519 
                 18.611 
                 1.00 
                 45.11 
                 C 
               
               
                 ATOM 
                 319 
                 O 
                 THR 
                 A 
                 40 
                 39.598 
                 −10.220 
                 19.467 
                 1.00 
                 45.36 
                 O 
               
               
                 ATOM 
                 320 
                 N 
                 LEU 
                 A 
                 41 
                 40.398 
                 −11.666 
                 17.930 
                 1.00 
                 45.34 
                 N 
               
               
                 ATOM 
                 321 
                 CA 
                 LEU 
                 A 
                 41 
                 39.405 
                 −12.708 
                 18.185 
                 1.00 
                 45.60 
                 C 
               
               
                 ATOM 
                 322 
                 CB 
                 LEU 
                 A 
                 41 
                 39.650 
                 −13.923 
                 17.284 
                 1.00 
                 45.75 
                 C 
               
               
                 ATOM 
                 323 
                 CG 
                 LEU 
                 A 
                 41 
                 39.027 
                 −13.992 
                 15.886 
                 1.00 
                 46.10 
                 C 
               
               
                 ATOM 
                 324 
                 CD1 
                 LEU 
                 A 
                 41 
                 39.400 
                 −15.309 
                 15.218 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 325 
                 CD2 
                 LEU 
                 A 
                 41 
                 37.504 
                 −13.847 
                 15.936 
                 1.00 
                 46.64 
                 C 
               
               
                 ATOM 
                 326 
                 C 
                 LEU 
                 A 
                 41 
                 39.377 
                 −13.162 
                 19.646 
                 1.00 
                 45.78 
                 C 
               
               
                 ATOM 
                 327 
                 O 
                 LEU 
                 A 
                 41 
                 40.419 
                 −13.282 
                 20.296 
                 1.00 
                 45.53 
                 O 
               
               
                 ATOM 
                 328 
                 N 
                 GLY 
                 A 
                 42 
                 38.171 
                 −13.406 
                 20.149 
                 1.00 
                 46.12 
                 N 
               
               
                 ATOM 
                 329 
                 CA 
                 GLY 
                 A 
                 42 
                 37.968 
                 −13.838 
                 21.526 
                 1.00 
                 46.62 
                 C 
               
               
                 ATOM 
                 330 
                 C 
                 GLY 
                 A 
                 42 
                 38.330 
                 −12.787 
                 22.561 
                 1.00 
                 46.95 
                 C 
               
               
                 ATOM 
                 331 
                 O 
                 GLY 
                 A 
                 42 
                 38.450 
                 −13.096 
                 23.744 
                 1.00 
                 47.22 
                 O 
               
               
                 ATOM 
                 332 
                 N 
                 SER 
                 A 
                 43 
                 38.496 
                 −11.544 
                 22.120 
                 1.00 
                 47.14 
                 N 
               
               
                 ATOM 
                 333 
                 CA 
                 SER 
                 A 
                 43 
                 38.904 
                 −10.461 
                 23.002 
                 1.00 
                 47.51 
                 C 
               
               
                 ATOM 
                 334 
                 CB 
                 SER 
                 A 
                 43 
                 40.172 
                 −9.807 
                 22.452 
                 1.00 
                 47.44 
                 C 
               
               
                 ATOM 
                 335 
                 OG 
                 SER 
                 A 
                 43 
                 40.588 
                 −8.718 
                 23.250 
                 1.00 
                 47.84 
                 O 
               
               
                 ATOM 
                 336 
                 C 
                 SER 
                 A 
                 43 
                 37.782 
                 −9.438 
                 23.139 
                 1.00 
                 47.74 
                 C 
               
               
                 ATOM 
                 337 
                 O 
                 SER 
                 A 
                 43 
                 37.201 
                 −9.029 
                 22.138 
                 1.00 
                 47.93 
                 O 
               
               
                 ATOM 
                 338 
                 N 
                 THR 
                 A 
                 44 
                 37.491 
                 −9.024 
                 24.374 
                 1.00 
                 48.06 
                 N 
               
               
                 ATOM 
                 339 
                 CA 
                 THR 
                 A 
                 44 
                 36.372 
                 −8.104 
                 24.675 
                 1.00 
                 48.47 
                 C 
               
               
                 ATOM 
                 340 
                 CB 
                 THR 
                 A 
                 44 
                 36.037 
                 −8.081 
                 26.193 
                 1.00 
                 48.56 
                 C 
               
               
                 ATOM 
                 341 
                 OG1 
                 THR 
                 A 
                 44 
                 36.312 
                 −9.358 
                 26.790 
                 1.00 
                 49.42 
                 O 
               
               
                 ATOM 
                 342 
                 CG2 
                 THR 
                 A 
                 44 
                 34.566 
                 −7.694 
                 26.424 
                 1.00 
                 48.79 
                 C 
               
               
                 ATOM 
                 343 
                 C 
                 THR 
                 A 
                 44 
                 36.584 
                 −6.636 
                 24.258 
                 1.00 
                 48.60 
                 C 
               
               
                 ATOM 
                 344 
                 O 
                 THR 
                 A 
                 44 
                 35.606 
                 −5.879 
                 24.132 
                 1.00 
                 48.74 
                 O 
               
               
                 ATOM 
                 345 
                 N 
                 ASN 
                 A 
                 45 
                 37.841 
                 −6.227 
                 24.064 
                 1.00 
                 48.29 
                 N 
               
               
                 ATOM 
                 346 
                 CA 
                 ASN 
                 A 
                 45 
                 38.146 
                 −4.801 
                 23.989 
                 1.00 
                 47.93 
                 C 
               
               
                 ATOM 
                 347 
                 CB 
                 ASN 
                 A 
                 45 
                 38.709 
                 −4.286 
                 25.321 
                 1.00 
                 48.18 
                 C 
               
               
                 ATOM 
                 348 
                 CG 
                 ASN 
                 A 
                 45 
                 40.194 
                 −4.610 
                 25.510 
                 1.00 
                 47.74 
                 C 
               
               
                 ATOM 
                 349 
                 OD1 
                 ASN 
                 A 
                 45 
                 40.583 
                 −5.160 
                 26.535 
                 1.00 
                 48.34 
                 O 
               
               
                 ATOM 
                 350 
                 ND2 
                 ASN 
                 A 
                 45 
                 41.024 
                 −4.252 
                 24.532 
                 1.00 
                 47.01 
                 N 
               
               
                 ATOM 
                 351 
                 C 
                 ASN 
                 A 
                 45 
                 39.064 
                 −4.353 
                 22.875 
                 1.00 
                 47.68 
                 C 
               
               
                 ATOM 
                 352 
                 O 
                 ASN 
                 A 
                 45 
                 39.969 
                 −5.080 
                 22.450 
                 1.00 
                 47.62 
                 O 
               
               
                 ATOM 
                 353 
                 N 
                 GLU 
                 A 
                 46 
                 38.830 
                 −3.107 
                 22.475 
                 1.00 
                 47.03 
                 N 
               
               
                 ATOM 
                 354 
                 CA 
                 GLU 
                 A 
                 46 
                 39.563 
                 −2.405 
                 21.446 
                 1.00 
                 46.44 
                 C 
               
               
                 ATOM 
                 355 
                 CB 
                 GLU 
                 A 
                 46 
                 38.666 
                 −1.289 
                 20.929 
                 1.00 
                 46.92 
                 C 
               
               
                 ATOM 
                 356 
                 CG 
                 GLU 
                 A 
                 46 
                 38.808 
                 −0.975 
                 19.478 
                 1.00 
                 49.14 
                 C 
               
               
                 ATOM 
                 357 
                 CD 
                 GLU 
                 A 
                 46 
                 37.665 
                 −0.129 
                 18.953 
                 1.00 
                 52.82 
                 C 
               
               
                 ATOM 
                 358 
                 OE1 
                 GLU 
                 A 
                 46 
                 36.756 
                 0.231 
                 19.743 
                 1.00 
                 53.98 
                 O 
               
               
                 ATOM 
                 359 
                 OE2 
                 GLU 
                 A 
                 46 
                 37.671 
                 0.181 
                 17.738 
                 1.00 
                 55.31 
                 O 
               
               
                 ATOM 
                 360 
                 C 
                 GLU 
                 A 
                 46 
                 40.834 
                 −1.792 
                 22.019 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 361 
                 O 
                 GLU 
                 A 
                 46 
                 40.779 
                 −1.015 
                 22.969 
                 1.00 
                 45.55 
                 O 
               
               
                 ATOM 
                 362 
                 N 
                 GLN 
                 A 
                 47 
                 41.979 
                 −2.146 
                 21.452 
                 1.00 
                 44.11 
                 N 
               
               
                 ATOM 
                 363 
                 CA 
                 GLN 
                 A 
                 47 
                 43.235 
                 −1.524 
                 21.856 
                 1.00 
                 43.28 
                 C 
               
               
                 ATOM 
                 364 
                 CB 
                 GLN 
                 A 
                 47 
                 44.246 
                 −2.584 
                 22.324 
                 1.00 
                 43.08 
                 C 
               
               
                 ATOM 
                 365 
                 CG 
                 GLN 
                 A 
                 47 
                 44.622 
                 −3.594 
                 21.239 
                 1.00 
                 44.55 
                 C 
               
               
                 ATOM 
                 366 
                 CD 
                 GLN 
                 A 
                 47 
                 45.149 
                 −4.939 
                 21.765 
                 1.00 
                 45.07 
                 C 
               
               
                 ATOM 
                 367 
                 OE1 
                 GLN 
                 A 
                 47 
                 45.388 
                 −5.115 
                 22.972 
                 1.00 
                 48.41 
                 O 
               
               
                 ATOM 
                 368 
                 NE2 
                 GLN 
                 A 
                 47 
                 45.326 
                 −5.899 
                 20.846 
                 1.00 
                 45.13 
                 N 
               
               
                 ATOM 
                 369 
                 C 
                 GLN 
                 A 
                 47 
                 43.764 
                 −0.656 
                 20.703 
                 1.00 
                 41.76 
                 C 
               
               
                 ATOM 
                 370 
                 O 
                 GLN 
                 A 
                 47 
                 43.516 
                 −0.952 
                 19.538 
                 1.00 
                 41.19 
                 O 
               
               
                 ATOM 
                 371 
                 N 
                 LYS 
                 A 
                 48 
                 44.446 
                 0.438 
                 21.035 
                 1.00 
                 40.40 
                 N 
               
               
                 ATOM 
                 372 
                 CA 
                 LYS 
                 A 
                 48 
                 45.041 
                 1.298 
                 20.027 
                 1.00 
                 39.25 
                 C 
               
               
                 ATOM 
                 373 
                 CB 
                 LYS 
                 A 
                 48 
                 45.258 
                 2.703 
                 20.566 
                 1.00 
                 39.55 
                 C 
               
               
                 ATOM 
                 374 
                 CG 
                 LYS 
                 A 
                 48 
                 46.022 
                 3.635 
                 19.626 
                 1.00 
                 41.07 
                 C 
               
               
                 ATOM 
                 375 
                 CD 
                 LYS 
                 A 
                 48 
                 45.976 
                 5.054 
                 20.154 
                 1.00 
                 44.06 
                 C 
               
               
                 ATOM 
                 376 
                 CE 
                 LYS 
                 A 
                 48 
                 47.037 
                 5.918 
                 19.518 
                 1.00 
                 45.73 
                 C 
               
               
                 ATOM 
                 377 
                 NZ 
                 LYS 
                 A 
                 48 
                 46.515 
                 6.731 
                 18.397 
                 1.00 
                 47.48 
                 N 
               
               
                 ATOM 
                 378 
                 C 
                 LYS 
                 A 
                 48 
                 46.359 
                 0.714 
                 19.568 
                 1.00 
                 38.35 
                 C 
               
               
                 ATOM 
                 379 
                 O 
                 LYS 
                 A 
                 48 
                 47.164 
                 0.259 
                 20.380 
                 1.00 
                 37.69 
                 O 
               
               
                 ATOM 
                 380 
                 N 
                 ILE 
                 A 
                 49 
                 46.556 
                 0.722 
                 18.251 
                 1.00 
                 37.55 
                 N 
               
               
                 ATOM 
                 381 
                 CA 
                 ILE 
                 A 
                 49 
                 47.776 
                 0.228 
                 17.632 
                 1.00 
                 36.50 
                 C 
               
               
                 ATOM 
                 382 
                 CB 
                 ILE 
                 A 
                 49 
                 47.546 
                 −0.204 
                 16.169 
                 1.00 
                 36.80 
                 C 
               
               
                 ATOM 
                 383 
                 CG1 
                 ILE 
                 A 
                 49 
                 46.439 
                 −1.272 
                 16.078 
                 1.00 
                 35.88 
                 C 
               
               
                 ATOM 
                 384 
                 CD1 
                 ILE 
                 A 
                 49 
                 46.064 
                 −1.701 
                 14.656 
                 1.00 
                 35.50 
                 C 
               
               
                 ATOM 
                 385 
                 CG2 
                 ILE 
                 A 
                 49 
                 48.895 
                 −0.667 
                 15.549 
                 1.00 
                 36.79 
                 C 
               
               
                 ATOM 
                 386 
                 C 
                 ILE 
                 A 
                 49 
                 48.865 
                 1.298 
                 17.664 
                 1.00 
                 36.12 
                 C 
               
               
                 ATOM 
                 387 
                 O 
                 ILE 
                 A 
                 49 
                 48.694 
                 2.395 
                 17.125 
                 1.00 
                 36.62 
                 O 
               
               
                 ATOM 
                 388 
                 N 
                 SER 
                 A 
                 50 
                 49.977 
                 0.995 
                 18.318 
                 1.00 
                 35.10 
                 N 
               
               
                 ATOM 
                 389 
                 CA 
                 SER 
                 A 
                 50 
                 51.093 
                 1.906 
                 18.311 
                 1.00 
                 34.20 
                 C 
               
               
                 ATOM 
                 390 
                 CB 
                 SER 
                 A 
                 50 
                 51.986 
                 1.645 
                 19.515 
                 1.00 
                 33.93 
                 C 
               
               
                 ATOM 
                 391 
                 OG 
                 SER 
                 A 
                 50 
                 53.288 
                 2.161 
                 19.314 
                 1.00 
                 34.04 
                 O 
               
               
                 ATOM 
                 392 
                 C 
                 SER 
                 A 
                 50 
                 51.835 
                 1.757 
                 16.972 
                 1.00 
                 33.93 
                 C 
               
               
                 ATOM 
                 393 
                 O 
                 SER 
                 A 
                 50 
                 52.425 
                 0.706 
                 16.694 
                 1.00 
                 34.24 
                 O 
               
               
                 ATOM 
                 394 
                 N 
                 ILE 
                 A 
                 51 
                 51.770 
                 2.805 
                 16.142 
                 1.00 
                 33.13 
                 N 
               
               
                 ATOM 
                 395 
                 CA 
                 ILE 
                 A 
                 51 
                 52.425 
                 2.857 
                 14.825 
                 1.00 
                 32.31 
                 C 
               
               
                 ATOM 
                 396 
                 CB 
                 ILE 
                 A 
                 51 
                 51.963 
                 4.106 
                 14.044 
                 1.00 
                 32.15 
                 C 
               
               
                 ATOM 
                 397 
                 CG1 
                 ILE 
                 A 
                 51 
                 50.426 
                 4.185 
                 13.996 
                 1.00 
                 31.76 
                 C 
               
               
                 ATOM 
                 398 
                 CD1 
                 ILE 
                 A 
                 51 
                 49.747 
                 3.145 
                 13.130 
                 1.00 
                 32.12 
                 C 
               
               
                 ATOM 
                 399 
                 CG2 
                 ILE 
                 A 
                 51 
                 52.599 
                 4.194 
                 12.654 
                 1.00 
                 31.09 
                 C 
               
               
                 ATOM 
                 400 
                 C 
                 ILE 
                 A 
                 51 
                 53.954 
                 2.829 
                 14.912 
                 1.00 
                 32.65 
                 C 
               
               
                 ATOM 
                 401 
                 O 
                 ILE 
                 A 
                 51 
                 54.564 
                 3.433 
                 15.791 
                 1.00 
                 32.80 
                 O 
               
               
                 ATOM 
                 402 
                 N 
                 GLY 
                 A 
                 52 
                 54.567 
                 2.124 
                 13.976 
                 1.00 
                 33.09 
                 N 
               
               
                 ATOM 
                 403 
                 CA 
                 GLY 
                 A 
                 52 
                 56.002 
                 1.887 
                 13.991 
                 1.00 
                 33.42 
                 C 
               
               
                 ATOM 
                 404 
                 C 
                 GLY 
                 A 
                 52 
                 56.221 
                 0.399 
                 13.838 
                 1.00 
                 33.74 
                 C 
               
               
                 ATOM 
                 405 
                 O 
                 GLY 
                 A 
                 52 
                 55.305 
                 −0.393 
                 14.056 
                 1.00 
                 33.66 
                 O 
               
               
                 ATOM 
                 406 
                 N 
                 GLY 
                 A 
                 53 
                 57.432 
                 0.015 
                 13.460 
                 1.00 
                 34.29 
                 N 
               
               
                 ATOM 
                 407 
                 CA 
                 GLY 
                 A 
                 53 
                 57.763 
                 −1.397 
                 13.322 
                 1.00 
                 35.04 
                 C 
               
               
                 ATOM 
                 408 
                 C 
                 GLY 
                 A 
                 53 
                 56.957 
                 −1.991 
                 12.195 
                 1.00 
                 35.46 
                 C 
               
               
                 ATOM 
                 409 
                 O 
                 GLY 
                 A 
                 53 
                 56.982 
                 −1.476 
                 11.080 
                 1.00 
                 35.74 
                 O 
               
               
                 ATOM 
                 410 
                 N 
                 ARG 
                 A 
                 54 
                 56.213 
                 −3.050 
                 12.490 
                 1.00 
                 35.90 
                 N 
               
               
                 ATOM 
                 411 
                 CA 
                 ARG 
                 A 
                 54 
                 55.433 
                 −3.725 
                 11.461 
                 1.00 
                 36.34 
                 C 
               
               
                 ATOM 
                 412 
                 CB 
                 ARG 
                 A 
                 54 
                 55.022 
                 −5.121 
                 11.923 
                 1.00 
                 36.49 
                 C 
               
               
                 ATOM 
                 413 
                 CG 
                 ARG 
                 A 
                 54 
                 54.076 
                 −5.157 
                 13.113 
                 1.00 
                 37.52 
                 C 
               
               
                 ATOM 
                 414 
                 CD 
                 ARG 
                 A 
                 54 
                 53.998 
                 −6.557 
                 13.716 
                 1.00 
                 40.03 
                 C 
               
               
                 ATOM 
                 415 
                 NE 
                 ARG 
                 A 
                 54 
                 53.427 
                 −7.539 
                 12.792 
                 1.00 
                 41.16 
                 N 
               
               
                 ATOM 
                 416 
                 CZ 
                 ARG 
                 A 
                 54 
                 52.182 
                 −8.028 
                 12.856 
                 1.00 
                 42.21 
                 C 
               
               
                 ATOM 
                 417 
                 NH1 
                 ARG 
                 A 
                 54 
                 51.329 
                 −7.666 
                 13.819 
                 1.00 
                 40.89 
                 N 
               
               
                 ATOM 
                 418 
                 NH2 
                 ARG 
                 A 
                 54 
                 51.795 
                 −8.918 
                 11.953 
                 1.00 
                 42.90 
                 N 
               
               
                 ATOM 
                 419 
                 C 
                 ARG 
                 A 
                 54 
                 54.217 
                 −2.927 
                 10.989 
                 1.00 
                 36.53 
                 C 
               
               
                 ATOM 
                 420 
                 O 
                 ARG 
                 A 
                 54 
                 53.644 
                 −3.246 
                 9.948 
                 1.00 
                 36.70 
                 O 
               
               
                 ATOM 
                 421 
                 N 
                 TYR 
                 A 
                 55 
                 53.822 
                 −1.902 
                 11.747 
                 1.00 
                 36.80 
                 N 
               
               
                 ATOM 
                 422 
                 CA 
                 TYR 
                 A 
                 55 
                 52.639 
                 −1.088 
                 11.404 
                 1.00 
                 37.20 
                 C 
               
               
                 ATOM 
                 423 
                 CB 
                 TYR 
                 A 
                 55 
                 51.798 
                 −0.746 
                 12.635 
                 1.00 
                 37.76 
                 C 
               
               
                 ATOM 
                 424 
                 CG 
                 TYR 
                 A 
                 55 
                 51.512 
                 −1.949 
                 13.486 
                 1.00 
                 38.65 
                 C 
               
               
                 ATOM 
                 425 
                 CD1 
                 TYR 
                 A 
                 55 
                 50.408 
                 −2.756 
                 13.232 
                 1.00 
                 39.27 
                 C 
               
               
                 ATOM 
                 426 
                 CE1 
                 TYR 
                 A 
                 55 
                 50.159 
                 −3.879 
                 14.009 
                 1.00 
                 40.17 
                 C 
               
               
                 ATOM 
                 427 
                 CZ 
                 TYR 
                 A 
                 55 
                 51.043 
                 −4.206 
                 15.042 
                 1.00 
                 39.69 
                 C 
               
               
                 ATOM 
                 428 
                 OH 
                 TYR 
                 A 
                 55 
                 50.821 
                 −5.328 
                 15.824 
                 1.00 
                 40.19 
                 O 
               
               
                 ATOM 
                 429 
                 CE2 
                 TYR 
                 A 
                 55 
                 52.150 
                 −3.421 
                 15.296 
                 1.00 
                 39.05 
                 C 
               
               
                 ATOM 
                 430 
                 CD2 
                 TYR 
                 A 
                 55 
                 52.375 
                 −2.302 
                 14.528 
                 1.00 
                 38.92 
                 C 
               
               
                 ATOM 
                 431 
                 C 
                 TYR 
                 A 
                 55 
                 53.092 
                 0.188 
                 10.765 
                 1.00 
                 36.81 
                 C 
               
               
                 ATOM 
                 432 
                 O 
                 TYR 
                 A 
                 55 
                 53.922 
                 0.898 
                 11.327 
                 1.00 
                 36.76 
                 O 
               
               
                 ATOM 
                 433 
                 N 
                 VAL 
                 A 
                 56 
                 52.554 
                 0.483 
                 9.586 
                 1.00 
                 36.40 
                 N 
               
               
                 ATOM 
                 434 
                 CA 
                 VAL 
                 A 
                 56 
                 52.999 
                 1.679 
                 8.866 
                 1.00 
                 35.90 
                 C 
               
               
                 ATOM 
                 435 
                 CB 
                 VAL 
                 A 
                 56 
                 54.262 
                 1.420 
                 7.938 
                 1.00 
                 35.20 
                 C 
               
               
                 ATOM 
                 436 
                 CG1 
                 VAL 
                 A 
                 56 
                 54.243 
                 0.050 
                 7.360 
                 1.00 
                 35.04 
                 C 
               
               
                 ATOM 
                 437 
                 CG2 
                 VAL 
                 A 
                 56 
                 54.393 
                 2.462 
                 6.867 
                 1.00 
                 34.11 
                 C 
               
               
                 ATOM 
                 438 
                 C 
                 VAL 
                 A 
                 56 
                 51.859 
                 2.475 
                 8.230 
                 1.00 
                 35.61 
                 C 
               
               
                 ATOM 
                 439 
                 O 
                 VAL 
                 A 
                 56 
                 51.327 
                 2.092 
                 7.216 
                 1.00 
                 36.11 
                 O 
               
               
                 ATOM 
                 440 
                 N 
                 GLU 
                 A 
                 57 
                 51.515 
                 3.588 
                 8.863 
                 1.00 
                 35.55 
                 N 
               
               
                 ATOM 
                 441 
                 CA 
                 GLU 
                 A 
                 57 
                 50.453 
                 4.475 
                 8.427 
                 1.00 
                 35.99 
                 C 
               
               
                 ATOM 
                 442 
                 CB 
                 GLU 
                 A 
                 57 
                 49.955 
                 5.271 
                 9.617 
                 1.00 
                 36.06 
                 C 
               
               
                 ATOM 
                 443 
                 CG 
                 GLU 
                 A 
                 57 
                 48.594 
                 5.851 
                 9.404 
                 1.00 
                 36.87 
                 C 
               
               
                 ATOM 
                 444 
                 CD 
                 GLU 
                 A 
                 57 
                 48.199 
                 6.813 
                 10.501 
                 1.00 
                 38.36 
                 C 
               
               
                 ATOM 
                 445 
                 OE1 
                 GLU 
                 A 
                 57 
                 49.107 
                 7.427 
                 11.114 
                 1.00 
                 37.22 
                 O 
               
               
                 ATOM 
                 446 
                 OE2 
                 GLU 
                 A 
                 57 
                 46.970 
                 6.965 
                 10.720 
                 1.00 
                 39.11 
                 O 
               
               
                 ATOM 
                 447 
                 C 
                 GLU 
                 A 
                 57 
                 50.892 
                 5.463 
                 7.363 
                 1.00 
                 36.29 
                 C 
               
               
                 ATOM 
                 448 
                 O 
                 GLU 
                 A 
                 57 
                 51.989 
                 6.024 
                 7.424 
                 1.00 
                 36.57 
                 O 
               
               
                 ATOM 
                 449 
                 N 
                 THR 
                 A 
                 58 
                 50.011 
                 5.701 
                 6.404 
                 1.00 
                 36.94 
                 N 
               
               
                 ATOM 
                 450 
                 CA 
                 THR 
                 A 
                 58 
                 50.256 
                 6.677 
                 5.354 
                 1.00 
                 38.04 
                 C 
               
               
                 ATOM 
                 451 
                 CB 
                 THR 
                 A 
                 58 
                 50.400 
                 5.991 
                 3.978 
                 1.00 
                 38.06 
                 C 
               
               
                 ATOM 
                 452 
                 OG1 
                 THR 
                 A 
                 58 
                 51.539 
                 5.115 
                 4.017 
                 1.00 
                 38.61 
                 O 
               
               
                 ATOM 
                 453 
                 CG2 
                 THR 
                 A 
                 58 
                 50.600 
                 7.016 
                 2.871 
                 1.00 
                 37.85 
                 C 
               
               
                 ATOM 
                 454 
                 C 
                 THR 
                 A 
                 58 
                 49.101 
                 7.656 
                 5.367 
                 1.00 
                 38.73 
                 C 
               
               
                 ATOM 
                 455 
                 O 
                 THR 
                 A 
                 58 
                 47.935 
                 7.256 
                 5.228 
                 1.00 
                 39.47 
                 O 
               
               
                 ATOM 
                 456 
                 N 
                 VAL 
                 A 
                 59 
                 49.412 
                 8.936 
                 5.581 
                 1.00 
                 39.11 
                 N 
               
               
                 ATOM 
                 457 
                 CA 
                 VAL 
                 A 
                 59 
                 48.358 
                 9.934 
                 5.774 
                 1.00 
                 38.99 
                 C 
               
               
                 ATOM 
                 458 
                 CB 
                 VAL 
                 A 
                 59 
                 48.384 
                 10.521 
                 7.203 
                 1.00 
                 39.19 
                 C 
               
               
                 ATOM 
                 459 
                 CG1 
                 VAL 
                 A 
                 59 
                 47.438 
                 11.723 
                 7.355 
                 1.00 
                 38.40 
                 C 
               
               
                 ATOM 
                 460 
                 CG2 
                 VAL 
                 A 
                 59 
                 48.013 
                 9.435 
                 8.204 
                 1.00 
                 39.01 
                 C 
               
               
                 ATOM 
                 461 
                 C 
                 VAL 
                 A 
                 59 
                 48.441 
                 10.994 
                 4.704 
                 1.00 
                 39.04 
                 C 
               
               
                 ATOM 
                 462 
                 O 
                 VAL 
                 A 
                 59 
                 49.527 
                 11.445 
                 4.368 
                 1.00 
                 39.20 
                 O 
               
               
                 ATOM 
                 463 
                 N 
                 ASN 
                 A 
                 60 
                 47.288 
                 11.329 
                 4.123 
                 1.00 
                 39.25 
                 N 
               
               
                 ATOM 
                 464 
                 CA 
                 ASN 
                 A 
                 60 
                 47.167 
                 12.432 
                 3.159 
                 1.00 
                 38.89 
                 C 
               
               
                 ATOM 
                 465 
                 CB 
                 ASN 
                 A 
                 60 
                 46.856 
                 11.903 
                 1.766 
                 1.00 
                 38.66 
                 C 
               
               
                 ATOM 
                 466 
                 CG 
                 ASN 
                 A 
                 60 
                 46.808 
                 13.004 
                 0.716 
                 1.00 
                 39.92 
                 C 
               
               
                 ATOM 
                 467 
                 OD1 
                 ASN 
                 A 
                 60 
                 46.683 
                 14.195 
                 1.023 
                 1.00 
                 40.70 
                 O 
               
               
                 ATOM 
                 468 
                 ND2 
                 ASN 
                 A 
                 60 
                 46.898 
                 12.602 
                 −0.542 
                 1.00 
                 41.09 
                 N 
               
               
                 ATOM 
                 469 
                 C 
                 ASN 
                 A 
                 60 
                 46.088 
                 13.417 
                 3.620 
                 1.00 
                 38.71 
                 C 
               
               
                 ATOM 
                 470 
                 O 
                 ASN 
                 A 
                 60 
                 44.905 
                 13.256 
                 3.309 
                 1.00 
                 38.65 
                 O 
               
               
                 ATOM 
                 471 
                 N 
                 LYS 
                 A 
                 61 
                 46.514 
                 14.431 
                 4.370 
                 1.00 
                 38.57 
                 N 
               
               
                 ATOM 
                 472 
                 CA 
                 LYS 
                 A 
                 61 
                 45.602 
                 15.383 
                 4.996 
                 1.00 
                 38.16 
                 C 
               
               
                 ATOM 
                 473 
                 CB 
                 LYS 
                 A 
                 61 
                 46.355 
                 16.271 
                 5.980 
                 1.00 
                 37.56 
                 C 
               
               
                 ATOM 
                 474 
                 CG 
                 LYS 
                 A 
                 61 
                 46.886 
                 15.543 
                 7.172 
                 1.00 
                 35.28 
                 C 
               
               
                 ATOM 
                 475 
                 CD 
                 LYS 
                 A 
                 61 
                 47.561 
                 16.502 
                 8.098 
                 1.00 
                 32.88 
                 C 
               
               
                 ATOM 
                 476 
                 CE 
                 LYS 
                 A 
                 61 
                 47.572 
                 15.971 
                 9.495 
                 1.00 
                 31.84 
                 C 
               
               
                 ATOM 
                 477 
                 NZ 
                 LYS 
                 A 
                 61 
                 48.779 
                 16.466 
                 10.203 
                 1.00 
                 33.28 
                 N 
               
               
                 ATOM 
                 478 
                 C 
                 LYS 
                 A 
                 61 
                 44.841 
                 16.234 
                 3.966 
                 1.00 
                 38.90 
                 C 
               
               
                 ATOM 
                 479 
                 O 
                 LYS 
                 A 
                 61 
                 43.655 
                 16.544 
                 4.180 
                 1.00 
                 38.97 
                 O 
               
               
                 ATOM 
                 480 
                 N 
                 GLY 
                 A 
                 62 
                 45.521 
                 16.606 
                 2.869 
                 1.00 
                 39.06 
                 N 
               
               
                 ATOM 
                 481 
                 CA 
                 GLY 
                 A 
                 62 
                 44.897 
                 17.316 
                 1.742 
                 1.00 
                 39.10 
                 C 
               
               
                 ATOM 
                 482 
                 C 
                 GLY 
                 A 
                 62 
                 43.622 
                 16.614 
                 1.292 
                 1.00 
                 39.43 
                 C 
               
               
                 ATOM 
                 483 
                 O 
                 GLY 
                 A 
                 62 
                 42.535 
                 17.195 
                 1.319 
                 1.00 
                 39.28 
                 O 
               
               
                 ATOM 
                 484 
                 N 
                 SER 
                 A 
                 63 
                 43.735 
                 15.345 
                 0.914 
                 1.00 
                 39.54 
                 N 
               
               
                 ATOM 
                 485 
                 CA 
                 SER 
                 A 
                 63 
                 42.556 
                 14.614 
                 0.471 
                 1.00 
                 39.91 
                 C 
               
               
                 ATOM 
                 486 
                 CB 
                 SER 
                 A 
                 63 
                 42.924 
                 13.630 
                 −0.640 
                 1.00 
                 40.15 
                 C 
               
               
                 ATOM 
                 487 
                 OG 
                 SER 
                 A 
                 63 
                 43.499 
                 12.450 
                 −0.115 
                 1.00 
                 40.82 
                 O 
               
               
                 ATOM 
                 488 
                 C 
                 SER 
                 A 
                 63 
                 41.827 
                 13.907 
                 1.618 
                 1.00 
                 39.94 
                 C 
               
               
                 ATOM 
                 489 
                 O 
                 SER 
                 A 
                 63 
                 40.885 
                 13.162 
                 1.382 
                 1.00 
                 39.93 
                 O 
               
               
                 ATOM 
                 490 
                 N 
                 LYS 
                 A 
                 64 
                 42.260 
                 14.157 
                 2.853 
                 1.00 
                 39.99 
                 N 
               
               
                 ATOM 
                 491 
                 CA 
                 LYS 
                 A 
                 64 
                 41.631 
                 13.589 
                 4.054 
                 1.00 
                 40.06 
                 C 
               
               
                 ATOM 
                 492 
                 CB 
                 LYS 
                 A 
                 64 
                 40.267 
                 14.231 
                 4.317 
                 1.00 
                 39.53 
                 C 
               
               
                 ATOM 
                 493 
                 CG 
                 LYS 
                 A 
                 64 
                 40.306 
                 15.555 
                 5.036 
                 1.00 
                 38.57 
                 C 
               
               
                 ATOM 
                 494 
                 CD 
                 LYS 
                 A 
                 64 
                 39.285 
                 16.496 
                 4.420 
                 1.00 
                 38.14 
                 C 
               
               
                 ATOM 
                 495 
                 CE 
                 LYS 
                 A 
                 64 
                 38.478 
                 17.277 
                 5.453 
                 1.00 
                 37.99 
                 C 
               
               
                 ATOM 
                 496 
                 NZ 
                 LYS 
                 A 
                 64 
                 38.684 
                 18.747 
                 5.347 
                 1.00 
                 38.34 
                 N 
               
               
                 ATOM 
                 497 
                 C 
                 LYS 
                 A 
                 64 
                 41.506 
                 12.060 
                 4.015 
                 1.00 
                 40.63 
                 C 
               
               
                 ATOM 
                 498 
                 O 
                 LYS 
                 A 
                 64 
                 40.515 
                 11.491 
                 4.507 
                 1.00 
                 40.91 
                 O 
               
               
                 ATOM 
                 499 
                 N 
                 SER 
                 A 
                 65 
                 42.507 
                 11.399 
                 3.439 
                 1.00 
                 40.85 
                 N 
               
               
                 ATOM 
                 500 
                 CA 
                 SER 
                 A 
                 65 
                 42.524 
                 9.940 
                 3.393 
                 1.00 
                 41.61 
                 C 
               
               
                 ATOM 
                 501 
                 CB 
                 SER 
                 A 
                 65 
                 42.351 
                 9.465 
                 1.974 
                 1.00 
                 41.33 
                 C 
               
               
                 ATOM 
                 502 
                 OG 
                 SER 
                 A 
                 65 
                 43.517 
                 9.807 
                 1.261 
                 1.00 
                 42.19 
                 O 
               
               
                 ATOM 
                 503 
                 C 
                 SER 
                 A 
                 65 
                 43.839 
                 9.391 
                 3.938 
                 1.00 
                 42.06 
                 C 
               
               
                 ATOM 
                 504 
                 O 
                 SER 
                 A 
                 65 
                 44.880 
                 10.055 
                 3.886 
                 1.00 
                 42.51 
                 O 
               
               
                 ATOM 
                 505 
                 N 
                 PHE 
                 A 
                 66 
                 43.797 
                 8.164 
                 4.438 
                 1.00 
                 42.21 
                 N 
               
               
                 ATOM 
                 506 
                 CA 
                 PHE 
                 A 
                 66 
                 44.934 
                 7.603 
                 5.135 
                 1.00 
                 42.56 
                 C 
               
               
                 ATOM 
                 507 
                 CB 
                 PHE 
                 A 
                 66 
                 45.006 
                 8.173 
                 6.554 
                 1.00 
                 42.69 
                 C 
               
               
                 ATOM 
                 508 
                 CG 
                 PHE 
                 A 
                 66 
                 43.749 
                 7.977 
                 7.340 
                 1.00 
                 43.57 
                 C 
               
               
                 ATOM 
                 509 
                 CD1 
                 PHE 
                 A 
                 66 
                 43.747 
                 7.183 
                 8.488 
                 1.00 
                 45.35 
                 C 
               
               
                 ATOM 
                 510 
                 CE1 
                 PHE 
                 A 
                 66 
                 42.560 
                 6.982 
                 9.215 
                 1.00 
                 45.15 
                 C 
               
               
                 ATOM 
                 511 
                 CZ 
                 PHE 
                 A 
                 66 
                 41.365 
                 7.585 
                 8.792 
                 1.00 
                 44.06 
                 C 
               
               
                 ATOM 
                 512 
                 CE2 
                 PHE 
                 A 
                 66 
                 41.364 
                 8.380 
                 7.656 
                 1.00 
                 43.63 
                 C 
               
               
                 ATOM 
                 513 
                 CD2 
                 PHE 
                 A 
                 66 
                 42.554 
                 8.569 
                 6.935 
                 1.00 
                 44.35 
                 C 
               
               
                 ATOM 
                 514 
                 C 
                 PHE 
                 A 
                 66 
                 44.757 
                 6.106 
                 5.157 
                 1.00 
                 42.46 
                 C 
               
               
                 ATOM 
                 515 
                 O 
                 PHE 
                 A 
                 66 
                 43.636 
                 5.617 
                 5.036 
                 1.00 
                 42.37 
                 O 
               
               
                 ATOM 
                 516 
                 N 
                 SER 
                 A 
                 67 
                 45.859 
                 5.381 
                 5.301 
                 1.00 
                 42.29 
                 N 
               
               
                 ATOM 
                 517 
                 CA 
                 SER 
                 A 
                 67 
                 45.826 
                 3.926 
                 5.227 
                 1.00 
                 42.43 
                 C 
               
               
                 ATOM 
                 518 
                 CB 
                 SER 
                 A 
                 67 
                 46.278 
                 3.454 
                 3.846 
                 1.00 
                 42.23 
                 C 
               
               
                 ATOM 
                 519 
                 OG 
                 SER 
                 A 
                 67 
                 47.595 
                 3.886 
                 3.538 
                 1.00 
                 42.43 
                 O 
               
               
                 ATOM 
                 520 
                 C 
                 SER 
                 A 
                 67 
                 46.708 
                 3.319 
                 6.301 
                 1.00 
                 42.62 
                 C 
               
               
                 ATOM 
                 521 
                 O 
                 SER 
                 A 
                 67 
                 47.547 
                 4.022 
                 6.869 
                 1.00 
                 43.30 
                 O 
               
               
                 ATOM 
                 522 
                 N 
                 LEU 
                 A 
                 68 
                 46.503 
                 2.032 
                 6.599 
                 1.00 
                 42.30 
                 N 
               
               
                 ATOM 
                 523 
                 CA 
                 LEU 
                 A 
                 68 
                 47.421 
                 1.276 
                 7.460 
                 1.00 
                 41.69 
                 C 
               
               
                 ATOM 
                 524 
                 CB 
                 LEU 
                 A 
                 68 
                 46.731 
                 0.905 
                 8.771 
                 1.00 
                 42.08 
                 C 
               
               
                 ATOM 
                 525 
                 CG 
                 LEU 
                 A 
                 68 
                 47.490 
                 0.038 
                 9.789 
                 1.00 
                 41.64 
                 C 
               
               
                 ATOM 
                 526 
                 CD1 
                 LEU 
                 A 
                 68 
                 48.609 
                 0.829 
                 10.433 
                 1.00 
                 40.86 
                 C 
               
               
                 ATOM 
                 527 
                 CD2 
                 LEU 
                 A 
                 68 
                 46.532 
                 −0.537 
                 10.837 
                 1.00 
                 40.59 
                 C 
               
               
                 ATOM 
                 528 
                 C 
                 LEU 
                 A 
                 68 
                 47.899 
                 0.010 
                 6.766 
                 1.00 
                 41.78 
                 C 
               
               
                 ATOM 
                 529 
                 O 
                 LEU 
                 A 
                 68 
                 47.109 
                 −0.693 
                 6.130 
                 1.00 
                 41.90 
                 O 
               
               
                 ATOM 
                 530 
                 N 
                 ARG 
                 A 
                 69 
                 49.188 
                 −0.286 
                 6.892 
                 1.00 
                 41.68 
                 N 
               
               
                 ATOM 
                 531 
                 CA 
                 ARG 
                 A 
                 69 
                 49.758 
                 −1.526 
                 6.355 
                 1.00 
                 41.58 
                 C 
               
               
                 ATOM 
                 532 
                 CB 
                 ARG 
                 A 
                 69 
                 50.780 
                 −1.257 
                 5.265 
                 1.00 
                 41.79 
                 C 
               
               
                 ATOM 
                 533 
                 CG 
                 ARG 
                 A 
                 69 
                 50.930 
                 −2.417 
                 4.305 
                 1.00 
                 44.13 
                 C 
               
               
                 ATOM 
                 534 
                 CD 
                 ARG 
                 A 
                 69 
                 51.683 
                 −2.018 
                 3.041 
                 1.00 
                 48.20 
                 C 
               
               
                 ATOM 
                 535 
                 NE 
                 ARG 
                 A 
                 69 
                 53.069 
                 −2.481 
                 3.086 
                 1.00 
                 52.28 
                 N 
               
               
                 ATOM 
                 536 
                 CZ 
                 ARG 
                 A 
                 69 
                 54.101 
                 −1.792 
                 3.584 
                 1.00 
                 54.41 
                 C 
               
               
                 ATOM 
                 537 
                 NH1 
                 ARG 
                 A 
                 69 
                 55.322 
                 −2.331 
                 3.571 
                 1.00 
                 55.41 
                 N 
               
               
                 ATOM 
                 538 
                 NH2 
                 ARG 
                 A 
                 69 
                 53.933 
                 −0.569 
                 4.083 
                 1.00 
                 54.08 
                 N 
               
               
                 ATOM 
                 539 
                 C 
                 ARG 
                 A 
                 69 
                 50.410 
                 −2.320 
                 7.458 
                 1.00 
                 41.10 
                 C 
               
               
                 ATOM 
                 540 
                 O 
                 ARG 
                 A 
                 69 
                 51.175 
                 −1.776 
                 8.258 
                 1.00 
                 41.13 
                 O 
               
               
                 ATOM 
                 541 
                 N 
                 ILE 
                 A 
                 70 
                 50.092 
                 −3.610 
                 7.501 
                 1.00 
                 40.76 
                 N 
               
               
                 ATOM 
                 542 
                 CA 
                 ILE 
                 A 
                 70 
                 50.601 
                 −4.510 
                 8.535 
                 1.00 
                 39.88 
                 C 
               
               
                 ATOM 
                 543 
                 CB 
                 ILE 
                 A 
                 70 
                 49.453 
                 −5.222 
                 9.325 
                 1.00 
                 39.36 
                 C 
               
               
                 ATOM 
                 544 
                 CG1 
                 ILE 
                 A 
                 70 
                 48.347 
                 −4.228 
                 9.728 
                 1.00 
                 37.87 
                 C 
               
               
                 ATOM 
                 545 
                 CD1 
                 ILE 
                 A 
                 70 
                 47.792 
                 −4.439 
                 11.089 
                 1.00 
                 35.40 
                 C 
               
               
                 ATOM 
                 546 
                 CG2 
                 ILE 
                 A 
                 70 
                 50.006 
                 −5.964 
                 10.520 
                 1.00 
                 38.83 
                 C 
               
               
                 ATOM 
                 547 
                 C 
                 ILE 
                 A 
                 70 
                 51.449 
                 −5.521 
                 7.808 
                 1.00 
                 40.36 
                 C 
               
               
                 ATOM 
                 548 
                 O 
                 ILE 
                 A 
                 70 
                 50.957 
                 −6.225 
                 6.941 
                 1.00 
                 40.44 
                 O 
               
               
                 ATOM 
                 549 
                 N 
                 ARG 
                 A 
                 71 
                 52.733 
                 −5.552 
                 8.130 
                 1.00 
                 41.10 
                 N 
               
               
                 ATOM 
                 550 
                 CA 
                 ARG 
                 A 
                 71 
                 53.666 
                 −6.476 
                 7.528 
                 1.00 
                 41.96 
                 C 
               
               
                 ATOM 
                 551 
                 CB 
                 ARG 
                 A 
                 71 
                 55.068 
                 −5.884 
                 7.626 
                 1.00 
                 42.48 
                 C 
               
               
                 ATOM 
                 552 
                 CG 
                 ARG 
                 A 
                 71 
                 56.093 
                 −6.426 
                 6.622 
                 1.00 
                 46.49 
                 C 
               
               
                 ATOM 
                 553 
                 CD 
                 ARG 
                 A 
                 71 
                 56.065 
                 −5.651 
                 5.276 
                 1.00 
                 52.49 
                 C 
               
               
                 ATOM 
                 554 
                 NE 
                 ARG 
                 A 
                 71 
                 57.001 
                 −6.185 
                 4.271 
                 1.00 
                 55.71 
                 N 
               
               
                 ATOM 
                 555 
                 CZ 
                 ARG 
                 A 
                 71 
                 57.090 
                 −5.751 
                 3.010 
                 1.00 
                 57.32 
                 C 
               
               
                 ATOM 
                 556 
                 NH1 
                 ARG 
                 A 
                 71 
                 56.295 
                 −4.773 
                 2.577 
                 1.00 
                 58.00 
                 N 
               
               
                 ATOM 
                 557 
                 NH2 
                 ARG 
                 A 
                 71 
                 57.975 
                 −6.293 
                 2.177 
                 1.00 
                 57.14 
                 N 
               
               
                 ATOM 
                 558 
                 C 
                 ARG 
                 A 
                 71 
                 53.606 
                 −7.790 
                 8.309 
                 1.00 
                 42.06 
                 C 
               
               
                 ATOM 
                 559 
                 O 
                 ARG 
                 A 
                 71 
                 53.359 
                 −7.772 
                 9.522 
                 1.00 
                 41.88 
                 O 
               
               
                 ATOM 
                 560 
                 N 
                 ASP 
                 A 
                 72 
                 53.816 
                 −8.917 
                 7.615 
                 1.00 
                 42.18 
                 N 
               
               
                 ATOM 
                 561 
                 CA 
                 ASP 
                 A 
                 72 
                 53.979 
                 −10.243 
                 8.237 
                 1.00 
                 42.19 
                 C 
               
               
                 ATOM 
                 562 
                 CB 
                 ASP 
                 A 
                 72 
                 55.119 
                 −10.225 
                 9.257 
                 1.00 
                 42.61 
                 C 
               
               
                 ATOM 
                 563 
                 CG 
                 ASP 
                 A 
                 72 
                 56.476 
                 −10.361 
                 8.625 
                 1.00 
                 44.47 
                 C 
               
               
                 ATOM 
                 564 
                 OD1 
                 ASP 
                 A 
                 72 
                 57.153 
                 −11.381 
                 8.916 
                 1.00 
                 45.25 
                 O 
               
               
                 ATOM 
                 565 
                 OD2 
                 ASP 
                 A 
                 72 
                 56.867 
                 −9.447 
                 7.850 
                 1.00 
                 46.70 
                 O 
               
               
                 ATOM 
                 566 
                 C 
                 ASP 
                 A 
                 72 
                 52.756 
                 −10.734 
                 8.969 
                 1.00 
                 41.93 
                 C 
               
               
                 ATOM 
                 567 
                 O 
                 ASP 
                 A 
                 72 
                 52.819 
                 −10.966 
                 10.178 
                 1.00 
                 41.95 
                 O 
               
               
                 ATOM 
                 568 
                 N 
                 LEU 
                 A 
                 73 
                 51.645 
                 −10.913 
                 8.268 
                 1.00 
                 41.73 
                 N 
               
               
                 ATOM 
                 569 
                 CA 
                 LEU 
                 A 
                 73 
                 50.422 
                 −11.332 
                 8.954 
                 1.00 
                 41.47 
                 C 
               
               
                 ATOM 
                 570 
                 CB 
                 LEU 
                 A 
                 73 
                 49.222 
                 −11.373 
                 8.010 
                 1.00 
                 41.11 
                 C 
               
               
                 ATOM 
                 571 
                 CG 
                 LEU 
                 A 
                 73 
                 48.727 
                 −9.994 
                 7.567 
                 1.00 
                 40.12 
                 C 
               
               
                 ATOM 
                 572 
                 CD1 
                 LEU 
                 A 
                 73 
                 47.903 
                 −10.146 
                 6.326 
                 1.00 
                 40.41 
                 C 
               
               
                 ATOM 
                 573 
                 CD2 
                 LEU 
                 A 
                 73 
                 47.941 
                 −9.265 
                 8.650 
                 1.00 
                 37.17 
                 C 
               
               
                 ATOM 
                 574 
                 C 
                 LEU 
                 A 
                 73 
                 50.648 
                 −12.664 
                 9.644 
                 1.00 
                 41.62 
                 C 
               
               
                 ATOM 
                 575 
                 O 
                 LEU 
                 A 
                 73 
                 51.502 
                 −13.438 
                 9.224 
                 1.00 
                 41.48 
                 O 
               
               
                 ATOM 
                 576 
                 N 
                 ARG 
                 A 
                 74 
                 49.904 
                 −12.903 
                 10.720 
                 1.00 
                 42.02 
                 N 
               
               
                 ATOM 
                 577 
                 CA 
                 ARG 
                 A 
                 74 
                 50.122 
                 −14.067 
                 11.589 
                 1.00 
                 42.54 
                 C 
               
               
                 ATOM 
                 578 
                 CB 
                 ARG 
                 A 
                 74 
                 51.235 
                 −13.788 
                 12.614 
                 1.00 
                 42.53 
                 C 
               
               
                 ATOM 
                 579 
                 CG 
                 ARG 
                 A 
                 74 
                 51.179 
                 −12.388 
                 13.256 
                 1.00 
                 43.61 
                 C 
               
               
                 ATOM 
                 580 
                 CD 
                 ARG 
                 A 
                 74 
                 52.125 
                 −12.257 
                 14.459 
                 1.00 
                 43.83 
                 C 
               
               
                 ATOM 
                 581 
                 NE 
                 ARG 
                 A 
                 74 
                 53.394 
                 −11.580 
                 14.167 
                 1.00 
                 46.03 
                 N 
               
               
                 ATOM 
                 582 
                 CZ 
                 ARG 
                 A 
                 74 
                 53.748 
                 −10.386 
                 14.649 
                 1.00 
                 46.33 
                 C 
               
               
                 ATOM 
                 583 
                 NH1 
                 ARG 
                 A 
                 74 
                 52.936 
                 −9.706 
                 15.457 
                 1.00 
                 45.42 
                 N 
               
               
                 ATOM 
                 584 
                 NH2 
                 ARG 
                 A 
                 74 
                 54.924 
                 −9.870 
                 14.317 
                 1.00 
                 46.76 
                 N 
               
               
                 ATOM 
                 585 
                 C 
                 ARG 
                 A 
                 74 
                 48.833 
                 −14.489 
                 12.290 
                 1.00 
                 42.15 
                 C 
               
               
                 ATOM 
                 586 
                 O 
                 ARG 
                 A 
                 74 
                 47.851 
                 −13.742 
                 12.296 
                 1.00 
                 42.15 
                 O 
               
               
                 ATOM 
                 587 
                 N 
                 VAL 
                 A 
                 75 
                 48.839 
                 −15.691 
                 12.863 
                 1.00 
                 41.96 
                 N 
               
               
                 ATOM 
                 588 
                 CA 
                 VAL 
                 A 
                 75 
                 47.655 
                 −16.259 
                 13.526 
                 1.00 
                 41.57 
                 C 
               
               
                 ATOM 
                 589 
                 CB 
                 VAL 
                 A 
                 75 
                 48.010 
                 −17.568 
                 14.298 
                 1.00 
                 41.47 
                 C 
               
               
                 ATOM 
                 590 
                 CG1 
                 VAL 
                 A 
                 75 
                 46.806 
                 −18.116 
                 15.058 
                 1.00 
                 41.34 
                 C 
               
               
                 ATOM 
                 591 
                 CG2 
                 VAL 
                 A 
                 75 
                 48.559 
                 −18.619 
                 13.334 
                 1.00 
                 41.54 
                 C 
               
               
                 ATOM 
                 592 
                 C 
                 VAL 
                 A 
                 75 
                 47.012 
                 −15.202 
                 14.444 
                 1.00 
                 41.29 
                 C 
               
               
                 ATOM 
                 593 
                 O 
                 VAL 
                 A 
                 75 
                 45.917 
                 −14.683 
                 14.150 
                 1.00 
                 41.52 
                 O 
               
               
                 ATOM 
                 594 
                 N 
                 GLU 
                 A 
                 76 
                 47.737 
                 −14.853 
                 15.509 
                 1.00 
                 40.35 
                 N 
               
               
                 ATOM 
                 595 
                 CA 
                 GLU 
                 A 
                 76 
                 47.289 
                 −13.910 
                 16.530 
                 1.00 
                 39.34 
                 C 
               
               
                 ATOM 
                 596 
                 CB 
                 GLU 
                 A 
                 76 
                 48.455 
                 −13.586 
                 17.474 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 597 
                 CG 
                 GLU 
                 A 
                 76 
                 49.647 
                 −12.919 
                 16.786 
                 1.00 
                 41.25 
                 C 
               
               
                 ATOM 
                 598 
                 CD 
                 GLU 
                 A 
                 76 
                 51.012 
                 −13.380 
                 17.305 
                 1.00 
                 43.35 
                 C 
               
               
                 ATOM 
                 599 
                 OE1 
                 GLU 
                 A 
                 76 
                 51.405 
                 −14.537 
                 17.015 
                 1.00 
                 43.69 
                 O 
               
               
                 ATOM 
                 600 
                 OE2 
                 GLU 
                 A 
                 76 
                 51.711 
                 −12.568 
                 17.962 
                 1.00 
                 43.92 
                 O 
               
               
                 ATOM 
                 601 
                 C 
                 GLU 
                 A 
                 76 
                 46.646 
                 −12.637 
                 15.963 
                 1.00 
                 38.30 
                 C 
               
               
                 ATOM 
                 602 
                 O 
                 GLU 
                 A 
                 76 
                 45.830 
                 −12.017 
                 16.631 
                 1.00 
                 38.03 
                 O 
               
               
                 ATOM 
                 603 
                 N 
                 ASP 
                 A 
                 77 
                 46.995 
                 −12.285 
                 14.725 
                 1.00 
                 37.35 
                 N 
               
               
                 ATOM 
                 604 
                 CA 
                 ASP 
                 A 
                 77 
                 46.562 
                 −11.037 
                 14.072 
                 1.00 
                 36.49 
                 C 
               
               
                 ATOM 
                 605 
                 CB 
                 ASP 
                 A 
                 77 
                 47.430 
                 −10.761 
                 12.852 
                 1.00 
                 36.49 
                 C 
               
               
                 ATOM 
                 606 
                 CG 
                 ASP 
                 A 
                 77 
                 48.581 
                 −9.848 
                 13.147 
                 1.00 
                 37.31 
                 C 
               
               
                 ATOM 
                 607 
                 OD1 
                 ASP 
                 A 
                 77 
                 48.488 
                 −9.031 
                 14.082 
                 1.00 
                 39.17 
                 O 
               
               
                 ATOM 
                 608 
                 OD2 
                 ASP 
                 A 
                 77 
                 49.587 
                 −9.934 
                 12.419 
                 1.00 
                 37.91 
                 O 
               
               
                 ATOM 
                 609 
                 C 
                 ASP 
                 A 
                 77 
                 45.104 
                 −10.946 
                 13.614 
                 1.00 
                 35.90 
                 C 
               
               
                 ATOM 
                 610 
                 O 
                 ASP 
                 A 
                 77 
                 44.686 
                 −9.903 
                 13.119 
                 1.00 
                 35.62 
                 O 
               
               
                 ATOM 
                 611 
                 N 
                 SER 
                 A 
                 78 
                 44.338 
                 −12.026 
                 13.750 
                 1.00 
                 35.37 
                 N 
               
               
                 ATOM 
                 612 
                 CA 
                 SER 
                 A 
                 78 
                 42.955 
                 −12.026 
                 13.270 
                 1.00 
                 34.66 
                 C 
               
               
                 ATOM 
                 613 
                 CB 
                 SER 
                 A 
                 78 
                 42.436 
                 −13.451 
                 13.134 
                 1.00 
                 34.45 
                 C 
               
               
                 ATOM 
                 614 
                 OG 
                 SER 
                 A 
                 78 
                 43.376 
                 −14.247 
                 12.450 
                 1.00 
                 34.25 
                 O 
               
               
                 ATOM 
                 615 
                 C 
                 SER 
                 A 
                 78 
                 42.050 
                 −11.228 
                 14.199 
                 1.00 
                 34.40 
                 C 
               
               
                 ATOM 
                 616 
                 O 
                 SER 
                 A 
                 78 
                 42.061 
                 −11.442 
                 15.412 
                 1.00 
                 34.25 
                 O 
               
               
                 ATOM 
                 617 
                 N 
                 GLY 
                 A 
                 79 
                 41.277 
                 −10.307 
                 13.625 
                 1.00 
                 34.06 
                 N 
               
               
                 ATOM 
                 618 
                 CA 
                 GLY 
                 A 
                 79 
                 40.327 
                 −9.506 
                 14.395 
                 1.00 
                 33.98 
                 C 
               
               
                 ATOM 
                 619 
                 C 
                 GLY 
                 A 
                 79 
                 39.751 
                 −8.336 
                 13.625 
                 1.00 
                 34.18 
                 C 
               
               
                 ATOM 
                 620 
                 O 
                 GLY 
                 A 
                 79 
                 39.807 
                 −8.317 
                 12.390 
                 1.00 
                 34.12 
                 O 
               
               
                 ATOM 
                 621 
                 N 
                 THR 
                 A 
                 80 
                 39.207 
                 −7.355 
                 14.354 
                 1.00 
                 34.22 
                 N 
               
               
                 ATOM 
                 622 
                 CA 
                 THR 
                 A 
                 80 
                 38.551 
                 −6.189 
                 13.742 
                 1.00 
                 34.52 
                 C 
               
               
                 ATOM 
                 623 
                 CB 
                 THR 
                 A 
                 80 
                 37.118 
                 −5.930 
                 14.301 
                 1.00 
                 34.52 
                 C 
               
               
                 ATOM 
                 624 
                 OG1 
                 THR 
                 A 
                 80 
                 36.338 
                 −7.125 
                 14.215 
                 1.00 
                 35.18 
                 O 
               
               
                 ATOM 
                 625 
                 CG2 
                 THR 
                 A 
                 80 
                 36.405 
                 −4.848 
                 13.507 
                 1.00 
                 34.49 
                 C 
               
               
                 ATOM 
                 626 
                 C 
                 THR 
                 A 
                 80 
                 39.387 
                 −4.922 
                 13.888 
                 1.00 
                 34.82 
                 C 
               
               
                 ATOM 
                 627 
                 O 
                 THR 
                 A 
                 80 
                 39.666 
                 −4.458 
                 15.003 
                 1.00 
                 35.04 
                 O 
               
               
                 ATOM 
                 628 
                 N 
                 TYR 
                 A 
                 81 
                 39.775 
                 −4.365 
                 12.750 
                 1.00 
                 34.80 
                 N 
               
               
                 ATOM 
                 629 
                 CA 
                 TYR 
                 A 
                 81 
                 40.543 
                 −3.143 
                 12.732 
                 1.00 
                 35.18 
                 C 
               
               
                 ATOM 
                 630 
                 CB 
                 TYR 
                 A 
                 81 
                 41.690 
                 −3.274 
                 11.738 
                 1.00 
                 34.34 
                 C 
               
               
                 ATOM 
                 631 
                 CG 
                 TYR 
                 A 
                 81 
                 42.654 
                 −4.335 
                 12.154 
                 1.00 
                 33.32 
                 C 
               
               
                 ATOM 
                 632 
                 CD1 
                 TYR 
                 A 
                 81 
                 43.933 
                 −4.010 
                 12.556 
                 1.00 
                 33.55 
                 C 
               
               
                 ATOM 
                 633 
                 CE1 
                 TYR 
                 A 
                 81 
                 44.822 
                 −5.002 
                 12.958 
                 1.00 
                 33.31 
                 C 
               
               
                 ATOM 
                 634 
                 CZ 
                 TYR 
                 A 
                 81 
                 44.424 
                 −6.321 
                 12.966 
                 1.00 
                 32.64 
                 C 
               
               
                 ATOM 
                 635 
                 OH 
                 TYR 
                 A 
                 81 
                 45.292 
                 −7.296 
                 13.373 
                 1.00 
                 31.77 
                 O 
               
               
                 ATOM 
                 636 
                 CE2 
                 TYR 
                 A 
                 81 
                 43.147 
                 −6.660 
                 12.586 
                 1.00 
                 32.62 
                 C 
               
               
                 ATOM 
                 637 
                 CD2 
                 TYR 
                 A 
                 81 
                 42.275 
                 −5.670 
                 12.182 
                 1.00 
                 32.26 
                 C 
               
               
                 ATOM 
                 638 
                 C 
                 TYR 
                 A 
                 81 
                 39.629 
                 −1.958 
                 12.393 
                 1.00 
                 36.14 
                 C 
               
               
                 ATOM 
                 639 
                 O 
                 TYR 
                 A 
                 81 
                 38.818 
                 −2.057 
                 11.461 
                 1.00 
                 36.07 
                 O 
               
               
                 ATOM 
                 640 
                 N 
                 LYS 
                 A 
                 82 
                 39.751 
                 −0.865 
                 13.161 
                 1.00 
                 36.60 
                 N 
               
               
                 ATOM 
                 641 
                 CA 
                 LYS 
                 A 
                 82 
                 38.958 
                 0.330 
                 12.934 
                 1.00 
                 37.79 
                 C 
               
               
                 ATOM 
                 642 
                 CB 
                 LYS 
                 A 
                 82 
                 37.866 
                 0.467 
                 13.980 
                 1.00 
                 37.18 
                 C 
               
               
                 ATOM 
                 643 
                 CG 
                 LYS 
                 A 
                 82 
                 36.568 
                 −0.098 
                 13.582 
                 1.00 
                 36.88 
                 C 
               
               
                 ATOM 
                 644 
                 CD 
                 LYS 
                 A 
                 82 
                 35.673 
                 −0.167 
                 14.774 
                 1.00 
                 37.48 
                 C 
               
               
                 ATOM 
                 645 
                 CE 
                 LYS 
                 A 
                 82 
                 34.371 
                 −0.857 
                 14.437 
                 1.00 
                 38.70 
                 C 
               
               
                 ATOM 
                 646 
                 NZ 
                 LYS 
                 A 
                 82 
                 33.540 
                 −1.153 
                 15.653 
                 1.00 
                 40.07 
                 N 
               
               
                 ATOM 
                 647 
                 C 
                 LYS 
                 A 
                 82 
                 39.830 
                 1.555 
                 12.997 
                 1.00 
                 39.37 
                 C 
               
               
                 ATOM 
                 648 
                 O 
                 LYS 
                 A 
                 82 
                 40.507 
                 1.786 
                 14.000 
                 1.00 
                 40.01 
                 O 
               
               
                 ATOM 
                 649 
                 N 
                 CYS 
                 A 
                 83 
                 39.797 
                 2.358 
                 11.936 
                 1.00 
                 41.01 
                 N 
               
               
                 ATOM 
                 650 
                 CA 
                 CYS 
                 A 
                 83 
                 40.517 
                 3.629 
                 11.915 
                 1.00 
                 42.65 
                 C 
               
               
                 ATOM 
                 651 
                 CB 
                 CYS 
                 A 
                 83 
                 40.841 
                 4.047 
                 10.473 
                 1.00 
                 43.26 
                 C 
               
               
                 ATOM 
                 652 
                 SG 
                 CYS 
                 A 
                 83 
                 39.421 
                 4.180 
                 9.326 
                 1.00 
                 47.78 
                 S 
               
               
                 ATOM 
                 653 
                 C 
                 CYS 
                 A 
                 83 
                 39.696 
                 4.707 
                 12.617 
                 1.00 
                 42.57 
                 C 
               
               
                 ATOM 
                 654 
                 O 
                 CYS 
                 A 
                 83 
                 38.468 
                 4.634 
                 12.641 
                 1.00 
                 43.03 
                 O 
               
               
                 ATOM 
                 655 
                 N 
                 GLY 
                 A 
                 84 
                 40.365 
                 5.701 
                 13.197 
                 1.00 
                 42.24 
                 N 
               
               
                 ATOM 
                 656 
                 CA 
                 GLY 
                 A 
                 84 
                 39.667 
                 6.825 
                 13.803 
                 1.00 
                 41.51 
                 C 
               
               
                 ATOM 
                 657 
                 C 
                 GLY 
                 A 
                 84 
                 40.216 
                 8.090 
                 13.221 
                 1.00 
                 41.19 
                 C 
               
               
                 ATOM 
                 658 
                 O 
                 GLY 
                 A 
                 84 
                 41.428 
                 8.307 
                 13.271 
                 1.00 
                 41.93 
                 O 
               
               
                 ATOM 
                 659 
                 N 
                 ALA 
                 A 
                 85 
                 39.338 
                 8.907 
                 12.640 
                 1.00 
                 40.68 
                 N 
               
               
                 ATOM 
                 660 
                 CA 
                 ALA 
                 A 
                 85 
                 39.721 
                 10.194 
                 12.043 
                 1.00 
                 40.26 
                 C 
               
               
                 ATOM 
                 661 
                 CB 
                 ALA 
                 A 
                 85 
                 39.171 
                 10.280 
                 10.648 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 662 
                 C 
                 ALA 
                 A 
                 85 
                 39.229 
                 11.380 
                 12.890 
                 1.00 
                 40.43 
                 C 
               
               
                 ATOM 
                 663 
                 O 
                 ALA 
                 A 
                 85 
                 38.024 
                 11.524 
                 13.095 
                 1.00 
                 40.41 
                 O 
               
               
                 ATOM 
                 664 
                 N 
                 TYR 
                 A 
                 86 
                 40.144 
                 12.217 
                 13.389 
                 1.00 
                 40.96 
                 N 
               
               
                 ATOM 
                 665 
                 CA 
                 TYR 
                 A 
                 86 
                 39.770 
                 13.398 
                 14.230 
                 1.00 
                 41.74 
                 C 
               
               
                 ATOM 
                 666 
                 CB 
                 TYR 
                 A 
                 86 
                 40.395 
                 13.287 
                 15.633 
                 1.00 
                 42.59 
                 C 
               
               
                 ATOM 
                 667 
                 CG 
                 TYR 
                 A 
                 86 
                 39.840 
                 12.049 
                 16.256 
                 1.00 
                 44.45 
                 C 
               
               
                 ATOM 
                 668 
                 CD1 
                 TYR 
                 A 
                 86 
                 40.464 
                 10.820 
                 16.075 
                 1.00 
                 46.20 
                 C 
               
               
                 ATOM 
                 669 
                 CE1 
                 TYR 
                 A 
                 86 
                 39.898 
                 9.655 
                 16.575 
                 1.00 
                 47.13 
                 C 
               
               
                 ATOM 
                 670 
                 CZ 
                 TYR 
                 A 
                 86 
                 38.677 
                 9.716 
                 17.243 
                 1.00 
                 47.00 
                 C 
               
               
                 ATOM 
                 671 
                 OH 
                 TYR 
                 A 
                 86 
                 38.110 
                 8.570 
                 17.743 
                 1.00 
                 47.11 
                 O 
               
               
                 ATOM 
                 672 
                 CE2 
                 TYR 
                 A 
                 86 
                 38.022 
                 10.920 
                 17.411 
                 1.00 
                 47.20 
                 C 
               
               
                 ATOM 
                 673 
                 CD2 
                 TYR 
                 A 
                 86 
                 38.602 
                 12.076 
                 16.903 
                 1.00 
                 46.80 
                 C 
               
               
                 ATOM 
                 674 
                 C 
                 TYR 
                 A 
                 86 
                 40.025 
                 14.730 
                 13.541 
                 1.00 
                 41.34 
                 C 
               
               
                 ATOM 
                 675 
                 O 
                 TYR 
                 A 
                 86 
                 41.040 
                 14.901 
                 12.903 
                 1.00 
                 41.73 
                 O 
               
               
                 ATOM 
                 676 
                 N 
                 PHE 
                 A 
                 87 
                 39.080 
                 15.650 
                 13.608 
                 1.00 
                 41.28 
                 N 
               
               
                 ATOM 
                 677 
                 CA 
                 PHE 
                 A 
                 87 
                 39.166 
                 16.845 
                 12.782 
                 1.00 
                 41.56 
                 C 
               
               
                 ATOM 
                 678 
                 CB 
                 PHE 
                 A 
                 87 
                 38.374 
                 16.639 
                 11.477 
                 1.00 
                 41.06 
                 C 
               
               
                 ATOM 
                 679 
                 CG 
                 PHE 
                 A 
                 87 
                 36.932 
                 16.274 
                 11.676 
                 1.00 
                 39.53 
                 C 
               
               
                 ATOM 
                 680 
                 CD1 
                 PHE 
                 A 
                 87 
                 35.947 
                 17.257 
                 11.679 
                 1.00 
                 39.73 
                 C 
               
               
                 ATOM 
                 681 
                 CE1 
                 PHE 
                 A 
                 87 
                 34.586 
                 16.931 
                 11.869 
                 1.00 
                 39.72 
                 C 
               
               
                 ATOM 
                 682 
                 CZ 
                 PHE 
                 A 
                 87 
                 34.210 
                 15.602 
                 12.037 
                 1.00 
                 39.61 
                 C 
               
               
                 ATOM 
                 683 
                 CE2 
                 PHE 
                 A 
                 87 
                 35.196 
                 14.600 
                 12.011 
                 1.00 
                 39.83 
                 C 
               
               
                 ATOM 
                 684 
                 CD2 
                 PHE 
                 A 
                 87 
                 36.550 
                 14.948 
                 11.824 
                 1.00 
                 39.38 
                 C 
               
               
                 ATOM 
                 685 
                 C 
                 PHE 
                 A 
                 87 
                 38.748 
                 18.133 
                 13.494 
                 1.00 
                 42.67 
                 C 
               
               
                 ATOM 
                 686 
                 O 
                 PHE 
                 A 
                 87 
                 37.823 
                 18.117 
                 14.298 
                 1.00 
                 42.45 
                 O 
               
               
                 ATOM 
                 687 
                 N 
                 SER 
                 A 
                 88 
                 39.422 
                 19.249 
                 13.208 
                 1.00 
                 44.36 
                 N 
               
               
                 ATOM 
                 688 
                 CA 
                 SER 
                 A 
                 88 
                 38.983 
                 20.548 
                 13.756 
                 1.00 
                 46.58 
                 C 
               
               
                 ATOM 
                 689 
                 CB 
                 SER 
                 A 
                 88 
                 39.254 
                 20.623 
                 15.262 
                 1.00 
                 46.54 
                 C 
               
               
                 ATOM 
                 690 
                 OG 
                 SER 
                 A 
                 88 
                 38.249 
                 21.402 
                 15.909 
                 1.00 
                 47.58 
                 O 
               
               
                 ATOM 
                 691 
                 C 
                 SER 
                 A 
                 88 
                 39.537 
                 21.793 
                 13.046 
                 1.00 
                 47.83 
                 C 
               
               
                 ATOM 
                 692 
                 O 
                 SER 
                 A 
                 88 
                 40.136 
                 21.682 
                 11.982 
                 1.00 
                 48.24 
                 O 
               
               
                 ATOM 
                 693 
                 N 
                 ASP 
                 A 
                 89 
                 39.280 
                 22.973 
                 13.611 
                 1.00 
                 49.69 
                 N 
               
               
                 ATOM 
                 694 
                 CA 
                 ASP 
                 A 
                 89 
                 39.998 
                 24.207 
                 13.237 
                 1.00 
                 51.76 
                 C 
               
               
                 ATOM 
                 695 
                 CB 
                 ASP 
                 A 
                 89 
                 39.034 
                 25.388 
                 13.018 
                 1.00 
                 51.71 
                 C 
               
               
                 ATOM 
                 696 
                 CG 
                 ASP 
                 A 
                 89 
                 37.997 
                 25.525 
                 14.126 
                 1.00 
                 52.05 
                 C 
               
               
                 ATOM 
                 697 
                 OD1 
                 ASP 
                 A 
                 89 
                 37.313 
                 24.520 
                 14.445 
                 1.00 
                 51.33 
                 O 
               
               
                 ATOM 
                 698 
                 OD2 
                 ASP 
                 A 
                 89 
                 37.854 
                 26.652 
                 14.656 
                 1.00 
                 52.53 
                 O 
               
               
                 ATOM 
                 699 
                 C 
                 ASP 
                 A 
                 89 
                 41.078 
                 24.545 
                 14.284 
                 1.00 
                 53.06 
                 C 
               
               
                 ATOM 
                 700 
                 O 
                 ASP 
                 A 
                 89 
                 41.313 
                 23.760 
                 15.207 
                 1.00 
                 53.58 
                 O 
               
               
                 ATOM 
                 701 
                 N 
                 ALA 
                 A 
                 90 
                 41.754 
                 25.683 
                 14.147 
                 1.00 
                 54.40 
                 N 
               
               
                 ATOM 
                 702 
                 CA 
                 ALA 
                 A 
                 90 
                 42.727 
                 26.075 
                 15.167 
                 1.00 
                 55.85 
                 C 
               
               
                 ATOM 
                 703 
                 CB 
                 ALA 
                 A 
                 90 
                 43.719 
                 27.092 
                 14.620 
                 1.00 
                 55.91 
                 C 
               
               
                 ATOM 
                 704 
                 C 
                 ALA 
                 A 
                 90 
                 42.008 
                 26.617 
                 16.406 
                 1.00 
                 56.94 
                 C 
               
               
                 ATOM 
                 705 
                 O 
                 ALA 
                 A 
                 90 
                 42.408 
                 26.311 
                 17.536 
                 1.00 
                 57.01 
                 O 
               
               
                 ATOM 
                 706 
                 N 
                 MET 
                 A 
                 91 
                 40.941 
                 27.391 
                 16.163 
                 1.00 
                 58.11 
                 N 
               
               
                 ATOM 
                 707 
                 CA 
                 MET 
                 A 
                 91 
                 40.091 
                 28.038 
                 17.187 
                 1.00 
                 59.30 
                 C 
               
               
                 ATOM 
                 708 
                 CB 
                 MET 
                 A 
                 91 
                 38.880 
                 28.721 
                 16.498 
                 1.00 
                 59.40 
                 C 
               
               
                 ATOM 
                 709 
                 CG 
                 MET 
                 A 
                 91 
                 37.535 
                 28.722 
                 17.267 
                 1.00 
                 60.45 
                 C 
               
               
                 ATOM 
                 710 
                 SD 
                 MET 
                 A 
                 91 
                 37.156 
                 30.177 
                 18.308 
                 1.00 
                 63.23 
                 S 
               
               
                 ATOM 
                 711 
                 CE 
                 MET 
                 A 
                 91 
                 36.666 
                 31.394 
                 17.075 
                 1.00 
                 61.90 
                 C 
               
               
                 ATOM 
                 712 
                 C 
                 MET 
                 A 
                 91 
                 39.652 
                 27.166 
                 18.396 
                 1.00 
                 59.86 
                 C 
               
               
                 ATOM 
                 713 
                 O 
                 MET 
                 A 
                 91 
                 39.717 
                 27.622 
                 19.549 
                 1.00 
                 59.93 
                 O 
               
               
                 ATOM 
                 714 
                 N 
                 SER 
                 A 
                 92 
                 39.226 
                 25.926 
                 18.131 
                 1.00 
                 60.49 
                 N 
               
               
                 ATOM 
                 715 
                 CA 
                 SER 
                 A 
                 92 
                 38.665 
                 25.034 
                 19.166 
                 1.00 
                 60.99 
                 C 
               
               
                 ATOM 
                 716 
                 CB 
                 SER 
                 A 
                 92 
                 37.804 
                 23.923 
                 18.536 
                 1.00 
                 61.05 
                 C 
               
               
                 ATOM 
                 717 
                 OG 
                 SER 
                 A 
                 92 
                 37.490 
                 24.177 
                 17.178 
                 1.00 
                 61.70 
                 O 
               
               
                 ATOM 
                 718 
                 C 
                 SER 
                 A 
                 92 
                 39.749 
                 24.388 
                 20.036 
                 1.00 
                 61.12 
                 C 
               
               
                 ATOM 
                 719 
                 O 
                 SER 
                 A 
                 92 
                 40.158 
                 23.246 
                 19.782 
                 1.00 
                 61.30 
                 O 
               
               
                 ATOM 
                 720 
                 N 
                 ASN 
                 A 
                 93 
                 40.184 
                 25.096 
                 21.078 
                 1.00 
                 61.18 
                 N 
               
               
                 ATOM 
                 721 
                 CA 
                 ASN 
                 A 
                 93 
                 41.338 
                 24.655 
                 21.873 
                 1.00 
                 61.19 
                 C 
               
               
                 ATOM 
                 722 
                 CB 
                 ASN 
                 A 
                 93 
                 41.617 
                 25.608 
                 23.059 
                 1.00 
                 61.23 
                 C 
               
               
                 ATOM 
                 723 
                 CG 
                 ASN 
                 A 
                 93 
                 40.859 
                 25.241 
                 24.321 
                 1.00 
                 61.10 
                 C 
               
               
                 ATOM 
                 724 
                 OD1 
                 ASN 
                 A 
                 93 
                 40.047 
                 26.018 
                 24.809 
                 1.00 
                 60.02 
                 O 
               
               
                 ATOM 
                 725 
                 ND2 
                 ASN 
                 A 
                 93 
                 41.145 
                 24.065 
                 24.870 
                 1.00 
                 61.37 
                 N 
               
               
                 ATOM 
                 726 
                 C 
                 ASN 
                 A 
                 93 
                 41.293 
                 23.171 
                 22.270 
                 1.00 
                 61.09 
                 C 
               
               
                 ATOM 
                 727 
                 O 
                 ASN 
                 A 
                 93 
                 40.238 
                 22.645 
                 22.631 
                 1.00 
                 61.14 
                 O 
               
               
                 ATOM 
                 728 
                 N 
                 TYR 
                 A 
                 94 
                 42.447 
                 22.513 
                 22.186 
                 1.00 
                 61.01 
                 N 
               
               
                 ATOM 
                 729 
                 CA 
                 TYR 
                 A 
                 94 
                 42.527 
                 21.044 
                 22.190 
                 1.00 
                 60.82 
                 C 
               
               
                 ATOM 
                 730 
                 CB 
                 TYR 
                 A 
                 94 
                 43.727 
                 20.577 
                 21.348 
                 1.00 
                 61.25 
                 C 
               
               
                 ATOM 
                 731 
                 CG 
                 TYR 
                 A 
                 94 
                 43.596 
                 20.802 
                 19.846 
                 1.00 
                 62.15 
                 C 
               
               
                 ATOM 
                 732 
                 CD1 
                 TYR 
                 A 
                 94 
                 43.511 
                 19.718 
                 18.956 
                 1.00 
                 62.46 
                 C 
               
               
                 ATOM 
                 733 
                 CE1 
                 TYR 
                 A 
                 94 
                 43.406 
                 19.923 
                 17.572 
                 1.00 
                 62.67 
                 C 
               
               
                 ATOM 
                 734 
                 CZ 
                 TYR 
                 A 
                 94 
                 43.387 
                 21.228 
                 17.067 
                 1.00 
                 62.76 
                 C 
               
               
                 ATOM 
                 735 
                 OH 
                 TYR 
                 A 
                 94 
                 43.280 
                 21.469 
                 15.707 
                 1.00 
                 62.36 
                 O 
               
               
                 ATOM 
                 736 
                 CE2 
                 TYR 
                 A 
                 94 
                 43.478 
                 22.312 
                 17.932 
                 1.00 
                 63.17 
                 C 
               
               
                 ATOM 
                 737 
                 CD2 
                 TYR 
                 A 
                 94 
                 43.582 
                 22.096 
                 19.311 
                 1.00 
                 62.95 
                 C 
               
               
                 ATOM 
                 738 
                 C 
                 TYR 
                 A 
                 94 
                 42.581 
                 20.366 
                 23.567 
                 1.00 
                 60.23 
                 C 
               
               
                 ATOM 
                 739 
                 O 
                 TYR 
                 A 
                 94 
                 42.718 
                 19.140 
                 23.641 
                 1.00 
                 60.11 
                 O 
               
               
                 ATOM 
                 740 
                 N 
                 SER 
                 A 
                 95 
                 42.461 
                 21.141 
                 24.646 
                 1.00 
                 59.52 
                 N 
               
               
                 ATOM 
                 741 
                 CA 
                 SER 
                 A 
                 95 
                 42.581 
                 20.582 
                 26.002 
                 1.00 
                 58.81 
                 C 
               
               
                 ATOM 
                 742 
                 CB 
                 SER 
                 A 
                 95 
                 42.852 
                 21.672 
                 27.042 
                 1.00 
                 58.71 
                 C 
               
               
                 ATOM 
                 743 
                 OG 
                 SER 
                 A 
                 95 
                 41.818 
                 22.630 
                 27.053 
                 1.00 
                 58.55 
                 O 
               
               
                 ATOM 
                 744 
                 C 
                 SER 
                 A 
                 95 
                 41.415 
                 19.669 
                 26.431 
                 1.00 
                 58.41 
                 C 
               
               
                 ATOM 
                 745 
                 O 
                 SER 
                 A 
                 95 
                 41.552 
                 18.918 
                 27.404 
                 1.00 
                 58.61 
                 O 
               
               
                 ATOM 
                 746 
                 N 
                 TYR 
                 A 
                 96 
                 40.280 
                 19.744 
                 25.725 
                 1.00 
                 57.56 
                 N 
               
               
                 ATOM 
                 747 
                 CA 
                 TYR 
                 A 
                 96 
                 39.262 
                 18.672 
                 25.743 
                 1.00 
                 56.62 
                 C 
               
               
                 ATOM 
                 748 
                 CB 
                 TYR 
                 A 
                 96 
                 37.920 
                 19.112 
                 26.373 
                 1.00 
                 57.07 
                 C 
               
               
                 ATOM 
                 749 
                 CG 
                 TYR 
                 A 
                 96 
                 37.741 
                 18.806 
                 27.868 
                 1.00 
                 57.61 
                 C 
               
               
                 ATOM 
                 750 
                 CD1 
                 TYR 
                 A 
                 96 
                 37.940 
                 17.510 
                 28.391 
                 1.00 
                 57.75 
                 C 
               
               
                 ATOM 
                 751 
                 CE1 
                 TYR 
                 A 
                 96 
                 37.767 
                 17.247 
                 29.764 
                 1.00 
                 57.76 
                 C 
               
               
                 ATOM 
                 752 
                 CZ 
                 TYR 
                 A 
                 96 
                 37.377 
                 18.287 
                 30.616 
                 1.00 
                 58.09 
                 C 
               
               
                 ATOM 
                 753 
                 OH 
                 TYR 
                 A 
                 96 
                 37.191 
                 18.084 
                 31.966 
                 1.00 
                 57.64 
                 O 
               
               
                 ATOM 
                 754 
                 CE2 
                 TYR 
                 A 
                 96 
                 37.167 
                 19.565 
                 30.118 
                 1.00 
                 58.28 
                 C 
               
               
                 ATOM 
                 755 
                 CD2 
                 TYR 
                 A 
                 96 
                 37.343 
                 19.813 
                 28.753 
                 1.00 
                 58.03 
                 C 
               
               
                 ATOM 
                 756 
                 C 
                 TYR 
                 A 
                 96 
                 39.086 
                 18.199 
                 24.297 
                 1.00 
                 55.45 
                 C 
               
               
                 ATOM 
                 757 
                 O 
                 TYR 
                 A 
                 96 
                 39.520 
                 18.902 
                 23.381 
                 1.00 
                 55.68 
                 O 
               
               
                 ATOM 
                 758 
                 N 
                 PRO 
                 A 
                 97 
                 38.437 
                 17.029 
                 24.084 
                 1.00 
                 54.13 
                 N 
               
               
                 ATOM 
                 759 
                 CA 
                 PRO 
                 A 
                 97 
                 38.603 
                 16.250 
                 22.842 
                 1.00 
                 52.71 
                 C 
               
               
                 ATOM 
                 760 
                 CB 
                 PRO 
                 A 
                 97 
                 37.814 
                 14.964 
                 23.119 
                 1.00 
                 52.84 
                 C 
               
               
                 ATOM 
                 761 
                 CG 
                 PRO 
                 A 
                 97 
                 37.584 
                 14.952 
                 24.598 
                 1.00 
                 53.79 
                 C 
               
               
                 ATOM 
                 762 
                 CD 
                 PRO 
                 A 
                 97 
                 37.472 
                 16.380 
                 24.989 
                 1.00 
                 54.03 
                 C 
               
               
                 ATOM 
                 763 
                 C 
                 PRO 
                 A 
                 97 
                 38.060 
                 16.910 
                 21.592 
                 1.00 
                 51.10 
                 C 
               
               
                 ATOM 
                 764 
                 O 
                 PRO 
                 A 
                 97 
                 37.344 
                 17.897 
                 21.657 
                 1.00 
                 50.84 
                 O 
               
               
                 ATOM 
                 765 
                 N 
                 ILE 
                 A 
                 98 
                 38.401 
                 16.347 
                 20.448 
                 1.00 
                 49.60 
                 N 
               
               
                 ATOM 
                 766 
                 CA 
                 ILE 
                 A 
                 98 
                 37.932 
                 16.909 
                 19.185 
                 1.00 
                 47.94 
                 C 
               
               
                 ATOM 
                 767 
                 CB 
                 ILE 
                 A 
                 98 
                 39.116 
                 17.382 
                 18.274 
                 1.00 
                 48.04 
                 C 
               
               
                 ATOM 
                 768 
                 CG1 
                 ILE 
                 A 
                 98 
                 40.146 
                 16.264 
                 18.054 
                 1.00 
                 47.50 
                 C 
               
               
                 ATOM 
                 769 
                 CD1 
                 ILE 
                 A 
                 98 
                 41.275 
                 16.645 
                 17.088 
                 1.00 
                 47.86 
                 C 
               
               
                 ATOM 
                 770 
                 CG2 
                 ILE 
                 A 
                 98 
                 39.769 
                 18.647 
                 18.881 
                 1.00 
                 48.04 
                 C 
               
               
                 ATOM 
                 771 
                 C 
                 ILE 
                 A 
                 98 
                 36.983 
                 15.953 
                 18.469 
                 1.00 
                 46.38 
                 C 
               
               
                 ATOM 
                 772 
                 O 
                 ILE 
                 A 
                 98 
                 37.126 
                 14.733 
                 18.617 
                 1.00 
                 46.53 
                 O 
               
               
                 ATOM 
                 773 
                 N 
                 PRO 
                 A 
                 99 
                 35.988 
                 16.498 
                 17.726 
                 1.00 
                 44.56 
                 N 
               
               
                 ATOM 
                 774 
                 CA 
                 PRO 
                 A 
                 99 
                 35.087 
                 15.693 
                 16.891 
                 1.00 
                 43.02 
                 C 
               
               
                 ATOM 
                 775 
                 CB 
                 PRO 
                 A 
                 99 
                 34.375 
                 16.736 
                 16.023 
                 1.00 
                 42.91 
                 C 
               
               
                 ATOM 
                 776 
                 CG 
                 PRO 
                 A 
                 99 
                 35.076 
                 18.025 
                 16.282 
                 1.00 
                 43.57 
                 C 
               
               
                 ATOM 
                 777 
                 CD 
                 PRO 
                 A 
                 99 
                 35.638 
                 17.922 
                 17.647 
                 1.00 
                 44.32 
                 C 
               
               
                 ATOM 
                 778 
                 C 
                 PRO 
                 A 
                 99 
                 35.819 
                 14.672 
                 16.015 
                 1.00 
                 41.63 
                 C 
               
               
                 ATOM 
                 779 
                 O 
                 PRO 
                 A 
                 99 
                 36.930 
                 14.920 
                 15.542 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 780 
                 N 
                 GLY 
                 A 
                 100 
                 35.210 
                 13.515 
                 15.819 
                 1.00 
                 40.25 
                 N 
               
               
                 ATOM 
                 781 
                 CA 
                 GLY 
                 A 
                 100 
                 35.838 
                 12.516 
                 14.992 
                 1.00 
                 38.90 
                 C 
               
               
                 ATOM 
                 782 
                 C 
                 GLY 
                 A 
                 100 
                 34.862 
                 11.434 
                 14.664 
                 1.00 
                 38.33 
                 C 
               
               
                 ATOM 
                 783 
                 O 
                 GLY 
                 A 
                 100 
                 33.789 
                 11.369 
                 15.265 
                 1.00 
                 38.01 
                 O 
               
               
                 ATOM 
                 784 
                 N 
                 GLU 
                 A 
                 101 
                 35.247 
                 10.592 
                 13.707 
                 1.00 
                 37.69 
                 N 
               
               
                 ATOM 
                 785 
                 CA 
                 GLU 
                 A 
                 101 
                 34.459 
                 9.460 
                 13.277 
                 1.00 
                 37.26 
                 C 
               
               
                 ATOM 
                 786 
                 CB 
                 GLU 
                 A 
                 101 
                 33.817 
                 9.732 
                 11.925 
                 1.00 
                 37.40 
                 C 
               
               
                 ATOM 
                 787 
                 CG 
                 GLU 
                 A 
                 101 
                 32.802 
                 10.844 
                 11.894 
                 1.00 
                 39.41 
                 C 
               
               
                 ATOM 
                 788 
                 CD 
                 GLU 
                 A 
                 101 
                 31.489 
                 10.480 
                 12.574 
                 1.00 
                 42.64 
                 C 
               
               
                 ATOM 
                 789 
                 OE1 
                 GLU 
                 A 
                 101 
                 31.156 
                 9.266 
                 12.657 
                 1.00 
                 44.09 
                 O 
               
               
                 ATOM 
                 790 
                 OE2 
                 GLU 
                 A 
                 101 
                 30.784 
                 11.422 
                 13.015 
                 1.00 
                 42.76 
                 O 
               
               
                 ATOM 
                 791 
                 C 
                 GLU 
                 A 
                 101 
                 35.362 
                 8.271 
                 13.110 
                 1.00 
                 37.21 
                 C 
               
               
                 ATOM 
                 792 
                 O 
                 GLU 
                 A 
                 101 
                 36.540 
                 8.394 
                 12.789 
                 1.00 
                 36.41 
                 O 
               
               
                 ATOM 
                 793 
                 N 
                 LYS 
                 A 
                 102 
                 34.783 
                 7.098 
                 13.306 
                 1.00 
                 38.04 
                 N 
               
               
                 ATOM 
                 794 
                 CA 
                 LYS 
                 A 
                 102 
                 35.478 
                 5.831 
                 13.085 
                 1.00 
                 38.38 
                 C 
               
               
                 ATOM 
                 795 
                 CB 
                 LYS 
                 A 
                 102 
                 35.316 
                 4.910 
                 14.300 
                 1.00 
                 38.22 
                 C 
               
               
                 ATOM 
                 796 
                 CG 
                 LYS 
                 A 
                 102 
                 35.999 
                 5.442 
                 15.541 
                 1.00 
                 39.05 
                 C 
               
               
                 ATOM 
                 797 
                 CD 
                 LYS 
                 A 
                 102 
                 35.674 
                 4.610 
                 16.753 
                 1.00 
                 41.78 
                 C 
               
               
                 ATOM 
                 798 
                 CE 
                 LYS 
                 A 
                 102 
                 36.545 
                 3.369 
                 16.826 
                 1.00 
                 43.99 
                 C 
               
               
                 ATOM 
                 799 
                 NZ 
                 LYS 
                 A 
                 102 
                 36.106 
                 2.510 
                 17.964 
                 1.00 
                 47.98 
                 N 
               
               
                 ATOM 
                 800 
                 C 
                 LYS 
                 A 
                 102 
                 34.936 
                 5.168 
                 11.823 
                 1.00 
                 38.37 
                 C 
               
               
                 ATOM 
                 801 
                 O 
                 LYS 
                 A 
                 102 
                 33.815 
                 5.468 
                 11.379 
                 1.00 
                 38.58 
                 O 
               
               
                 ATOM 
                 802 
                 N 
                 GLY 
                 A 
                 103 
                 35.741 
                 4.289 
                 11.232 
                 1.00 
                 38.20 
                 N 
               
               
                 ATOM 
                 803 
                 CA 
                 GLY 
                 A 
                 103 
                 35.315 
                 3.531 
                 10.069 
                 1.00 
                 37.94 
                 C 
               
               
                 ATOM 
                 804 
                 C 
                 GLY 
                 A 
                 103 
                 34.398 
                 2.432 
                 10.546 
                 1.00 
                 37.97 
                 C 
               
               
                 ATOM 
                 805 
                 O 
                 GLY 
                 A 
                 103 
                 34.407 
                 2.098 
                 11.738 
                 1.00 
                 37.93 
                 O 
               
               
                 ATOM 
                 806 
                 N 
                 ALA 
                 A 
                 104 
                 33.597 
                 1.878 
                 9.631 
                 1.00 
                 37.92 
                 N 
               
               
                 ATOM 
                 807 
                 CA 
                 ALA 
                 A 
                 104 
                 32.750 
                 0.702 
                 9.939 
                 1.00 
                 37.58 
                 C 
               
               
                 ATOM 
                 808 
                 CB 
                 ALA 
                 A 
                 104 
                 31.765 
                 0.432 
                 8.801 
                 1.00 
                 37.08 
                 C 
               
               
                 ATOM 
                 809 
                 C 
                 ALA 
                 A 
                 104 
                 33.551 
                 −0.583 
                 10.315 
                 1.00 
                 37.23 
                 C 
               
               
                 ATOM 
                 810 
                 O 
                 ALA 
                 A 
                 104 
                 32.987 
                 −1.493 
                 10.913 
                 1.00 
                 36.83 
                 O 
               
               
                 ATOM 
                 811 
                 N 
                 GLY 
                 A 
                 105 
                 34.848 
                 −0.639 
                 9.980 
                 1.00 
                 36.70 
                 N 
               
               
                 ATOM 
                 812 
                 CA 
                 GLY 
                 A 
                 105 
                 35.717 
                 −1.739 
                 10.405 
                 1.00 
                 36.63 
                 C 
               
               
                 ATOM 
                 813 
                 C 
                 GLY 
                 A 
                 105 
                 36.121 
                 −2.751 
                 9.334 
                 1.00 
                 36.82 
                 C 
               
               
                 ATOM 
                 814 
                 O 
                 GLY 
                 A 
                 105 
                 35.447 
                 −2.898 
                 8.310 
                 1.00 
                 36.82 
                 O 
               
               
                 ATOM 
                 815 
                 N 
                 THR 
                 A 
                 106 
                 37.228 
                 −3.452 
                 9.586 
                 1.00 
                 36.84 
                 N 
               
               
                 ATOM 
                 816 
                 CA 
                 THR 
                 A 
                 106 
                 37.735 
                 −4.539 
                 8.727 
                 1.00 
                 36.57 
                 C 
               
               
                 ATOM 
                 817 
                 CB 
                 THR 
                 A 
                 106 
                 39.140 
                 −4.208 
                 8.153 
                 1.00 
                 36.36 
                 C 
               
               
                 ATOM 
                 818 
                 OG1 
                 THR 
                 A 
                 106 
                 39.057 
                 −3.079 
                 7.270 
                 1.00 
                 36.90 
                 O 
               
               
                 ATOM 
                 819 
                 CG2 
                 THR 
                 A 
                 106 
                 39.716 
                 −5.390 
                 7.393 
                 1.00 
                 36.01 
                 C 
               
               
                 ATOM 
                 820 
                 C 
                 THR 
                 A 
                 106 
                 37.848 
                 −5.826 
                 9.540 
                 1.00 
                 36.39 
                 C 
               
               
                 ATOM 
                 821 
                 O 
                 THR 
                 A 
                 106 
                 38.609 
                 −5.895 
                 10.499 
                 1.00 
                 36.67 
                 O 
               
               
                 ATOM 
                 822 
                 N 
                 VAL 
                 A 
                 107 
                 37.093 
                 −6.848 
                 9.183 
                 1.00 
                 36.21 
                 N 
               
               
                 ATOM 
                 823 
                 CA 
                 VAL 
                 A 
                 107 
                 37.282 
                 −8.113 
                 9.871 
                 1.00 
                 36.14 
                 C 
               
               
                 ATOM 
                 824 
                 CB 
                 VAL 
                 A 
                 107 
                 35.938 
                 −8.872 
                 10.219 
                 1.00 
                 36.19 
                 C 
               
               
                 ATOM 
                 825 
                 CG1 
                 VAL 
                 A 
                 107 
                 34.747 
                 −8.302 
                 9.454 
                 1.00 
                 36.06 
                 C 
               
               
                 ATOM 
                 826 
                 CG2 
                 VAL 
                 A 
                 107 
                 36.078 
                 −10.400 
                 10.048 
                 1.00 
                 35.72 
                 C 
               
               
                 ATOM 
                 827 
                 C 
                 VAL 
                 A 
                 107 
                 38.315 
                 −8.942 
                 9.111 
                 1.00 
                 36.04 
                 C 
               
               
                 ATOM 
                 828 
                 O 
                 VAL 
                 A 
                 107 
                 38.114 
                 −9.330 
                 7.953 
                 1.00 
                 36.06 
                 O 
               
               
                 ATOM 
                 829 
                 N 
                 LEU 
                 A 
                 108 
                 39.439 
                 −9.173 
                 9.780 
                 1.00 
                 35.79 
                 N 
               
               
                 ATOM 
                 830 
                 CA 
                 LEU 
                 A 
                 108 
                 40.553 
                 −9.902 
                 9.202 
                 1.00 
                 35.32 
                 C 
               
               
                 ATOM 
                 831 
                 CB 
                 LEU 
                 A 
                 108 
                 41.836 
                 −9.135 
                 9.469 
                 1.00 
                 35.00 
                 C 
               
               
                 ATOM 
                 832 
                 CG 
                 LEU 
                 A 
                 108 
                 43.135 
                 −9.811 
                 9.049 
                 1.00 
                 35.77 
                 C 
               
               
                 ATOM 
                 833 
                 CD1 
                 LEU 
                 A 
                 108 
                 43.114 
                 −10.166 
                 7.569 
                 1.00 
                 34.89 
                 C 
               
               
                 ATOM 
                 834 
                 CD2 
                 LEU 
                 A 
                 108 
                 44.303 
                 −8.880 
                 9.385 
                 1.00 
                 36.41 
                 C 
               
               
                 ATOM 
                 835 
                 C 
                 LEU 
                 A 
                 108 
                 40.665 
                 −11.351 
                 9.707 
                 1.00 
                 34.96 
                 C 
               
               
                 ATOM 
                 836 
                 O 
                 LEU 
                 A 
                 108 
                 40.651 
                 −11.607 
                 10.914 
                 1.00 
                 34.93 
                 O 
               
               
                 ATOM 
                 837 
                 N 
                 THR 
                 A 
                 109 
                 40.763 
                 −12.291 
                 8.771 
                 1.00 
                 34.40 
                 N 
               
               
                 ATOM 
                 838 
                 CA 
                 THR 
                 A 
                 109 
                 41.047 
                 −13.679 
                 9.108 
                 1.00 
                 33.95 
                 C 
               
               
                 ATOM 
                 839 
                 CB 
                 THR 
                 A 
                 109 
                 40.034 
                 −14.648 
                 8.489 
                 1.00 
                 33.87 
                 C 
               
               
                 ATOM 
                 840 
                 OG1 
                 THR 
                 A 
                 109 
                 38.720 
                 −14.118 
                 8.645 
                 1.00 
                 34.49 
                 O 
               
               
                 ATOM 
                 841 
                 CG2 
                 THR 
                 A 
                 109 
                 40.092 
                 −15.997 
                 9.177 
                 1.00 
                 34.16 
                 C 
               
               
                 ATOM 
                 842 
                 C 
                 THR 
                 A 
                 109 
                 42.411 
                 −13.992 
                 8.553 
                 1.00 
                 33.64 
                 C 
               
               
                 ATOM 
                 843 
                 O 
                 THR 
                 A 
                 109 
                 42.731 
                 −13.599 
                 7.432 
                 1.00 
                 33.51 
                 O 
               
               
                 ATOM 
                 844 
                 N 
                 VAL 
                 A 
                 110 
                 43.214 
                 −14.689 
                 9.351 
                 1.00 
                 33.46 
                 N 
               
               
                 ATOM 
                 845 
                 CA 
                 VAL 
                 A 
                 110 
                 44.557 
                 −15.120 
                 8.951 
                 1.00 
                 33.20 
                 C 
               
               
                 ATOM 
                 846 
                 CB 
                 VAL 
                 A 
                 110 
                 45.644 
                 −14.520 
                 9.895 
                 1.00 
                 33.18 
                 C 
               
               
                 ATOM 
                 847 
                 CG1 
                 VAL 
                 A 
                 110 
                 47.033 
                 −14.974 
                 9.497 
                 1.00 
                 32.89 
                 C 
               
               
                 ATOM 
                 848 
                 CG2 
                 VAL 
                 A 
                 110 
                 45.576 
                 −12.990 
                 9.876 
                 1.00 
                 33.11 
                 C 
               
               
                 ATOM 
                 849 
                 C 
                 VAL 
                 A 
                 110 
                 44.628 
                 −16.662 
                 8.879 
                 1.00 
                 33.14 
                 C 
               
               
                 ATOM 
                 850 
                 O 
                 VAL 
                 A 
                 110 
                 43.820 
                 −17.352 
                 9.508 
                 1.00 
                 33.15 
                 O 
               
               
                 ATOM 
                 851 
                 N 
                 LYS 
                 A 
                 111 
                 45.569 
                 −17.176 
                 8.076 
                 1.00 
                 32.96 
                 N 
               
               
                 ATOM 
                 852 
                 CA 
                 LYS 
                 A 
                 111 
                 45.863 
                 −18.614 
                 7.908 
                 1.00 
                 32.47 
                 C 
               
               
                 ATOM 
                 853 
                 CB 
                 LYS 
                 A 
                 111 
                 46.047 
                 −19.310 
                 9.266 
                 1.00 
                 32.42 
                 C 
               
               
                 ATOM 
                 854 
                 CG 
                 LYS 
                 A 
                 111 
                 47.301 
                 −20.173 
                 9.401 
                 1.00 
                 32.16 
                 C 
               
               
                 ATOM 
                 855 
                 CD 
                 LYS 
                 A 
                 111 
                 47.322 
                 −21.337 
                 8.439 
                 1.00 
                 30.51 
                 C 
               
               
                 ATOM 
                 856 
                 CE 
                 LYS 
                 A 
                 111 
                 48.666 
                 −21.373 
                 7.765 
                 1.00 
                 29.84 
                 C 
               
               
                 ATOM 
                 857 
                 NZ 
                 LYS 
                 A 
                 111 
                 48.509 
                 −21.849 
                 6.325 
                 1.00 
                 28.97 
                 N 
               
               
                 ATOM 
                 858 
                 C 
                 LYS 
                 A 
                 111 
                 44.803 
                 −19.337 
                 7.075 
                 1.00 
                 32.50 
                 C 
               
               
                 ATOM 
                 859 
                 O 
                 LYS 
                 A 
                 111 
                 43.688 
                 −18.840 
                 6.886 
                 1.00 
                 32.44 
                 O 
               
               
                 ATOM 
                 860 
                 N 
                 ALA 
                 B 
                 1 
                 61.374 
                 15.952 
                 26.666 
                 1.00 
                 40.58 
                 N 
               
               
                 ATOM 
                 861 
                 CA 
                 ALA 
                 B 
                 1 
                 61.194 
                 15.867 
                 25.190 
                 1.00 
                 40.32 
                 C 
               
               
                 ATOM 
                 862 
                 CB 
                 ALA 
                 B 
                 1 
                 59.746 
                 15.561 
                 24.857 
                 1.00 
                 40.27 
                 C 
               
               
                 ATOM 
                 863 
                 C 
                 ALA 
                 B 
                 1 
                 61.595 
                 17.183 
                 24.574 
                 1.00 
                 40.31 
                 C 
               
               
                 ATOM 
                 864 
                 O 
                 ALA 
                 B 
                 1 
                 61.451 
                 18.221 
                 25.207 
                 1.00 
                 40.46 
                 O 
               
               
                 ATOM 
                 865 
                 N 
                 TRP 
                 B 
                 2 
                 62.100 
                 17.137 
                 23.345 
                 1.00 
                 40.50 
                 N 
               
               
                 ATOM 
                 866 
                 CA 
                 TRP 
                 B 
                 2 
                 62.339 
                 18.351 
                 22.545 
                 1.00 
                 40.64 
                 C 
               
               
                 ATOM 
                 867 
                 CB 
                 TRP 
                 B 
                 2 
                 63.662 
                 19.036 
                 22.923 
                 1.00 
                 40.90 
                 C 
               
               
                 ATOM 
                 868 
                 CG 
                 TRP 
                 B 
                 2 
                 64.853 
                 18.232 
                 22.538 
                 1.00 
                 41.26 
                 C 
               
               
                 ATOM 
                 869 
                 CD1 
                 TRP 
                 B 
                 2 
                 65.313 
                 17.111 
                 23.157 
                 1.00 
                 41.31 
                 C 
               
               
                 ATOM 
                 870 
                 NE1 
                 TRP 
                 B 
                 2 
                 66.415 
                 16.634 
                 22.506 
                 1.00 
                 41.61 
                 N 
               
               
                 ATOM 
                 871 
                 CE2 
                 TRP 
                 B 
                 2 
                 66.688 
                 17.445 
                 21.435 
                 1.00 
                 41.51 
                 C 
               
               
                 ATOM 
                 872 
                 CD2 
                 TRP 
                 B 
                 2 
                 65.721 
                 18.465 
                 21.426 
                 1.00 
                 41.52 
                 C 
               
               
                 ATOM 
                 873 
                 CE3 
                 TRP 
                 B 
                 2 
                 65.776 
                 19.445 
                 20.419 
                 1.00 
                 42.43 
                 C 
               
               
                 ATOM 
                 874 
                 CZ3 
                 TRP 
                 B 
                 2 
                 66.798 
                 19.376 
                 19.467 
                 1.00 
                 41.87 
                 C 
               
               
                 ATOM 
                 875 
                 CH2 
                 TRP 
                 B 
                 2 
                 67.753 
                 18.344 
                 19.507 
                 1.00 
                 42.06 
                 C 
               
               
                 ATOM 
                 876 
                 CZ2 
                 TRP 
                 B 
                 2 
                 67.716 
                 17.373 
                 20.482 
                 1.00 
                 42.00 
                 C 
               
               
                 ATOM 
                 877 
                 C 
                 TRP 
                 B 
                 2 
                 62.302 
                 18.017 
                 21.058 
                 1.00 
                 40.47 
                 C 
               
               
                 ATOM 
                 878 
                 O 
                 TRP 
                 B 
                 2 
                 62.361 
                 16.852 
                 20.678 
                 1.00 
                 40.26 
                 O 
               
               
                 ATOM 
                 879 
                 N 
                 VAL 
                 B 
                 3 
                 62.187 
                 19.050 
                 20.231 
                 1.00 
                 40.69 
                 N 
               
               
                 ATOM 
                 880 
                 CA 
                 VAL 
                 B 
                 3 
                 62.056 
                 18.889 
                 18.794 
                 1.00 
                 40.91 
                 C 
               
               
                 ATOM 
                 881 
                 CB 
                 VAL 
                 B 
                 3 
                 60.770 
                 19.529 
                 18.257 
                 1.00 
                 40.88 
                 C 
               
               
                 ATOM 
                 882 
                 CG1 
                 VAL 
                 B 
                 3 
                 60.727 
                 19.412 
                 16.755 
                 1.00 
                 40.86 
                 C 
               
               
                 ATOM 
                 883 
                 CG2 
                 VAL 
                 B 
                 3 
                 59.540 
                 18.863 
                 18.860 
                 1.00 
                 40.88 
                 C 
               
               
                 ATOM 
                 884 
                 C 
                 VAL 
                 B 
                 3 
                 63.222 
                 19.534 
                 18.093 
                 1.00 
                 41.36 
                 C 
               
               
                 ATOM 
                 885 
                 O 
                 VAL 
                 B 
                 3 
                 63.461 
                 20.727 
                 18.240 
                 1.00 
                 41.24 
                 O 
               
               
                 ATOM 
                 886 
                 N 
                 ASP 
                 B 
                 4 
                 63.942 
                 18.720 
                 17.329 
                 1.00 
                 42.15 
                 N 
               
               
                 ATOM 
                 887 
                 CA 
                 ASP 
                 B 
                 4 
                 65.052 
                 19.174 
                 16.502 
                 1.00 
                 42.71 
                 C 
               
               
                 ATOM 
                 888 
                 CB 
                 ASP 
                 B 
                 4 
                 66.056 
                 18.034 
                 16.348 
                 1.00 
                 43.16 
                 C 
               
               
                 ATOM 
                 889 
                 CG 
                 ASP 
                 B 
                 4 
                 67.427 
                 18.503 
                 15.884 
                 1.00 
                 45.21 
                 C 
               
               
                 ATOM 
                 890 
                 OD1 
                 ASP 
                 B 
                 4 
                 68.205 
                 17.616 
                 15.462 
                 1.00 
                 47.92 
                 O 
               
               
                 ATOM 
                 891 
                 OD2 
                 ASP 
                 B 
                 4 
                 67.739 
                 19.725 
                 15.948 
                 1.00 
                 45.46 
                 O 
               
               
                 ATOM 
                 892 
                 C 
                 ASP 
                 B 
                 4 
                 64.510 
                 19.559 
                 15.141 
                 1.00 
                 42.38 
                 C 
               
               
                 ATOM 
                 893 
                 O 
                 ASP 
                 B 
                 4 
                 64.014 
                 18.697 
                 14.419 
                 1.00 
                 42.71 
                 O 
               
               
                 ATOM 
                 894 
                 N 
                 GLN 
                 B 
                 5 
                 64.585 
                 20.842 
                 14.795 
                 1.00 
                 42.02 
                 N 
               
               
                 ATOM 
                 895 
                 CA 
                 GLN 
                 B 
                 5 
                 64.012 
                 21.321 
                 13.537 
                 1.00 
                 42.00 
                 C 
               
               
                 ATOM 
                 896 
                 CB 
                 GLN 
                 B 
                 5 
                 62.884 
                 22.316 
                 13.775 
                 1.00 
                 41.95 
                 C 
               
               
                 ATOM 
                 897 
                 CG 
                 GLN 
                 B 
                 5 
                 62.484 
                 23.088 
                 12.544 
                 1.00 
                 42.24 
                 C 
               
               
                 ATOM 
                 898 
                 CD 
                 GLN 
                 B 
                 5 
                 61.343 
                 24.061 
                 12.775 
                 1.00 
                 42.53 
                 C 
               
               
                 ATOM 
                 899 
                 OE1 
                 GLN 
                 B 
                 5 
                 61.122 
                 24.946 
                 11.957 
                 1.00 
                 44.45 
                 O 
               
               
                 ATOM 
                 900 
                 NE2 
                 GLN 
                 B 
                 5 
                 60.601 
                 23.896 
                 13.871 
                 1.00 
                 42.54 
                 N 
               
               
                 ATOM 
                 901 
                 C 
                 GLN 
                 B 
                 5 
                 65.070 
                 21.925 
                 12.647 
                 1.00 
                 42.01 
                 C 
               
               
                 ATOM 
                 902 
                 O 
                 GLN 
                 B 
                 5 
                 65.737 
                 22.873 
                 13.020 
                 1.00 
                 41.81 
                 O 
               
               
                 ATOM 
                 903 
                 N 
                 THR 
                 B 
                 6 
                 65.165 
                 21.383 
                 11.442 
                 1.00 
                 42.28 
                 N 
               
               
                 ATOM 
                 904 
                 CA 
                 THR 
                 B 
                 6 
                 66.276 
                 21.604 
                 10.539 
                 1.00 
                 42.29 
                 C 
               
               
                 ATOM 
                 905 
                 CB 
                 THR 
                 B 
                 6 
                 67.123 
                 20.300 
                 10.533 
                 1.00 
                 42.26 
                 C 
               
               
                 ATOM 
                 906 
                 OG1 
                 THR 
                 B 
                 6 
                 68.506 
                 20.595 
                 10.360 
                 1.00 
                 42.75 
                 O 
               
               
                 ATOM 
                 907 
                 CG2 
                 THR 
                 B 
                 6 
                 66.646 
                 19.280 
                 9.494 
                 1.00 
                 43.12 
                 C 
               
               
                 ATOM 
                 908 
                 C 
                 THR 
                 B 
                 6 
                 65.656 
                 21.970 
                 9.174 
                 1.00 
                 42.28 
                 C 
               
               
                 ATOM 
                 909 
                 O 
                 THR 
                 B 
                 6 
                 64.656 
                 21.372 
                 8.774 
                 1.00 
                 43.46 
                 O 
               
               
                 ATOM 
                 910 
                 N 
                 PRO 
                 B 
                 7 
                 66.161 
                 23.007 
                 8.485 
                 1.00 
                 41.61 
                 N 
               
               
                 ATOM 
                 911 
                 CA 
                 PRO 
                 B 
                 7 
                 67.250 
                 23.902 
                 8.768 
                 1.00 
                 41.37 
                 C 
               
               
                 ATOM 
                 912 
                 CB 
                 PRO 
                 B 
                 7 
                 67.673 
                 24.367 
                 7.382 
                 1.00 
                 41.15 
                 C 
               
               
                 ATOM 
                 913 
                 CG 
                 PRO 
                 B 
                 7 
                 66.448 
                 24.287 
                 6.546 
                 1.00 
                 40.63 
                 C 
               
               
                 ATOM 
                 914 
                 CD 
                 PRO 
                 B 
                 7 
                 65.479 
                 23.370 
                 7.229 
                 1.00 
                 41.21 
                 C 
               
               
                 ATOM 
                 915 
                 C 
                 PRO 
                 B 
                 7 
                 66.795 
                 25.105 
                 9.578 
                 1.00 
                 41.83 
                 C 
               
               
                 ATOM 
                 916 
                 O 
                 PRO 
                 B 
                 7 
                 65.605 
                 25.469 
                 9.587 
                 1.00 
                 41.92 
                 O 
               
               
                 ATOM 
                 917 
                 N 
                 ARG 
                 B 
                 8 
                 67.767 
                 25.729 
                 10.227 
                 1.00 
                 42.11 
                 N 
               
               
                 ATOM 
                 918 
                 CA 
                 ARG 
                 B 
                 8 
                 67.546 
                 26.866 
                 11.084 
                 1.00 
                 42.31 
                 C 
               
               
                 ATOM 
                 919 
                 CB 
                 ARG 
                 B 
                 8 
                 68.804 
                 27.107 
                 11.904 
                 1.00 
                 42.89 
                 C 
               
               
                 ATOM 
                 920 
                 CG 
                 ARG 
                 B 
                 8 
                 68.536 
                 27.677 
                 13.253 
                 1.00 
                 46.29 
                 C 
               
               
                 ATOM 
                 921 
                 CD 
                 ARG 
                 B 
                 8 
                 69.820 
                 27.906 
                 14.054 
                 1.00 
                 52.71 
                 C 
               
               
                 ATOM 
                 922 
                 NE 
                 ARG 
                 B 
                 8 
                 70.453 
                 26.647 
                 14.446 
                 1.00 
                 57.86 
                 N 
               
               
                 ATOM 
                 923 
                 CZ 
                 ARG 
                 B 
                 8 
                 71.641 
                 26.231 
                 14.005 
                 1.00 
                 60.60 
                 C 
               
               
                 ATOM 
                 924 
                 NH1 
                 ARG 
                 B 
                 8 
                 72.133 
                 25.061 
                 14.415 
                 1.00 
                 61.06 
                 N 
               
               
                 ATOM 
                 925 
                 NH2 
                 ARG 
                 B 
                 8 
                 72.348 
                 26.988 
                 13.166 
                 1.00 
                 61.41 
                 N 
               
               
                 ATOM 
                 926 
                 C 
                 ARG 
                 B 
                 8 
                 67.214 
                 28.067 
                 10.209 
                 1.00 
                 41.73 
                 C 
               
               
                 ATOM 
                 927 
                 O 
                 ARG 
                 B 
                 8 
                 66.308 
                 28.843 
                 10.507 
                 1.00 
                 42.11 
                 O 
               
               
                 ATOM 
                 928 
                 N 
                 SER 
                 B 
                 9 
                 67.934 
                 28.205 
                 9.109 
                 1.00 
                 41.12 
                 N 
               
               
                 ATOM 
                 929 
                 CA 
                 SER 
                 B 
                 9 
                 67.642 
                 29.256 
                 8.158 
                 1.00 
                 41.01 
                 C 
               
               
                 ATOM 
                 930 
                 CB 
                 SER 
                 B 
                 9 
                 68.452 
                 30.518 
                 8.468 
                 1.00 
                 41.19 
                 C 
               
               
                 ATOM 
                 931 
                 OG 
                 SER 
                 B 
                 9 
                 69.842 
                 30.315 
                 8.271 
                 1.00 
                 40.95 
                 O 
               
               
                 ATOM 
                 932 
                 C 
                 SER 
                 B 
                 9 
                 67.933 
                 28.761 
                 6.752 
                 1.00 
                 40.85 
                 C 
               
               
                 ATOM 
                 933 
                 O 
                 SER 
                 B 
                 9 
                 68.813 
                 27.924 
                 6.553 
                 1.00 
                 41.20 
                 O 
               
               
                 ATOM 
                 934 
                 N 
                 VAL 
                 B 
                 10 
                 67.174 
                 29.264 
                 5.780 
                 1.00 
                 40.24 
                 N 
               
               
                 ATOM 
                 935 
                 CA 
                 VAL 
                 B 
                 10 
                 67.441 
                 28.996 
                 4.368 
                 1.00 
                 38.90 
                 C 
               
               
                 ATOM 
                 936 
                 CB 
                 VAL 
                 B 
                 10 
                 66.828 
                 27.641 
                 3.924 
                 1.00 
                 38.87 
                 C 
               
               
                 ATOM 
                 937 
                 CG1 
                 VAL 
                 B 
                 10 
                 65.327 
                 27.586 
                 4.213 
                 1.00 
                 38.32 
                 C 
               
               
                 ATOM 
                 938 
                 CG2 
                 VAL 
                 B 
                 10 
                 67.124 
                 27.343 
                 2.465 
                 1.00 
                 38.15 
                 C 
               
               
                 ATOM 
                 939 
                 C 
                 VAL 
                 B 
                 10 
                 66.940 
                 30.164 
                 3.519 
                 1.00 
                 38.48 
                 C 
               
               
                 ATOM 
                 940 
                 O 
                 VAL 
                 B 
                 10 
                 65.913 
                 30.783 
                 3.827 
                 1.00 
                 38.34 
                 O 
               
               
                 ATOM 
                 941 
                 N 
                 THR 
                 B 
                 11 
                 67.686 
                 30.501 
                 2.476 
                 1.00 
                 37.98 
                 N 
               
               
                 ATOM 
                 942 
                 CA 
                 THR 
                 B 
                 11 
                 67.104 
                 31.341 
                 1.447 
                 1.00 
                 37.86 
                 C 
               
               
                 ATOM 
                 943 
                 CB 
                 THR 
                 B 
                 11 
                 67.902 
                 32.620 
                 1.151 
                 1.00 
                 37.76 
                 C 
               
               
                 ATOM 
                 944 
                 OG1 
                 THR 
                 B 
                 11 
                 68.567 
                 32.460 
                 −0.094 
                 1.00 
                 39.82 
                 O 
               
               
                 ATOM 
                 945 
                 CG2 
                 THR 
                 B 
                 11 
                 68.917 
                 32.956 
                 2.258 
                 1.00 
                 37.12 
                 C 
               
               
                 ATOM 
                 946 
                 C 
                 THR 
                 B 
                 11 
                 66.833 
                 30.522 
                 0.164 
                 1.00 
                 37.54 
                 C 
               
               
                 ATOM 
                 947 
                 O 
                 THR 
                 B 
                 11 
                 67.627 
                 29.640 
                 −0.225 
                 1.00 
                 37.27 
                 O 
               
               
                 ATOM 
                 948 
                 N 
                 LYS 
                 B 
                 12 
                 65.683 
                 30.803 
                 −0.457 
                 1.00 
                 36.76 
                 N 
               
               
                 ATOM 
                 949 
                 CA 
                 LYS 
                 B 
                 12 
                 65.231 
                 30.116 
                 −1.671 
                 1.00 
                 35.59 
                 C 
               
               
                 ATOM 
                 950 
                 CB 
                 LYS 
                 B 
                 12 
                 64.089 
                 29.143 
                 −1.356 
                 1.00 
                 35.82 
                 C 
               
               
                 ATOM 
                 951 
                 CG 
                 LYS 
                 B 
                 12 
                 64.455 
                 27.976 
                 −0.437 
                 1.00 
                 36.08 
                 C 
               
               
                 ATOM 
                 952 
                 CD 
                 LYS 
                 B 
                 12 
                 65.410 
                 27.000 
                 −1.110 
                 1.00 
                 35.78 
                 C 
               
               
                 ATOM 
                 953 
                 CE 
                 LYS 
                 B 
                 12 
                 65.351 
                 25.656 
                 −0.461 
                 1.00 
                 35.08 
                 C 
               
               
                 ATOM 
                 954 
                 NZ 
                 LYS 
                 B 
                 12 
                 66.015 
                 24.710 
                 −1.348 
                 1.00 
                 35.28 
                 N 
               
               
                 ATOM 
                 955 
                 C 
                 LYS 
                 B 
                 12 
                 64.736 
                 31.152 
                 −2.664 
                 1.00 
                 34.87 
                 C 
               
               
                 ATOM 
                 956 
                 O 
                 LYS 
                 B 
                 12 
                 64.335 
                 32.253 
                 −2.247 
                 1.00 
                 35.65 
                 O 
               
               
                 ATOM 
                 957 
                 N 
                 GLU 
                 B 
                 13 
                 64.771 
                 30.801 
                 −3.956 
                 1.00 
                 33.28 
                 N 
               
               
                 ATOM 
                 958 
                 CA 
                 GLU 
                 B 
                 13 
                 64.308 
                 31.653 
                 −5.056 
                 1.00 
                 31.58 
                 C 
               
               
                 ATOM 
                 959 
                 CB 
                 GLU 
                 B 
                 13 
                 65.119 
                 31.370 
                 −6.306 
                 1.00 
                 31.34 
                 C 
               
               
                 ATOM 
                 960 
                 CG 
                 GLU 
                 B 
                 13 
                 66.376 
                 32.163 
                 −6.380 
                 1.00 
                 31.28 
                 C 
               
               
                 ATOM 
                 961 
                 CD 
                 GLU 
                 B 
                 13 
                 67.229 
                 31.761 
                 −7.540 
                 1.00 
                 32.53 
                 C 
               
               
                 ATOM 
                 962 
                 OE1 
                 GLU 
                 B 
                 13 
                 68.028 
                 30.799 
                 −7.409 
                 1.00 
                 32.67 
                 O 
               
               
                 ATOM 
                 963 
                 OE2 
                 GLU 
                 B 
                 13 
                 67.106 
                 32.426 
                 −8.586 
                 1.00 
                 32.70 
                 O 
               
               
                 ATOM 
                 964 
                 C 
                 GLU 
                 B 
                 13 
                 62.837 
                 31.432 
                 −5.359 
                 1.00 
                 31.03 
                 C 
               
               
                 ATOM 
                 965 
                 O 
                 GLU 
                 B 
                 13 
                 62.301 
                 30.362 
                 −5.087 
                 1.00 
                 31.03 
                 O 
               
               
                 ATOM 
                 966 
                 N 
                 THR 
                 B 
                 14 
                 62.184 
                 32.442 
                 −5.923 
                 1.00 
                 30.46 
                 N 
               
               
                 ATOM 
                 967 
                 CA 
                 THR 
                 B 
                 14 
                 60.759 
                 32.369 
                 −6.200 
                 1.00 
                 30.13 
                 C 
               
               
                 ATOM 
                 968 
                 CB 
                 THR 
                 B 
                 14 
                 60.240 
                 33.634 
                 −6.893 
                 1.00 
                 29.79 
                 C 
               
               
                 ATOM 
                 969 
                 OG1 
                 THR 
                 B 
                 14 
                 60.521 
                 34.754 
                 −6.071 
                 1.00 
                 29.96 
                 O 
               
               
                 ATOM 
                 970 
                 CG2 
                 THR 
                 B 
                 14 
                 58.743 
                 33.592 
                 −7.055 
                 1.00 
                 29.82 
                 C 
               
               
                 ATOM 
                 971 
                 C 
                 THR 
                 B 
                 14 
                 60.559 
                 31.177 
                 −7.101 
                 1.00 
                 30.18 
                 C 
               
               
                 ATOM 
                 972 
                 O 
                 THR 
                 B 
                 14 
                 61.333 
                 30.971 
                 −8.031 
                 1.00 
                 30.27 
                 O 
               
               
                 ATOM 
                 973 
                 N 
                 GLY 
                 B 
                 15 
                 59.553 
                 30.369 
                 −6.791 
                 1.00 
                 30.03 
                 N 
               
               
                 ATOM 
                 974 
                 CA 
                 GLY 
                 B 
                 15 
                 59.248 
                 29.200 
                 −7.588 
                 1.00 
                 30.02 
                 C 
               
               
                 ATOM 
                 975 
                 C 
                 GLY 
                 B 
                 15 
                 59.658 
                 27.906 
                 −6.923 
                 1.00 
                 30.20 
                 C 
               
               
                 ATOM 
                 976 
                 O 
                 GLY 
                 B 
                 15 
                 59.023 
                 26.880 
                 −7.150 
                 1.00 
                 31.13 
                 O 
               
               
                 ATOM 
                 977 
                 N 
                 GLU 
                 B 
                 16 
                 60.707 
                 27.941 
                 −6.105 
                 1.00 
                 30.13 
                 N 
               
               
                 ATOM 
                 978 
                 CA 
                 GLU 
                 B 
                 16 
                 61.317 
                 26.720 
                 −5.575 
                 1.00 
                 30.09 
                 C 
               
               
                 ATOM 
                 979 
                 CB 
                 GLU 
                 B 
                 16 
                 62.734 
                 26.998 
                 −5.097 
                 1.00 
                 29.57 
                 C 
               
               
                 ATOM 
                 980 
                 CG 
                 GLU 
                 B 
                 16 
                 63.685 
                 27.421 
                 −6.154 
                 1.00 
                 28.93 
                 C 
               
               
                 ATOM 
                 981 
                 CD 
                 GLU 
                 B 
                 16 
                 65.140 
                 27.353 
                 −5.687 
                 1.00 
                 30.00 
                 C 
               
               
                 ATOM 
                 982 
                 OE1 
                 GLU 
                 B 
                 16 
                 65.563 
                 28.203 
                 −4.863 
                 1.00 
                 28.19 
                 O 
               
               
                 ATOM 
                 983 
                 OE2 
                 GLU 
                 B 
                 16 
                 65.877 
                 26.449 
                 −6.162 
                 1.00 
                 30.14 
                 O 
               
               
                 ATOM 
                 984 
                 C 
                 GLU 
                 B 
                 16 
                 60.509 
                 26.160 
                 −4.421 
                 1.00 
                 30.54 
                 C 
               
               
                 ATOM 
                 985 
                 O 
                 GLU 
                 B 
                 16 
                 59.576 
                 26.799 
                 −3.965 
                 1.00 
                 30.94 
                 O 
               
               
                 ATOM 
                 986 
                 N 
                 SER 
                 B 
                 17 
                 60.885 
                 24.966 
                 −3.961 
                 1.00 
                 31.53 
                 N 
               
               
                 ATOM 
                 987 
                 CA 
                 SER 
                 B 
                 17 
                 60.337 
                 24.316 
                 −2.742 
                 1.00 
                 32.44 
                 C 
               
               
                 ATOM 
                 988 
                 CB 
                 SER 
                 B 
                 17 
                 60.147 
                 22.809 
                 −2.963 
                 1.00 
                 32.39 
                 C 
               
               
                 ATOM 
                 989 
                 OG 
                 SER 
                 B 
                 17 
                 59.425 
                 22.522 
                 −4.143 
                 1.00 
                 34.08 
                 O 
               
               
                 ATOM 
                 990 
                 C 
                 SER 
                 B 
                 17 
                 61.245 
                 24.448 
                 −1.511 
                 1.00 
                 32.74 
                 C 
               
               
                 ATOM 
                 991 
                 O 
                 SER 
                 B 
                 17 
                 62.466 
                 24.648 
                 −1.628 
                 1.00 
                 32.92 
                 O 
               
               
                 ATOM 
                 992 
                 N 
                 LEU 
                 B 
                 18 
                 60.647 
                 24.275 
                 −0.334 
                 1.00 
                 33.17 
                 N 
               
               
                 ATOM 
                 993 
                 CA 
                 LEU 
                 B 
                 18 
                 61.402 
                 24.112 
                 0.902 
                 1.00 
                 33.49 
                 C 
               
               
                 ATOM 
                 994 
                 CB 
                 LEU 
                 B 
                 18 
                 61.090 
                 25.264 
                 1.839 
                 1.00 
                 33.92 
                 C 
               
               
                 ATOM 
                 995 
                 CG 
                 LEU 
                 B 
                 18 
                 62.099 
                 25.810 
                 2.846 
                 1.00 
                 35.15 
                 C 
               
               
                 ATOM 
                 996 
                 CD1 
                 LEU 
                 B 
                 18 
                 61.288 
                 26.335 
                 4.010 
                 1.00 
                 36.95 
                 C 
               
               
                 ATOM 
                 997 
                 CD2 
                 LEU 
                 B 
                 18 
                 63.143 
                 24.818 
                 3.319 
                 1.00 
                 36.58 
                 C 
               
               
                 ATOM 
                 998 
                 C 
                 LEU 
                 B 
                 18 
                 60.962 
                 22.843 
                 1.590 
                 1.00 
                 33.50 
                 C 
               
               
                 ATOM 
                 999 
                 O 
                 LEU 
                 B 
                 18 
                 59.751 
                 22.616 
                 1.741 
                 1.00 
                 33.48 
                 O 
               
               
                 ATOM 
                 1000 
                 N 
                 THR 
                 B 
                 19 
                 61.917 
                 22.020 
                 2.014 
                 1.00 
                 33.67 
                 N 
               
               
                 ATOM 
                 1001 
                 CA 
                 THR 
                 B 
                 19 
                 61.592 
                 21.011 
                 3.034 
                 1.00 
                 34.29 
                 C 
               
               
                 ATOM 
                 1002 
                 CB 
                 THR 
                 B 
                 19 
                 62.028 
                 19.597 
                 2.665 
                 1.00 
                 33.80 
                 C 
               
               
                 ATOM 
                 1003 
                 OG1 
                 THR 
                 B 
                 19 
                 61.709 
                 19.353 
                 1.297 
                 1.00 
                 33.83 
                 O 
               
               
                 ATOM 
                 1004 
                 CG2 
                 THR 
                 B 
                 19 
                 61.269 
                 18.597 
                 3.500 
                 1.00 
                 33.92 
                 C 
               
               
                 ATOM 
                 1005 
                 C 
                 THR 
                 B 
                 19 
                 62.128 
                 21.359 
                 4.415 
                 1.00 
                 34.84 
                 C 
               
               
                 ATOM 
                 1006 
                 O 
                 THR 
                 B 
                 19 
                 63.333 
                 21.594 
                 4.583 
                 1.00 
                 35.20 
                 O 
               
               
                 ATOM 
                 1007 
                 N 
                 ILE 
                 B 
                 20 
                 61.213 
                 21.412 
                 5.382 
                 1.00 
                 35.38 
                 N 
               
               
                 ATOM 
                 1008 
                 CA 
                 ILE 
                 B 
                 20 
                 61.551 
                 21.554 
                 6.789 
                 1.00 
                 36.25 
                 C 
               
               
                 ATOM 
                 1009 
                 CB 
                 ILE 
                 B 
                 20 
                 60.621 
                 22.549 
                 7.507 
                 1.00 
                 36.25 
                 C 
               
               
                 ATOM 
                 1010 
                 CG1 
                 ILE 
                 B 
                 20 
                 60.585 
                 23.884 
                 6.750 
                 1.00 
                 35.44 
                 C 
               
               
                 ATOM 
                 1011 
                 CD1 
                 ILE 
                 B 
                 20 
                 59.842 
                 25.014 
                 7.450 
                 1.00 
                 35.83 
                 C 
               
               
                 ATOM 
                 1012 
                 CG2 
                 ILE 
                 B 
                 20 
                 61.041 
                 22.685 
                 9.009 
                 1.00 
                 36.74 
                 C 
               
               
                 ATOM 
                 1013 
                 C 
                 ILE 
                 B 
                 20 
                 61.369 
                 20.187 
                 7.443 
                 1.00 
                 37.37 
                 C 
               
               
                 ATOM 
                 1014 
                 O 
                 ILE 
                 B 
                 20 
                 60.321 
                 19.573 
                 7.293 
                 1.00 
                 37.80 
                 O 
               
               
                 ATOM 
                 1015 
                 N 
                 ASN 
                 B 
                 21 
                 62.393 
                 19.721 
                 8.160 
                 1.00 
                 38.67 
                 N 
               
               
                 ATOM 
                 1016 
                 CA 
                 ASN 
                 B 
                 21 
                 62.363 
                 18.449 
                 8.884 
                 1.00 
                 39.53 
                 C 
               
               
                 ATOM 
                 1017 
                 CB 
                 ASN 
                 B 
                 21 
                 63.610 
                 17.644 
                 8.584 
                 1.00 
                 39.82 
                 C 
               
               
                 ATOM 
                 1018 
                 CG 
                 ASN 
                 B 
                 21 
                 63.536 
                 16.947 
                 7.256 
                 1.00 
                 41.31 
                 C 
               
               
                 ATOM 
                 1019 
                 OD1 
                 ASN 
                 B 
                 21 
                 64.121 
                 17.392 
                 6.280 
                 1.00 
                 43.13 
                 O 
               
               
                 ATOM 
                 1020 
                 ND2 
                 ASN 
                 B 
                 21 
                 62.793 
                 15.855 
                 7.203 
                 1.00 
                 44.31 
                 N 
               
               
                 ATOM 
                 1021 
                 C 
                 ASN 
                 B 
                 21 
                 62.315 
                 18.677 
                 10.368 
                 1.00 
                 39.99 
                 C 
               
               
                 ATOM 
                 1022 
                 O 
                 ASN 
                 B 
                 21 
                 62.958 
                 19.585 
                 10.874 
                 1.00 
                 40.44 
                 O 
               
               
                 ATOM 
                 1023 
                 N 
                 CYS 
                 B 
                 22 
                 61.567 
                 17.835 
                 11.065 
                 1.00 
                 40.38 
                 N 
               
               
                 ATOM 
                 1024 
                 CA 
                 CYS 
                 B 
                 22 
                 61.545 
                 17.849 
                 12.507 
                 1.00 
                 40.90 
                 C 
               
               
                 ATOM 
                 1025 
                 CB 
                 CYS 
                 B 
                 22 
                 60.276 
                 18.529 
                 13.026 
                 1.00 
                 41.39 
                 C 
               
               
                 ATOM 
                 1026 
                 SG 
                 CYS 
                 B 
                 22 
                 60.092 
                 20.330 
                 12.606 
                 1.00 
                 45.04 
                 S 
               
               
                 ATOM 
                 1027 
                 C 
                 CYS 
                 B 
                 22 
                 61.625 
                 16.422 
                 13.020 
                 1.00 
                 40.81 
                 C 
               
               
                 ATOM 
                 1028 
                 O 
                 CYS 
                 B 
                 22 
                 61.075 
                 15.493 
                 12.427 
                 1.00 
                 40.89 
                 O 
               
               
                 ATOM 
                 1029 
                 N 
                 ALA 
                 B 
                 23 
                 62.341 
                 16.246 
                 14.122 
                 1.00 
                 40.97 
                 N 
               
               
                 ATOM 
                 1030 
                 CA 
                 ALA 
                 B 
                 23 
                 62.338 
                 14.972 
                 14.852 
                 1.00 
                 40.61 
                 C 
               
               
                 ATOM 
                 1031 
                 CB 
                 ALA 
                 B 
                 23 
                 63.660 
                 14.228 
                 14.663 
                 1.00 
                 40.21 
                 C 
               
               
                 ATOM 
                 1032 
                 C 
                 ALA 
                 B 
                 23 
                 62.056 
                 15.228 
                 16.333 
                 1.00 
                 40.31 
                 C 
               
               
                 ATOM 
                 1033 
                 O 
                 ALA 
                 B 
                 23 
                 62.728 
                 16.051 
                 16.970 
                 1.00 
                 40.42 
                 O 
               
               
                 ATOM 
                 1034 
                 N 
                 LEU 
                 B 
                 24 
                 61.034 
                 14.558 
                 16.859 
                 1.00 
                 39.95 
                 N 
               
               
                 ATOM 
                 1035 
                 CA 
                 LEU 
                 B 
                 24 
                 60.761 
                 14.558 
                 18.295 
                 1.00 
                 40.06 
                 C 
               
               
                 ATOM 
                 1036 
                 CB 
                 LEU 
                 B 
                 24 
                 59.343 
                 14.053 
                 18.581 
                 1.00 
                 39.89 
                 C 
               
               
                 ATOM 
                 1037 
                 CG 
                 LEU 
                 B 
                 24 
                 58.860 
                 13.966 
                 20.025 
                 1.00 
                 39.41 
                 C 
               
               
                 ATOM 
                 1038 
                 CD1 
                 LEU 
                 B 
                 24 
                 57.522 
                 13.239 
                 20.086 
                 1.00 
                 39.03 
                 C 
               
               
                 ATOM 
                 1039 
                 CD2 
                 LEU 
                 B 
                 24 
                 58.767 
                 15.349 
                 20.667 
                 1.00 
                 40.01 
                 C 
               
               
                 ATOM 
                 1040 
                 C 
                 LEU 
                 B 
                 24 
                 61.800 
                 13.669 
                 18.972 
                 1.00 
                 40.18 
                 C 
               
               
                 ATOM 
                 1041 
                 O 
                 LEU 
                 B 
                 24 
                 61.938 
                 12.504 
                 18.625 
                 1.00 
                 40.40 
                 O 
               
               
                 ATOM 
                 1042 
                 N 
                 LYS 
                 B 
                 25 
                 62.537 
                 14.230 
                 19.922 
                 1.00 
                 40.26 
                 N 
               
               
                 ATOM 
                 1043 
                 CA 
                 LYS 
                 B 
                 25 
                 63.727 
                 13.593 
                 20.444 
                 1.00 
                 40.45 
                 C 
               
               
                 ATOM 
                 1044 
                 CB 
                 LYS 
                 B 
                 25 
                 64.936 
                 14.452 
                 20.092 
                 1.00 
                 40.39 
                 C 
               
               
                 ATOM 
                 1045 
                 CG 
                 LYS 
                 B 
                 25 
                 66.143 
                 13.668 
                 19.606 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 1046 
                 CD 
                 LYS 
                 B 
                 25 
                 66.036 
                 13.256 
                 18.143 
                 1.00 
                 43.39 
                 C 
               
               
                 ATOM 
                 1047 
                 CE 
                 LYS 
                 B 
                 25 
                 66.106 
                 14.451 
                 17.218 
                 1.00 
                 45.53 
                 C 
               
               
                 ATOM 
                 1048 
                 NZ 
                 LYS 
                 B 
                 25 
                 67.340 
                 15.285 
                 17.411 
                 1.00 
                 46.91 
                 N 
               
               
                 ATOM 
                 1049 
                 C 
                 LYS 
                 B 
                 25 
                 63.586 
                 13.471 
                 21.947 
                 1.00 
                 40.69 
                 C 
               
               
                 ATOM 
                 1050 
                 O 
                 LYS 
                 B 
                 25 
                 63.041 
                 14.373 
                 22.579 
                 1.00 
                 41.02 
                 O 
               
               
                 ATOM 
                 1051 
                 N 
                 ASN 
                 B 
                 26 
                 64.070 
                 12.364 
                 22.512 
                 1.00 
                 40.94 
                 N 
               
               
                 ATOM 
                 1052 
                 CA 
                 ASN 
                 B 
                 26 
                 63.968 
                 12.075 
                 23.952 
                 1.00 
                 41.43 
                 C 
               
               
                 ATOM 
                 1053 
                 CB 
                 ASN 
                 B 
                 26 
                 64.633 
                 13.169 
                 24.793 
                 1.00 
                 41.74 
                 C 
               
               
                 ATOM 
                 1054 
                 CG 
                 ASN 
                 B 
                 26 
                 66.142 
                 13.104 
                 24.770 
                 1.00 
                 42.51 
                 C 
               
               
                 ATOM 
                 1055 
                 OD1 
                 ASN 
                 B 
                 26 
                 66.748 
                 12.119 
                 25.209 
                 1.00 
                 43.67 
                 O 
               
               
                 ATOM 
                 1056 
                 ND2 
                 ASN 
                 B 
                 26 
                 66.766 
                 14.179 
                 24.287 
                 1.00 
                 42.58 
                 N 
               
               
                 ATOM 
                 1057 
                 C 
                 ASN 
                 B 
                 26 
                 62.544 
                 11.867 
                 24.473 
                 1.00 
                 41.54 
                 C 
               
               
                 ATOM 
                 1058 
                 O 
                 ASN 
                 B 
                 26 
                 62.279 
                 12.075 
                 25.662 
                 1.00 
                 41.37 
                 O 
               
               
                 ATOM 
                 1059 
                 N 
                 ALA 
                 B 
                 27 
                 61.634 
                 11.468 
                 23.593 
                 1.00 
                 41.65 
                 N 
               
               
                 ATOM 
                 1060 
                 CA 
                 ALA 
                 B 
                 27 
                 60.277 
                 11.196 
                 24.010 
                 1.00 
                 42.12 
                 C 
               
               
                 ATOM 
                 1061 
                 CB 
                 ALA 
                 B 
                 27 
                 59.331 
                 12.088 
                 23.278 
                 1.00 
                 42.06 
                 C 
               
               
                 ATOM 
                 1062 
                 C 
                 ALA 
                 B 
                 27 
                 59.937 
                 9.734 
                 23.764 
                 1.00 
                 42.77 
                 C 
               
               
                 ATOM 
                 1063 
                 O 
                 ALA 
                 B 
                 27 
                 60.152 
                 9.219 
                 22.665 
                 1.00 
                 43.05 
                 O 
               
               
                 ATOM 
                 1064 
                 N 
                 ALA 
                 B 
                 28 
                 59.412 
                 9.067 
                 24.792 
                 1.00 
                 43.31 
                 N 
               
               
                 ATOM 
                 1065 
                 CA 
                 ALA 
                 B 
                 28 
                 59.003 
                 7.658 
                 24.693 
                 1.00 
                 43.96 
                 C 
               
               
                 ATOM 
                 1066 
                 CB 
                 ALA 
                 B 
                 28 
                 59.334 
                 6.914 
                 25.977 
                 1.00 
                 43.78 
                 C 
               
               
                 ATOM 
                 1067 
                 C 
                 ALA 
                 B 
                 28 
                 57.512 
                 7.525 
                 24.359 
                 1.00 
                 44.39 
                 C 
               
               
                 ATOM 
                 1068 
                 O 
                 ALA 
                 B 
                 28 
                 57.020 
                 6.441 
                 24.023 
                 1.00 
                 44.65 
                 O 
               
               
                 ATOM 
                 1069 
                 N 
                 ASP 
                 B 
                 29 
                 56.803 
                 8.641 
                 24.445 
                 1.00 
                 44.56 
                 N 
               
               
                 ATOM 
                 1070 
                 CA 
                 ASP 
                 B 
                 29 
                 55.377 
                 8.684 
                 24.176 
                 1.00 
                 44.63 
                 C 
               
               
                 ATOM 
                 1071 
                 CB 
                 ASP 
                 B 
                 29 
                 54.830 
                 9.999 
                 24.713 
                 1.00 
                 45.08 
                 C 
               
               
                 ATOM 
                 1072 
                 CG 
                 ASP 
                 B 
                 29 
                 55.468 
                 10.387 
                 26.038 
                 1.00 
                 47.13 
                 C 
               
               
                 ATOM 
                 1073 
                 OD1 
                 ASP 
                 B 
                 29 
                 56.306 
                 11.328 
                 26.063 
                 1.00 
                 48.02 
                 O 
               
               
                 ATOM 
                 1074 
                 OD2 
                 ASP 
                 B 
                 29 
                 55.154 
                 9.712 
                 27.051 
                 1.00 
                 50.45 
                 O 
               
               
                 ATOM 
                 1075 
                 C 
                 ASP 
                 B 
                 29 
                 55.147 
                 8.581 
                 22.676 
                 1.00 
                 44.03 
                 C 
               
               
                 ATOM 
                 1076 
                 O 
                 ASP 
                 B 
                 29 
                 56.040 
                 8.913 
                 21.893 
                 1.00 
                 43.92 
                 O 
               
               
                 ATOM 
                 1077 
                 N 
                 ASP 
                 B 
                 30 
                 53.968 
                 8.112 
                 22.277 
                 1.00 
                 43.17 
                 N 
               
               
                 ATOM 
                 1078 
                 CA 
                 ASP 
                 B 
                 30 
                 53.645 
                 8.001 
                 20.858 
                 1.00 
                 42.91 
                 C 
               
               
                 ATOM 
                 1079 
                 CB 
                 ASP 
                 B 
                 30 
                 52.414 
                 7.092 
                 20.649 
                 1.00 
                 43.11 
                 C 
               
               
                 ATOM 
                 1080 
                 CG 
                 ASP 
                 B 
                 30 
                 52.744 
                 5.580 
                 20.769 
                 1.00 
                 43.85 
                 C 
               
               
                 ATOM 
                 1081 
                 OD1 
                 ASP 
                 B 
                 30 
                 53.889 
                 5.165 
                 20.448 
                 1.00 
                 44.60 
                 O 
               
               
                 ATOM 
                 1082 
                 OD2 
                 ASP 
                 B 
                 30 
                 51.845 
                 4.801 
                 21.180 
                 1.00 
                 42.81 
                 O 
               
               
                 ATOM 
                 1083 
                 C 
                 ASP 
                 B 
                 30 
                 53.418 
                 9.389 
                 20.238 
                 1.00 
                 42.32 
                 C 
               
               
                 ATOM 
                 1084 
                 O 
                 ASP 
                 B 
                 30 
                 52.808 
                 10.239 
                 20.871 
                 1.00 
                 42.41 
                 O 
               
               
                 ATOM 
                 1085 
                 N 
                 LEU 
                 B 
                 31 
                 53.922 
                 9.627 
                 19.024 
                 1.00 
                 41.59 
                 N 
               
               
                 ATOM 
                 1086 
                 CA 
                 LEU 
                 B 
                 31 
                 53.573 
                 10.839 
                 18.262 
                 1.00 
                 41.02 
                 C 
               
               
                 ATOM 
                 1087 
                 CB 
                 LEU 
                 B 
                 31 
                 54.483 
                 11.003 
                 17.049 
                 1.00 
                 40.87 
                 C 
               
               
                 ATOM 
                 1088 
                 CG 
                 LEU 
                 B 
                 31 
                 54.888 
                 12.417 
                 16.609 
                 1.00 
                 41.41 
                 C 
               
               
                 ATOM 
                 1089 
                 CD1 
                 LEU 
                 B 
                 31 
                 53.857 
                 13.498 
                 16.958 
                 1.00 
                 42.54 
                 C 
               
               
                 ATOM 
                 1090 
                 CD2 
                 LEU 
                 B 
                 31 
                 55.243 
                 12.466 
                 15.126 
                 1.00 
                 40.70 
                 C 
               
               
                 ATOM 
                 1091 
                 C 
                 LEU 
                 B 
                 31 
                 52.112 
                 10.778 
                 17.776 
                 1.00 
                 40.93 
                 C 
               
               
                 ATOM 
                 1092 
                 O 
                 LEU 
                 B 
                 31 
                 51.776 
                 9.952 
                 16.921 
                 1.00 
                 40.54 
                 O 
               
               
                 ATOM 
                 1093 
                 N 
                 GLU 
                 B 
                 32 
                 51.260 
                 11.658 
                 18.309 
                 1.00 
                 40.64 
                 N 
               
               
                 ATOM 
                 1094 
                 CA 
                 GLU 
                 B 
                 32 
                 49.828 
                 11.619 
                 18.018 
                 1.00 
                 40.28 
                 C 
               
               
                 ATOM 
                 1095 
                 CB 
                 GLU 
                 B 
                 32 
                 48.993 
                 11.809 
                 19.287 
                 1.00 
                 40.23 
                 C 
               
               
                 ATOM 
                 1096 
                 CG 
                 GLU 
                 B 
                 32 
                 49.122 
                 10.694 
                 20.299 
                 1.00 
                 42.07 
                 C 
               
               
                 ATOM 
                 1097 
                 CD 
                 GLU 
                 B 
                 32 
                 48.607 
                 9.314 
                 19.806 
                 1.00 
                 46.47 
                 C 
               
               
                 ATOM 
                 1098 
                 OE1 
                 GLU 
                 B 
                 32 
                 48.930 
                 8.303 
                 20.502 
                 1.00 
                 47.39 
                 O 
               
               
                 ATOM 
                 1099 
                 OE2 
                 GLU 
                 B 
                 32 
                 47.886 
                 9.226 
                 18.756 
                 1.00 
                 45.59 
                 O 
               
               
                 ATOM 
                 1100 
                 C 
                 GLU 
                 B 
                 32 
                 49.390 
                 12.594 
                 16.927 
                 1.00 
                 39.99 
                 C 
               
               
                 ATOM 
                 1101 
                 O 
                 GLU 
                 B 
                 32 
                 48.651 
                 12.215 
                 16.027 
                 1.00 
                 39.79 
                 O 
               
               
                 ATOM 
                 1102 
                 N 
                 ARG 
                 B 
                 33 
                 49.824 
                 13.846 
                 17.000 
                 1.00 
                 40.07 
                 N 
               
               
                 ATOM 
                 1103 
                 CA 
                 ARG 
                 B 
                 33 
                 49.492 
                 14.790 
                 15.941 
                 1.00 
                 40.54 
                 C 
               
               
                 ATOM 
                 1104 
                 CB 
                 ARG 
                 B 
                 33 
                 48.153 
                 15.483 
                 16.185 
                 1.00 
                 40.81 
                 C 
               
               
                 ATOM 
                 1105 
                 CG 
                 ARG 
                 B 
                 33 
                 48.136 
                 16.524 
                 17.257 
                 1.00 
                 41.98 
                 C 
               
               
                 ATOM 
                 1106 
                 CD 
                 ARG 
                 B 
                 33 
                 46.826 
                 17.280 
                 17.238 
                 1.00 
                 45.56 
                 C 
               
               
                 ATOM 
                 1107 
                 NE 
                 ARG 
                 B 
                 33 
                 46.749 
                 18.207 
                 18.365 
                 1.00 
                 49.98 
                 N 
               
               
                 ATOM 
                 1108 
                 CZ 
                 ARG 
                 B 
                 33 
                 47.272 
                 19.437 
                 18.352 
                 1.00 
                 53.89 
                 C 
               
               
                 ATOM 
                 1109 
                 NH1 
                 ARG 
                 B 
                 33 
                 47.168 
                 20.217 
                 19.434 
                 1.00 
                 54.30 
                 N 
               
               
                 ATOM 
                 1110 
                 NH2 
                 ARG 
                 B 
                 33 
                 47.903 
                 19.894 
                 17.255 
                 1.00 
                 54.63 
                 N 
               
               
                 ATOM 
                 1111 
                 C 
                 ARG 
                 B 
                 33 
                 50.601 
                 15.780 
                 15.708 
                 1.00 
                 40.70 
                 C 
               
               
                 ATOM 
                 1112 
                 O 
                 ARG 
                 B 
                 33 
                 51.439 
                 15.977 
                 16.567 
                 1.00 
                 40.72 
                 O 
               
               
                 ATOM 
                 1113 
                 N 
                 THR 
                 B 
                 34 
                 50.607 
                 16.390 
                 14.531 
                 1.00 
                 41.39 
                 N 
               
               
                 ATOM 
                 1114 
                 CA 
                 THR 
                 B 
                 34 
                 51.682 
                 17.299 
                 14.136 
                 1.00 
                 42.45 
                 C 
               
               
                 ATOM 
                 1115 
                 CB 
                 THR 
                 B 
                 34 
                 52.565 
                 16.654 
                 13.051 
                 1.00 
                 42.54 
                 C 
               
               
                 ATOM 
                 1116 
                 OG1 
                 THR 
                 B 
                 34 
                 51.735 
                 16.068 
                 12.036 
                 1.00 
                 43.44 
                 O 
               
               
                 ATOM 
                 1117 
                 CG2 
                 THR 
                 B 
                 34 
                 53.409 
                 15.560 
                 13.650 
                 1.00 
                 42.44 
                 C 
               
               
                 ATOM 
                 1118 
                 C 
                 THR 
                 B 
                 34 
                 51.123 
                 18.643 
                 13.657 
                 1.00 
                 42.88 
                 C 
               
               
                 ATOM 
                 1119 
                 O 
                 THR 
                 B 
                 34 
                 50.017 
                 18.702 
                 13.129 
                 1.00 
                 43.42 
                 O 
               
               
                 ATOM 
                 1120 
                 N 
                 ASP 
                 B 
                 35 
                 51.884 
                 19.715 
                 13.848 
                 1.00 
                 43.44 
                 N 
               
               
                 ATOM 
                 1121 
                 CA 
                 ASP 
                 B 
                 35 
                 51.423 
                 21.088 
                 13.586 
                 1.00 
                 43.97 
                 C 
               
               
                 ATOM 
                 1122 
                 CB 
                 ASP 
                 B 
                 35 
                 51.229 
                 21.841 
                 14.892 
                 1.00 
                 44.87 
                 C 
               
               
                 ATOM 
                 1123 
                 CG 
                 ASP 
                 B 
                 35 
                 49.801 
                 21.859 
                 15.358 
                 1.00 
                 49.02 
                 C 
               
               
                 ATOM 
                 1124 
                 OD1 
                 ASP 
                 B 
                 35 
                 48.923 
                 21.176 
                 14.748 
                 1.00 
                 51.38 
                 O 
               
               
                 ATOM 
                 1125 
                 OD2 
                 ASP 
                 B 
                 35 
                 49.570 
                 22.578 
                 16.366 
                 1.00 
                 52.82 
                 O 
               
               
                 ATOM 
                 1126 
                 C 
                 ASP 
                 B 
                 35 
                 52.478 
                 21.866 
                 12.859 
                 1.00 
                 43.37 
                 C 
               
               
                 ATOM 
                 1127 
                 O 
                 ASP 
                 B 
                 35 
                 53.678 
                 21.613 
                 13.029 
                 1.00 
                 43.51 
                 O 
               
               
                 ATOM 
                 1128 
                 N 
                 TRP 
                 B 
                 36 
                 52.027 
                 22.850 
                 12.088 
                 1.00 
                 42.37 
                 N 
               
               
                 ATOM 
                 1129 
                 CA 
                 TRP 
                 B 
                 36 
                 52.906 
                 23.794 
                 11.423 
                 1.00 
                 41.24 
                 C 
               
               
                 ATOM 
                 1130 
                 CB 
                 TRP 
                 B 
                 36 
                 53.162 
                 23.366 
                 9.974 
                 1.00 
                 40.25 
                 C 
               
               
                 ATOM 
                 1131 
                 CG 
                 TRP 
                 B 
                 36 
                 53.820 
                 22.010 
                 9.910 
                 1.00 
                 39.18 
                 C 
               
               
                 ATOM 
                 1132 
                 CD1 
                 TRP 
                 B 
                 36 
                 53.189 
                 20.808 
                 9.912 
                 1.00 
                 39.03 
                 C 
               
               
                 ATOM 
                 1133 
                 NE1 
                 TRP 
                 B 
                 36 
                 54.105 
                 19.784 
                 9.875 
                 1.00 
                 39.65 
                 N 
               
               
                 ATOM 
                 1134 
                 CE2 
                 TRP 
                 B 
                 36 
                 55.365 
                 20.311 
                 9.861 
                 1.00 
                 37.81 
                 C 
               
               
                 ATOM 
                 1135 
                 CD2 
                 TRP 
                 B 
                 36 
                 55.231 
                 21.719 
                 9.889 
                 1.00 
                 37.66 
                 C 
               
               
                 ATOM 
                 1136 
                 CE3 
                 TRP 
                 B 
                 36 
                 56.383 
                 22.508 
                 9.886 
                 1.00 
                 36.22 
                 C 
               
               
                 ATOM 
                 1137 
                 CZ3 
                 TRP 
                 B 
                 36 
                 57.604 
                 21.887 
                 9.856 
                 1.00 
                 38.69 
                 C 
               
               
                 ATOM 
                 1138 
                 CH2 
                 TRP 
                 B 
                 36 
                 57.707 
                 20.471 
                 9.833 
                 1.00 
                 39.76 
                 C 
               
               
                 ATOM 
                 1139 
                 CZ2 
                 TRP 
                 B 
                 36 
                 56.593 
                 19.674 
                 9.839 
                 1.00 
                 38.23 
                 C 
               
               
                 ATOM 
                 1140 
                 C 
                 TRP 
                 B 
                 36 
                 52.325 
                 25.204 
                 11.545 
                 1.00 
                 41.48 
                 C 
               
               
                 ATOM 
                 1141 
                 O 
                 TRP 
                 B 
                 36 
                 51.133 
                 25.424 
                 11.358 
                 1.00 
                 41.17 
                 O 
               
               
                 ATOM 
                 1142 
                 N 
                 TYR 
                 B 
                 37 
                 53.187 
                 26.148 
                 11.899 
                 1.00 
                 42.11 
                 N 
               
               
                 ATOM 
                 1143 
                 CA 
                 TYR 
                 B 
                 37 
                 52.801 
                 27.525 
                 12.143 
                 1.00 
                 42.12 
                 C 
               
               
                 ATOM 
                 1144 
                 CB 
                 TYR 
                 B 
                 37 
                 52.809 
                 27.793 
                 13.641 
                 1.00 
                 43.09 
                 C 
               
               
                 ATOM 
                 1145 
                 CG 
                 TYR 
                 B 
                 37 
                 51.595 
                 27.209 
                 14.331 
                 1.00 
                 44.97 
                 C 
               
               
                 ATOM 
                 1146 
                 CD1 
                 TYR 
                 B 
                 37 
                 51.643 
                 25.957 
                 14.942 
                 1.00 
                 46.07 
                 C 
               
               
                 ATOM 
                 1147 
                 CE1 
                 TYR 
                 B 
                 37 
                 50.518 
                 25.408 
                 15.566 
                 1.00 
                 45.11 
                 C 
               
               
                 ATOM 
                 1148 
                 CZ 
                 TYR 
                 B 
                 37 
                 49.328 
                 26.125 
                 15.579 
                 1.00 
                 45.99 
                 C 
               
               
                 ATOM 
                 1149 
                 OH 
                 TYR 
                 B 
                 37 
                 48.193 
                 25.612 
                 16.193 
                 1.00 
                 47.09 
                 O 
               
               
                 ATOM 
                 1150 
                 CE2 
                 TYR 
                 B 
                 37 
                 49.256 
                 27.373 
                 14.979 
                 1.00 
                 46.28 
                 C 
               
               
                 ATOM 
                 1151 
                 CD2 
                 TYR 
                 B 
                 37 
                 50.383 
                 27.902 
                 14.351 
                 1.00 
                 46.48 
                 C 
               
               
                 ATOM 
                 1152 
                 C 
                 TYR 
                 B 
                 37 
                 53.774 
                 28.430 
                 11.435 
                 1.00 
                 41.70 
                 C 
               
               
                 ATOM 
                 1153 
                 O 
                 TYR 
                 B 
                 37 
                 54.956 
                 28.087 
                 11.285 
                 1.00 
                 41.41 
                 O 
               
               
                 ATOM 
                 1154 
                 N 
                 ARG 
                 B 
                 38 
                 53.280 
                 29.572 
                 10.972 
                 1.00 
                 41.33 
                 N 
               
               
                 ATOM 
                 1155 
                 CA 
                 ARG 
                 B 
                 38 
                 54.138 
                 30.506 
                 10.257 
                 1.00 
                 41.41 
                 C 
               
               
                 ATOM 
                 1156 
                 CB 
                 ARG 
                 B 
                 38 
                 54.109 
                 30.221 
                 8.748 
                 1.00 
                 41.64 
                 C 
               
               
                 ATOM 
                 1157 
                 CG 
                 ARG 
                 B 
                 38 
                 52.855 
                 30.715 
                 8.033 
                 1.00 
                 43.80 
                 C 
               
               
                 ATOM 
                 1158 
                 CD 
                 ARG 
                 B 
                 38 
                 52.500 
                 29.877 
                 6.808 
                 1.00 
                 48.30 
                 C 
               
               
                 ATOM 
                 1159 
                 NE 
                 ARG 
                 B 
                 38 
                 53.297 
                 30.168 
                 5.608 
                 1.00 
                 51.15 
                 N 
               
               
                 ATOM 
                 1160 
                 CZ 
                 ARG 
                 B 
                 38 
                 52.875 
                 30.864 
                 4.545 
                 1.00 
                 51.98 
                 C 
               
               
                 ATOM 
                 1161 
                 NH1 
                 ARG 
                 B 
                 38 
                 51.638 
                 31.388 
                 4.478 
                 1.00 
                 48.85 
                 N 
               
               
                 ATOM 
                 1162 
                 NH2 
                 ARG 
                 B 
                 38 
                 53.722 
                 31.042 
                 3.537 
                 1.00 
                 52.22 
                 N 
               
               
                 ATOM 
                 1163 
                 C 
                 ARG 
                 B 
                 38 
                 53.808 
                 31.967 
                 10.558 
                 1.00 
                 40.80 
                 C 
               
               
                 ATOM 
                 1164 
                 O 
                 ARG 
                 B 
                 38 
                 52.644 
                 32.328 
                 10.714 
                 1.00 
                 40.56 
                 O 
               
               
                 ATOM 
                 1165 
                 N 
                 THR 
                 B 
                 39 
                 54.855 
                 32.784 
                 10.665 
                 1.00 
                 40.49 
                 N 
               
               
                 ATOM 
                 1166 
                 CA 
                 THR 
                 B 
                 39 
                 54.737 
                 34.245 
                 10.769 
                 1.00 
                 40.14 
                 C 
               
               
                 ATOM 
                 1167 
                 CB 
                 THR 
                 B 
                 39 
                 55.282 
                 34.757 
                 12.108 
                 1.00 
                 39.95 
                 C 
               
               
                 ATOM 
                 1168 
                 OG1 
                 THR 
                 B 
                 39 
                 54.467 
                 34.241 
                 13.161 
                 1.00 
                 40.90 
                 O 
               
               
                 ATOM 
                 1169 
                 CG2 
                 THR 
                 B 
                 39 
                 55.296 
                 36.288 
                 12.165 
                 1.00 
                 38.83 
                 C 
               
               
                 ATOM 
                 1170 
                 C 
                 THR 
                 B 
                 39 
                 55.517 
                 34.853 
                 9.604 
                 1.00 
                 40.12 
                 C 
               
               
                 ATOM 
                 1171 
                 O 
                 THR 
                 B 
                 39 
                 56.759 
                 34.847 
                 9.588 
                 1.00 
                 39.84 
                 O 
               
               
                 ATOM 
                 1172 
                 N 
                 THR 
                 B 
                 40 
                 54.787 
                 35.362 
                 8.619 
                 1.00 
                 39.67 
                 N 
               
               
                 ATOM 
                 1173 
                 CA 
                 THR 
                 B 
                 40 
                 55.403 
                 35.647 
                 7.341 
                 1.00 
                 39.66 
                 C 
               
               
                 ATOM 
                 1174 
                 CB 
                 THR 
                 B 
                 40 
                 54.873 
                 34.699 
                 6.241 
                 1.00 
                 39.69 
                 C 
               
               
                 ATOM 
                 1175 
                 OG1 
                 THR 
                 B 
                 40 
                 53.465 
                 34.856 
                 6.095 
                 1.00 
                 40.00 
                 O 
               
               
                 ATOM 
                 1176 
                 CG2 
                 THR 
                 B 
                 40 
                 55.165 
                 33.264 
                 6.577 
                 1.00 
                 40.25 
                 C 
               
               
                 ATOM 
                 1177 
                 C 
                 THR 
                 B 
                 40 
                 55.161 
                 37.070 
                 6.941 
                 1.00 
                 39.57 
                 C 
               
               
                 ATOM 
                 1178 
                 O 
                 THR 
                 B 
                 40 
                 54.336 
                 37.741 
                 7.553 
                 1.00 
                 39.87 
                 O 
               
               
                 ATOM 
                 1179 
                 N 
                 LEU 
                 B 
                 41 
                 55.876 
                 37.529 
                 5.918 
                 1.00 
                 39.69 
                 N 
               
               
                 ATOM 
                 1180 
                 CA 
                 LEU 
                 B 
                 41 
                 55.682 
                 38.881 
                 5.389 
                 1.00 
                 40.14 
                 C 
               
               
                 ATOM 
                 1181 
                 CB 
                 LEU 
                 B 
                 41 
                 56.620 
                 39.170 
                 4.218 
                 1.00 
                 39.45 
                 C 
               
               
                 ATOM 
                 1182 
                 CG 
                 LEU 
                 B 
                 41 
                 58.064 
                 39.377 
                 4.651 
                 1.00 
                 38.18 
                 C 
               
               
                 ATOM 
                 1183 
                 CD1 
                 LEU 
                 B 
                 41 
                 58.992 
                 39.498 
                 3.463 
                 1.00 
                 36.16 
                 C 
               
               
                 ATOM 
                 1184 
                 CD2 
                 LEU 
                 B 
                 41 
                 58.149 
                 40.591 
                 5.544 
                 1.00 
                 35.87 
                 C 
               
               
                 ATOM 
                 1185 
                 C 
                 LEU 
                 B 
                 41 
                 54.248 
                 39.101 
                 4.977 
                 1.00 
                 41.07 
                 C 
               
               
                 ATOM 
                 1186 
                 O 
                 LEU 
                 B 
                 41 
                 53.558 
                 38.183 
                 4.564 
                 1.00 
                 40.61 
                 O 
               
               
                 ATOM 
                 1187 
                 N 
                 GLY 
                 B 
                 42 
                 53.803 
                 40.334 
                 5.132 
                 1.00 
                 43.06 
                 N 
               
               
                 ATOM 
                 1188 
                 CA 
                 GLY 
                 B 
                 42 
                 52.443 
                 40.730 
                 4.778 
                 1.00 
                 45.64 
                 C 
               
               
                 ATOM 
                 1189 
                 C 
                 GLY 
                 B 
                 42 
                 51.375 
                 40.327 
                 5.791 
                 1.00 
                 47.14 
                 C 
               
               
                 ATOM 
                 1190 
                 O 
                 GLY 
                 B 
                 42 
                 50.738 
                 41.196 
                 6.426 
                 1.00 
                 47.26 
                 O 
               
               
                 ATOM 
                 1191 
                 N 
                 SER 
                 B 
                 43 
                 51.163 
                 39.008 
                 5.915 
                 1.00 
                 48.13 
                 N 
               
               
                 ATOM 
                 1192 
                 CA 
                 SER 
                 B 
                 43 
                 50.160 
                 38.442 
                 6.811 
                 1.00 
                 48.78 
                 C 
               
               
                 ATOM 
                 1193 
                 CB 
                 SER 
                 B 
                 43 
                 50.174 
                 36.927 
                 6.713 
                 1.00 
                 48.76 
                 C 
               
               
                 ATOM 
                 1194 
                 OG 
                 SER 
                 B 
                 43 
                 49.508 
                 36.361 
                 7.829 
                 1.00 
                 50.24 
                 O 
               
               
                 ATOM 
                 1195 
                 C 
                 SER 
                 B 
                 43 
                 50.424 
                 38.895 
                 8.242 
                 1.00 
                 49.01 
                 C 
               
               
                 ATOM 
                 1196 
                 O 
                 SER 
                 B 
                 43 
                 51.549 
                 38.788 
                 8.734 
                 1.00 
                 49.17 
                 O 
               
               
                 ATOM 
                 1197 
                 N 
                 THR 
                 B 
                 44 
                 49.390 
                 39.417 
                 8.892 
                 1.00 
                 49.44 
                 N 
               
               
                 ATOM 
                 1198 
                 CA 
                 THR 
                 B 
                 44 
                 49.549 
                 40.109 
                 10.184 
                 1.00 
                 50.08 
                 C 
               
               
                 ATOM 
                 1199 
                 CB 
                 THR 
                 B 
                 44 
                 48.264 
                 40.935 
                 10.579 
                 1.00 
                 50.34 
                 C 
               
               
                 ATOM 
                 1200 
                 OG1 
                 THR 
                 B 
                 44 
                 47.092 
                 40.110 
                 10.468 
                 1.00 
                 50.77 
                 O 
               
               
                 ATOM 
                 1201 
                 CG2 
                 THR 
                 B 
                 44 
                 48.093 
                 42.184 
                 9.689 
                 1.00 
                 49.96 
                 C 
               
               
                 ATOM 
                 1202 
                 C 
                 THR 
                 B 
                 44 
                 50.054 
                 39.236 
                 11.366 
                 1.00 
                 50.19 
                 C 
               
               
                 ATOM 
                 1203 
                 O 
                 THR 
                 B 
                 44 
                 51.145 
                 39.497 
                 11.902 
                 1.00 
                 50.45 
                 O 
               
               
                 ATOM 
                 1204 
                 N 
                 ASN 
                 B 
                 45 
                 49.289 
                 38.202 
                 11.747 
                 1.00 
                 49.88 
                 N 
               
               
                 ATOM 
                 1205 
                 CA 
                 ASN 
                 B 
                 45 
                 49.637 
                 37.347 
                 12.898 
                 1.00 
                 49.63 
                 C 
               
               
                 ATOM 
                 1206 
                 CB 
                 ASN 
                 B 
                 45 
                 48.430 
                 37.140 
                 13.819 
                 1.00 
                 50.02 
                 C 
               
               
                 ATOM 
                 1207 
                 CG 
                 ASN 
                 B 
                 45 
                 47.471 
                 38.339 
                 13.840 
                 1.00 
                 50.87 
                 C 
               
               
                 ATOM 
                 1208 
                 OD1 
                 ASN 
                 B 
                 45 
                 47.891 
                 39.490 
                 13.728 
                 1.00 
                 51.82 
                 O 
               
               
                 ATOM 
                 1209 
                 ND2 
                 ASN 
                 B 
                 45 
                 46.170 
                 38.060 
                 13.999 
                 1.00 
                 51.34 
                 N 
               
               
                 ATOM 
                 1210 
                 C 
                 ASN 
                 B 
                 45 
                 50.178 
                 35.982 
                 12.492 
                 1.00 
                 49.19 
                 C 
               
               
                 ATOM 
                 1211 
                 O 
                 ASN 
                 B 
                 45 
                 50.131 
                 35.621 
                 11.325 
                 1.00 
                 48.90 
                 O 
               
               
                 ATOM 
                 1212 
                 N 
                 GLU 
                 B 
                 46 
                 50.703 
                 35.239 
                 13.465 
                 1.00 
                 48.83 
                 N 
               
               
                 ATOM 
                 1213 
                 CA 
                 GLU 
                 B 
                 46 
                 51.098 
                 33.839 
                 13.274 
                 1.00 
                 48.89 
                 C 
               
               
                 ATOM 
                 1214 
                 CB 
                 GLU 
                 B 
                 46 
                 51.616 
                 33.236 
                 14.602 
                 1.00 
                 48.72 
                 C 
               
               
                 ATOM 
                 1215 
                 CG 
                 GLU 
                 B 
                 46 
                 51.589 
                 31.680 
                 14.656 
                 1.00 
                 51.01 
                 C 
               
               
                 ATOM 
                 1216 
                 CD 
                 GLU 
                 B 
                 46 
                 52.026 
                 31.059 
                 16.009 
                 1.00 
                 51.85 
                 C 
               
               
                 ATOM 
                 1217 
                 OE1 
                 GLU 
                 B 
                 46 
                 53.085 
                 30.355 
                 16.022 
                 1.00 
                 55.28 
                 O 
               
               
                 ATOM 
                 1218 
                 OE2 
                 GLU 
                 B 
                 46 
                 51.310 
                 31.250 
                 17.040 
                 1.00 
                 54.03 
                 O 
               
               
                 ATOM 
                 1219 
                 C 
                 GLU 
                 B 
                 46 
                 49.877 
                 33.051 
                 12.783 
                 1.00 
                 47.40 
                 C 
               
               
                 ATOM 
                 1220 
                 O 
                 GLU 
                 B 
                 46 
                 48.776 
                 33.279 
                 13.296 
                 1.00 
                 47.31 
                 O 
               
               
                 ATOM 
                 1221 
                 N 
                 GLN 
                 B 
                 47 
                 50.055 
                 32.156 
                 11.797 
                 1.00 
                 45.67 
                 N 
               
               
                 ATOM 
                 1222 
                 CA 
                 GLN 
                 B 
                 47 
                 48.959 
                 31.256 
                 11.382 
                 1.00 
                 44.20 
                 C 
               
               
                 ATOM 
                 1223 
                 CB 
                 GLN 
                 B 
                 47 
                 48.202 
                 31.758 
                 10.146 
                 1.00 
                 44.02 
                 C 
               
               
                 ATOM 
                 1224 
                 CG 
                 GLN 
                 B 
                 47 
                 49.018 
                 32.205 
                 8.958 
                 1.00 
                 44.67 
                 C 
               
               
                 ATOM 
                 1225 
                 CD 
                 GLN 
                 B 
                 47 
                 48.193 
                 33.053 
                 7.957 
                 1.00 
                 45.30 
                 C 
               
               
                 ATOM 
                 1226 
                 OE1 
                 GLN 
                 B 
                 47 
                 48.624 
                 33.293 
                 6.825 
                 1.00 
                 47.08 
                 O 
               
               
                 ATOM 
                 1227 
                 NE2 
                 GLN 
                 B 
                 47 
                 47.014 
                 33.512 
                 8.383 
                 1.00 
                 46.34 
                 N 
               
               
                 ATOM 
                 1228 
                 C 
                 GLN 
                 B 
                 47 
                 49.271 
                 29.767 
                 11.249 
                 1.00 
                 42.77 
                 C 
               
               
                 ATOM 
                 1229 
                 O 
                 GLN 
                 B 
                 47 
                 50.388 
                 29.374 
                 10.902 
                 1.00 
                 43.17 
                 O 
               
               
                 ATOM 
                 1230 
                 N 
                 LYS 
                 B 
                 48 
                 48.263 
                 28.948 
                 11.536 
                 1.00 
                 40.86 
                 N 
               
               
                 ATOM 
                 1231 
                 CA 
                 LYS 
                 B 
                 48 
                 48.381 
                 27.516 
                 11.355 
                 1.00 
                 39.42 
                 C 
               
               
                 ATOM 
                 1232 
                 CB 
                 LYS 
                 B 
                 48 
                 47.374 
                 26.754 
                 12.192 
                 1.00 
                 39.66 
                 C 
               
               
                 ATOM 
                 1233 
                 CG 
                 LYS 
                 B 
                 48 
                 47.668 
                 25.273 
                 12.204 
                 1.00 
                 40.68 
                 C 
               
               
                 ATOM 
                 1234 
                 CD 
                 LYS 
                 B 
                 48 
                 46.769 
                 24.546 
                 13.155 
                 1.00 
                 44.74 
                 C 
               
               
                 ATOM 
                 1235 
                 CE 
                 LYS 
                 B 
                 48 
                 46.885 
                 23.054 
                 12.934 
                 1.00 
                 47.87 
                 C 
               
               
                 ATOM 
                 1236 
                 NZ 
                 LYS 
                 B 
                 48 
                 45.989 
                 22.323 
                 13.869 
                 1.00 
                 51.09 
                 N 
               
               
                 ATOM 
                 1237 
                 C 
                 LYS 
                 B 
                 48 
                 48.188 
                 27.139 
                 9.908 
                 1.00 
                 38.04 
                 C 
               
               
                 ATOM 
                 1238 
                 O 
                 LYS 
                 B 
                 48 
                 47.173 
                 27.468 
                 9.302 
                 1.00 
                 38.20 
                 O 
               
               
                 ATOM 
                 1239 
                 N 
                 ILE 
                 B 
                 49 
                 49.164 
                 26.424 
                 9.371 
                 1.00 
                 36.39 
                 N 
               
               
                 ATOM 
                 1240 
                 CA 
                 ILE 
                 B 
                 49 
                 49.139 
                 25.983 
                 7.993 
                 1.00 
                 34.41 
                 C 
               
               
                 ATOM 
                 1241 
                 CB 
                 ILE 
                 B 
                 49 
                 50.536 
                 25.543 
                 7.541 
                 1.00 
                 34.65 
                 C 
               
               
                 ATOM 
                 1242 
                 CG1 
                 ILE 
                 B 
                 49 
                 51.581 
                 26.630 
                 7.910 
                 1.00 
                 33.56 
                 C 
               
               
                 ATOM 
                 1243 
                 CD1 
                 ILE 
                 B 
                 49 
                 52.977 
                 26.419 
                 7.414 
                 1.00 
                 32.67 
                 C 
               
               
                 ATOM 
                 1244 
                 CG2 
                 ILE 
                 B 
                 49 
                 50.480 
                 25.172 
                 6.067 
                 1.00 
                 34.42 
                 C 
               
               
                 ATOM 
                 1245 
                 C 
                 ILE 
                 B 
                 49 
                 48.189 
                 24.815 
                 7.822 
                 1.00 
                 33.90 
                 C 
               
               
                 ATOM 
                 1246 
                 O 
                 ILE 
                 B 
                 49 
                 48.299 
                 23.837 
                 8.534 
                 1.00 
                 33.80 
                 O 
               
               
                 ATOM 
                 1247 
                 N 
                 SER 
                 B 
                 50 
                 47.240 
                 24.946 
                 6.897 
                 1.00 
                 33.32 
                 N 
               
               
                 ATOM 
                 1248 
                 CA 
                 SER 
                 B 
                 50 
                 46.433 
                 23.828 
                 6.427 
                 1.00 
                 32.90 
                 C 
               
               
                 ATOM 
                 1249 
                 CB 
                 SER 
                 B 
                 50 
                 45.206 
                 24.350 
                 5.696 
                 1.00 
                 32.66 
                 C 
               
               
                 ATOM 
                 1250 
                 OG 
                 SER 
                 B 
                 50 
                 44.029 
                 24.100 
                 6.418 
                 1.00 
                 33.04 
                 O 
               
               
                 ATOM 
                 1251 
                 C 
                 SER 
                 B 
                 50 
                 47.225 
                 22.981 
                 5.441 
                 1.00 
                 32.69 
                 C 
               
               
                 ATOM 
                 1252 
                 O 
                 SER 
                 B 
                 50 
                 47.443 
                 23.401 
                 4.317 
                 1.00 
                 33.31 
                 O 
               
               
                 ATOM 
                 1253 
                 N 
                 ILE 
                 B 
                 51 
                 47.659 
                 21.793 
                 5.842 
                 1.00 
                 32.40 
                 N 
               
               
                 ATOM 
                 1254 
                 CA 
                 ILE 
                 B 
                 51 
                 48.216 
                 20.831 
                 4.880 
                 1.00 
                 31.95 
                 C 
               
               
                 ATOM 
                 1255 
                 CB 
                 ILE 
                 B 
                 51 
                 48.520 
                 19.488 
                 5.559 
                 1.00 
                 31.82 
                 C 
               
               
                 ATOM 
                 1256 
                 CG1 
                 ILE 
                 B 
                 51 
                 49.417 
                 19.700 
                 6.788 
                 1.00 
                 31.72 
                 C 
               
               
                 ATOM 
                 1257 
                 CD1 
                 ILE 
                 B 
                 51 
                 50.781 
                 20.302 
                 6.518 
                 1.00 
                 30.73 
                 C 
               
               
                 ATOM 
                 1258 
                 CG2 
                 ILE 
                 B 
                 51 
                 49.112 
                 18.514 
                 4.573 
                 1.00 
                 30.78 
                 C 
               
               
                 ATOM 
                 1259 
                 C 
                 ILE 
                 B 
                 51 
                 47.270 
                 20.612 
                 3.681 
                 1.00 
                 31.79 
                 C 
               
               
                 ATOM 
                 1260 
                 O 
                 ILE 
                 B 
                 51 
                 46.052 
                 20.534 
                 3.839 
                 1.00 
                 31.18 
                 O 
               
               
                 ATOM 
                 1261 
                 N 
                 GLY 
                 B 
                 52 
                 47.856 
                 20.530 
                 2.493 
                 1.00 
                 32.00 
                 N 
               
               
                 ATOM 
                 1262 
                 CA 
                 GLY 
                 B 
                 52 
                 47.115 
                 20.377 
                 1.246 
                 1.00 
                 32.81 
                 C 
               
               
                 ATOM 
                 1263 
                 C 
                 GLY 
                 B 
                 52 
                 47.671 
                 21.388 
                 0.271 
                 1.00 
                 33.29 
                 C 
               
               
                 ATOM 
                 1264 
                 O 
                 GLY 
                 B 
                 52 
                 48.433 
                 22.266 
                 0.701 
                 1.00 
                 34.33 
                 O 
               
               
                 ATOM 
                 1265 
                 N 
                 GLY 
                 B 
                 53 
                 47.316 
                 21.271 
                 −1.020 
                 1.00 
                 32.93 
                 N 
               
               
                 ATOM 
                 1266 
                 CA 
                 GLY 
                 B 
                 53 
                 47.797 
                 22.167 
                 −2.079 
                 1.00 
                 32.74 
                 C 
               
               
                 ATOM 
                 1267 
                 C 
                 GLY 
                 B 
                 53 
                 49.317 
                 22.310 
                 −2.101 
                 1.00 
                 33.58 
                 C 
               
               
                 ATOM 
                 1268 
                 O 
                 GLY 
                 B 
                 53 
                 50.035 
                 21.328 
                 −2.253 
                 1.00 
                 33.62 
                 O 
               
               
                 ATOM 
                 1269 
                 N 
                 ARG 
                 B 
                 54 
                 49.800 
                 23.545 
                 −1.957 
                 1.00 
                 33.84 
                 N 
               
               
                 ATOM 
                 1270 
                 CA 
                 ARG 
                 B 
                 54 
                 51.210 
                 23.856 
                 −1.783 
                 1.00 
                 34.22 
                 C 
               
               
                 ATOM 
                 1271 
                 CB 
                 ARG 
                 B 
                 54 
                 51.356 
                 25.337 
                 −1.403 
                 1.00 
                 34.14 
                 C 
               
               
                 ATOM 
                 1272 
                 CG 
                 ARG 
                 B 
                 54 
                 51.572 
                 26.240 
                 −2.549 
                 1.00 
                 35.30 
                 C 
               
               
                 ATOM 
                 1273 
                 CD 
                 ARG 
                 B 
                 54 
                 50.951 
                 27.636 
                 −2.377 
                 1.00 
                 38.06 
                 C 
               
               
                 ATOM 
                 1274 
                 NE 
                 ARG 
                 B 
                 54 
                 51.387 
                 28.432 
                 −1.220 
                 1.00 
                 38.60 
                 N 
               
               
                 ATOM 
                 1275 
                 CZ 
                 ARG 
                 B 
                 54 
                 52.637 
                 28.827 
                 −0.962 
                 1.00 
                 38.97 
                 C 
               
               
                 ATOM 
                 1276 
                 NH1 
                 ARG 
                 B 
                 54 
                 53.655 
                 28.462 
                 −1.727 
                 1.00 
                 37.92 
                 N 
               
               
                 ATOM 
                 1277 
                 NH2 
                 ARG 
                 B 
                 54 
                 52.877 
                 29.574 
                 0.105 
                 1.00 
                 39.13 
                 N 
               
               
                 ATOM 
                 1278 
                 C 
                 ARG 
                 B 
                 54 
                 51.876 
                 23.037 
                 −0.670 
                 1.00 
                 34.59 
                 C 
               
               
                 ATOM 
                 1279 
                 O 
                 ARG 
                 B 
                 54 
                 53.099 
                 22.842 
                 −0.690 
                 1.00 
                 35.21 
                 O 
               
               
                 ATOM 
                 1280 
                 N 
                 TYR 
                 B 
                 55 
                 51.096 
                 22.605 
                 0.318 
                 1.00 
                 34.28 
                 N 
               
               
                 ATOM 
                 1281 
                 CA 
                 TYR 
                 B 
                 55 
                 51.680 
                 22.114 
                 1.558 
                 1.00 
                 35.05 
                 C 
               
               
                 ATOM 
                 1282 
                 CB 
                 TYR 
                 B 
                 55 
                 51.012 
                 22.750 
                 2.778 
                 1.00 
                 35.40 
                 C 
               
               
                 ATOM 
                 1283 
                 CG 
                 TYR 
                 B 
                 55 
                 51.104 
                 24.245 
                 2.771 
                 1.00 
                 36.76 
                 C 
               
               
                 ATOM 
                 1284 
                 CD1 
                 TYR 
                 B 
                 55 
                 49.993 
                 25.022 
                 2.453 
                 1.00 
                 36.78 
                 C 
               
               
                 ATOM 
                 1285 
                 CE1 
                 TYR 
                 B 
                 55 
                 50.076 
                 26.389 
                 2.425 
                 1.00 
                 36.81 
                 C 
               
               
                 ATOM 
                 1286 
                 CZ 
                 TYR 
                 B 
                 55 
                 51.282 
                 27.001 
                 2.706 
                 1.00 
                 36.69 
                 C 
               
               
                 ATOM 
                 1287 
                 OH 
                 TYR 
                 B 
                 55 
                 51.353 
                 28.363 
                 2.682 
                 1.00 
                 37.75 
                 O 
               
               
                 ATOM 
                 1288 
                 CE2 
                 TYR 
                 B 
                 55 
                 52.408 
                 26.269 
                 3.026 
                 1.00 
                 36.76 
                 C 
               
               
                 ATOM 
                 1289 
                 CD2 
                 TYR 
                 B 
                 55 
                 52.319 
                 24.893 
                 3.053 
                 1.00 
                 37.99 
                 C 
               
               
                 ATOM 
                 1290 
                 C 
                 TYR 
                 B 
                 55 
                 51.546 
                 20.621 
                 1.650 
                 1.00 
                 35.30 
                 C 
               
               
                 ATOM 
                 1291 
                 O 
                 TYR 
                 B 
                 55 
                 50.418 
                 20.093 
                 1.689 
                 1.00 
                 35.71 
                 O 
               
               
                 ATOM 
                 1292 
                 N 
                 VAL 
                 B 
                 56 
                 52.691 
                 19.942 
                 1.680 
                 1.00 
                 34.77 
                 N 
               
               
                 ATOM 
                 1293 
                 CA 
                 VAL 
                 B 
                 56 
                 52.700 
                 18.500 
                 1.816 
                 1.00 
                 34.57 
                 C 
               
               
                 ATOM 
                 1294 
                 CB 
                 VAL 
                 B 
                 56 
                 52.930 
                 17.723 
                 0.423 
                 1.00 
                 34.43 
                 C 
               
               
                 ATOM 
                 1295 
                 CG1 
                 VAL 
                 B 
                 56 
                 53.441 
                 18.632 
                 −0.682 
                 1.00 
                 34.03 
                 C 
               
               
                 ATOM 
                 1296 
                 CG2 
                 VAL 
                 B 
                 56 
                 53.758 
                 16.472 
                 0.581 
                 1.00 
                 33.69 
                 C 
               
               
                 ATOM 
                 1297 
                 C 
                 VAL 
                 B 
                 56 
                 53.522 
                 18.045 
                 3.026 
                 1.00 
                 34.81 
                 C 
               
               
                 ATOM 
                 1298 
                 O 
                 VAL 
                 B 
                 56 
                 54.724 
                 18.312 
                 3.129 
                 1.00 
                 35.06 
                 O 
               
               
                 ATOM 
                 1299 
                 N 
                 GLU 
                 B 
                 57 
                 52.821 
                 17.406 
                 3.963 
                 1.00 
                 35.01 
                 N 
               
               
                 ATOM 
                 1300 
                 CA 
                 GLU 
                 B 
                 57 
                 53.408 
                 16.847 
                 5.178 
                 1.00 
                 35.49 
                 C 
               
               
                 ATOM 
                 1301 
                 CB 
                 GLU 
                 B 
                 57 
                 52.474 
                 17.028 
                 6.364 
                 1.00 
                 35.34 
                 C 
               
               
                 ATOM 
                 1302 
                 CG 
                 GLU 
                 B 
                 57 
                 53.180 
                 16.934 
                 7.704 
                 1.00 
                 35.90 
                 C 
               
               
                 ATOM 
                 1303 
                 CD 
                 GLU 
                 B 
                 57 
                 52.231 
                 17.058 
                 8.896 
                 1.00 
                 36.90 
                 C 
               
               
                 ATOM 
                 1304 
                 OE1 
                 GLU 
                 B 
                 57 
                 51.089 
                 16.531 
                 8.854 
                 1.00 
                 38.87 
                 O 
               
               
                 ATOM 
                 1305 
                 OE2 
                 GLU 
                 B 
                 57 
                 52.642 
                 17.678 
                 9.898 
                 1.00 
                 39.53 
                 O 
               
               
                 ATOM 
                 1306 
                 C 
                 GLU 
                 B 
                 57 
                 53.679 
                 15.368 
                 5.034 
                 1.00 
                 35.42 
                 C 
               
               
                 ATOM 
                 1307 
                 O 
                 GLU 
                 B 
                 57 
                 52.834 
                 14.617 
                 4.549 
                 1.00 
                 35.57 
                 O 
               
               
                 ATOM 
                 1308 
                 N 
                 THR 
                 B 
                 58 
                 54.863 
                 14.956 
                 5.458 
                 1.00 
                 35.55 
                 N 
               
               
                 ATOM 
                 1309 
                 CA 
                 THR 
                 B 
                 58 
                 55.173 
                 13.552 
                 5.566 
                 1.00 
                 36.03 
                 C 
               
               
                 ATOM 
                 1310 
                 CB 
                 THR 
                 B 
                 58 
                 56.332 
                 13.180 
                 4.668 
                 1.00 
                 36.37 
                 C 
               
               
                 ATOM 
                 1311 
                 OG1 
                 THR 
                 B 
                 58 
                 55.971 
                 13.500 
                 3.324 
                 1.00 
                 38.93 
                 O 
               
               
                 ATOM 
                 1312 
                 CG2 
                 THR 
                 B 
                 58 
                 56.624 
                 11.680 
                 4.753 
                 1.00 
                 35.97 
                 C 
               
               
                 ATOM 
                 1313 
                 C 
                 THR 
                 B 
                 58 
                 55.510 
                 13.227 
                 6.999 
                 1.00 
                 35.82 
                 C 
               
               
                 ATOM 
                 1314 
                 O 
                 THR 
                 B 
                 58 
                 56.478 
                 13.750 
                 7.558 
                 1.00 
                 35.98 
                 O 
               
               
                 ATOM 
                 1315 
                 N 
                 VAL 
                 B 
                 59 
                 54.708 
                 12.363 
                 7.597 
                 1.00 
                 35.52 
                 N 
               
               
                 ATOM 
                 1316 
                 CA 
                 VAL 
                 B 
                 59 
                 54.956 
                 11.955 
                 8.968 
                 1.00 
                 35.20 
                 C 
               
               
                 ATOM 
                 1317 
                 CB 
                 VAL 
                 B 
                 59 
                 53.757 
                 12.247 
                 9.820 
                 1.00 
                 35.04 
                 C 
               
               
                 ATOM 
                 1318 
                 CG1 
                 VAL 
                 B 
                 59 
                 53.952 
                 11.715 
                 11.241 
                 1.00 
                 34.11 
                 C 
               
               
                 ATOM 
                 1319 
                 CG2 
                 VAL 
                 B 
                 59 
                 53.536 
                 13.760 
                 9.802 
                 1.00 
                 35.87 
                 C 
               
               
                 ATOM 
                 1320 
                 C 
                 VAL 
                 B 
                 59 
                 55.377 
                 10.504 
                 9.106 
                 1.00 
                 34.93 
                 C 
               
               
                 ATOM 
                 1321 
                 O 
                 VAL 
                 B 
                 59 
                 54.740 
                 9.610 
                 8.560 
                 1.00 
                 35.10 
                 O 
               
               
                 ATOM 
                 1322 
                 N 
                 ASN 
                 B 
                 60 
                 56.471 
                 10.286 
                 9.825 
                 1.00 
                 34.54 
                 N 
               
               
                 ATOM 
                 1323 
                 CA 
                 ASN 
                 B 
                 60 
                 56.872 
                 8.949 
                 10.196 
                 1.00 
                 34.43 
                 C 
               
               
                 ATOM 
                 1324 
                 CB 
                 ASN 
                 B 
                 60 
                 58.304 
                 8.695 
                 9.772 
                 1.00 
                 34.56 
                 C 
               
               
                 ATOM 
                 1325 
                 CG 
                 ASN 
                 B 
                 60 
                 58.665 
                 7.231 
                 9.819 
                 1.00 
                 34.65 
                 C 
               
               
                 ATOM 
                 1326 
                 OD1 
                 ASN 
                 B 
                 60 
                 58.226 
                 6.482 
                 10.704 
                 1.00 
                 34.77 
                 O 
               
               
                 ATOM 
                 1327 
                 ND2 
                 ASN 
                 B 
                 60 
                 59.474 
                 6.812 
                 8.867 
                 1.00 
                 33.75 
                 N 
               
               
                 ATOM 
                 1328 
                 C 
                 ASN 
                 B 
                 60 
                 56.707 
                 8.692 
                 11.692 
                 1.00 
                 34.35 
                 C 
               
               
                 ATOM 
                 1329 
                 O 
                 ASN 
                 B 
                 60 
                 57.659 
                 8.801 
                 12.473 
                 1.00 
                 34.37 
                 O 
               
               
                 ATOM 
                 1330 
                 N 
                 LYS 
                 B 
                 61 
                 55.486 
                 8.333 
                 12.082 
                 1.00 
                 34.32 
                 N 
               
               
                 ATOM 
                 1331 
                 CA 
                 LYS 
                 B 
                 61 
                 55.153 
                 8.102 
                 13.496 
                 1.00 
                 33.79 
                 C 
               
               
                 ATOM 
                 1332 
                 CB 
                 LYS 
                 B 
                 61 
                 53.712 
                 7.595 
                 13.640 
                 1.00 
                 33.51 
                 C 
               
               
                 ATOM 
                 1333 
                 CG 
                 LYS 
                 B 
                 61 
                 52.707 
                 8.696 
                 13.922 
                 1.00 
                 32.45 
                 C 
               
               
                 ATOM 
                 1334 
                 CD 
                 LYS 
                 B 
                 61 
                 51.272 
                 8.203 
                 13.746 
                 1.00 
                 31.18 
                 C 
               
               
                 ATOM 
                 1335 
                 CE 
                 LYS 
                 B 
                 61 
                 50.270 
                 9.348 
                 13.855 
                 1.00 
                 31.36 
                 C 
               
               
                 ATOM 
                 1336 
                 NZ 
                 LYS 
                 B 
                 61 
                 48.882 
                 8.975 
                 13.458 
                 1.00 
                 32.24 
                 N 
               
               
                 ATOM 
                 1337 
                 C 
                 LYS 
                 B 
                 61 
                 56.126 
                 7.150 
                 14.184 
                 1.00 
                 33.58 
                 C 
               
               
                 ATOM 
                 1338 
                 O 
                 LYS 
                 B 
                 61 
                 56.344 
                 7.252 
                 15.386 
                 1.00 
                 33.17 
                 O 
               
               
                 ATOM 
                 1339 
                 N 
                 GLY 
                 B 
                 62 
                 56.717 
                 6.248 
                 13.402 
                 1.00 
                 33.71 
                 N 
               
               
                 ATOM 
                 1340 
                 CA 
                 GLY 
                 B 
                 62 
                 57.582 
                 5.197 
                 13.927 
                 1.00 
                 33.75 
                 C 
               
               
                 ATOM 
                 1341 
                 C 
                 GLY 
                 B 
                 62 
                 58.902 
                 5.716 
                 14.449 
                 1.00 
                 33.69 
                 C 
               
               
                 ATOM 
                 1342 
                 O 
                 GLY 
                 B 
                 62 
                 59.342 
                 5.338 
                 15.535 
                 1.00 
                 33.29 
                 O 
               
               
                 ATOM 
                 1343 
                 N 
                 SER 
                 B 
                 63 
                 59.537 
                 6.581 
                 13.669 
                 1.00 
                 33.94 
                 N 
               
               
                 ATOM 
                 1344 
                 CA 
                 SER 
                 B 
                 63 
                 60.816 
                 7.159 
                 14.062 
                 1.00 
                 34.47 
                 C 
               
               
                 ATOM 
                 1345 
                 CB 
                 SER 
                 B 
                 63 
                 61.758 
                 7.243 
                 12.859 
                 1.00 
                 34.55 
                 C 
               
               
                 ATOM 
                 1346 
                 OG 
                 SER 
                 B 
                 63 
                 61.291 
                 8.202 
                 11.912 
                 1.00 
                 35.26 
                 O 
               
               
                 ATOM 
                 1347 
                 C 
                 SER 
                 B 
                 63 
                 60.605 
                 8.538 
                 14.678 
                 1.00 
                 34.60 
                 C 
               
               
                 ATOM 
                 1348 
                 O 
                 SER 
                 B 
                 63 
                 61.561 
                 9.279 
                 14.908 
                 1.00 
                 35.09 
                 O 
               
               
                 ATOM 
                 1349 
                 N 
                 LYS 
                 B 
                 64 
                 59.344 
                 8.866 
                 14.939 
                 1.00 
                 34.69 
                 N 
               
               
                 ATOM 
                 1350 
                 CA 
                 LYS 
                 B 
                 64 
                 58.925 
                 10.171 
                 15.447 
                 1.00 
                 34.92 
                 C 
               
               
                 ATOM 
                 1351 
                 CB 
                 LYS 
                 B 
                 64 
                 59.258 
                 10.326 
                 16.933 
                 1.00 
                 34.30 
                 C 
               
               
                 ATOM 
                 1352 
                 CG 
                 LYS 
                 B 
                 64 
                 58.467 
                 9.412 
                 17.849 
                 1.00 
                 34.05 
                 C 
               
               
                 ATOM 
                 1353 
                 CD 
                 LYS 
                 B 
                 64 
                 59.356 
                 8.857 
                 18.921 
                 1.00 
                 34.38 
                 C 
               
               
                 ATOM 
                 1354 
                 CE 
                 LYS 
                 B 
                 64 
                 58.612 
                 8.736 
                 20.206 
                 1.00 
                 35.46 
                 C 
               
               
                 ATOM 
                 1355 
                 NZ 
                 LYS 
                 B 
                 64 
                 57.842 
                 7.479 
                 20.278 
                 1.00 
                 37.44 
                 N 
               
               
                 ATOM 
                 1356 
                 C 
                 LYS 
                 B 
                 64 
                 59.430 
                 11.374 
                 14.647 
                 1.00 
                 35.47 
                 C 
               
               
                 ATOM 
                 1357 
                 O 
                 LYS 
                 B 
                 64 
                 59.438 
                 12.485 
                 15.153 
                 1.00 
                 36.15 
                 O 
               
               
                 ATOM 
                 1358 
                 N 
                 SER 
                 B 
                 65 
                 59.826 
                 11.185 
                 13.398 
                 1.00 
                 35.85 
                 N 
               
               
                 ATOM 
                 1359 
                 CA 
                 SER 
                 B 
                 65 
                 60.164 
                 12.354 
                 12.588 
                 1.00 
                 36.57 
                 C 
               
               
                 ATOM 
                 1360 
                 CB 
                 SER 
                 B 
                 65 
                 61.428 
                 12.116 
                 11.773 
                 1.00 
                 36.71 
                 C 
               
               
                 ATOM 
                 1361 
                 OG 
                 SER 
                 B 
                 65 
                 61.349 
                 10.872 
                 11.103 
                 1.00 
                 38.46 
                 O 
               
               
                 ATOM 
                 1362 
                 C 
                 SER 
                 B 
                 65 
                 59.000 
                 12.777 
                 11.692 
                 1.00 
                 36.53 
                 C 
               
               
                 ATOM 
                 1363 
                 O 
                 SER 
                 B 
                 65 
                 58.031 
                 12.039 
                 11.510 
                 1.00 
                 36.24 
                 O 
               
               
                 ATOM 
                 1364 
                 N 
                 PHE 
                 B 
                 66 
                 59.093 
                 13.983 
                 11.157 
                 1.00 
                 36.84 
                 N 
               
               
                 ATOM 
                 1365 
                 CA 
                 PHE 
                 B 
                 66 
                 58.081 
                 14.495 
                 10.254 
                 1.00 
                 37.54 
                 C 
               
               
                 ATOM 
                 1366 
                 CB 
                 PHE 
                 B 
                 66 
                 56.744 
                 14.728 
                 10.981 
                 1.00 
                 38.07 
                 C 
               
               
                 ATOM 
                 1367 
                 CG 
                 PHE 
                 B 
                 66 
                 56.815 
                 15.713 
                 12.127 
                 1.00 
                 38.99 
                 C 
               
               
                 ATOM 
                 1368 
                 CD1 
                 PHE 
                 B 
                 66 
                 56.073 
                 16.894 
                 12.082 
                 1.00 
                 39.56 
                 C 
               
               
                 ATOM 
                 1369 
                 CE1 
                 PHE 
                 B 
                 66 
                 56.129 
                 17.808 
                 13.131 
                 1.00 
                 39.86 
                 C 
               
               
                 ATOM 
                 1370 
                 CZ 
                 PHE 
                 B 
                 66 
                 56.932 
                 17.540 
                 14.245 
                 1.00 
                 40.09 
                 C 
               
               
                 ATOM 
                 1371 
                 CE2 
                 PHE 
                 B 
                 66 
                 57.673 
                 16.363 
                 14.308 
                 1.00 
                 39.63 
                 C 
               
               
                 ATOM 
                 1372 
                 CD2 
                 PHE 
                 B 
                 66 
                 57.603 
                 15.456 
                 13.253 
                 1.00 
                 39.81 
                 C 
               
               
                 ATOM 
                 1373 
                 C 
                 PHE 
                 B 
                 66 
                 58.567 
                 15.744 
                 9.527 
                 1.00 
                 37.56 
                 C 
               
               
                 ATOM 
                 1374 
                 O 
                 PHE 
                 B 
                 66 
                 59.251 
                 16.573 
                 10.114 
                 1.00 
                 37.86 
                 O 
               
               
                 ATOM 
                 1375 
                 N 
                 SER 
                 B 
                 67 
                 58.202 
                 15.868 
                 8.253 
                 1.00 
                 37.40 
                 N 
               
               
                 ATOM 
                 1376 
                 CA 
                 SER 
                 B 
                 67 
                 58.668 
                 16.953 
                 7.398 
                 1.00 
                 37.02 
                 C 
               
               
                 ATOM 
                 1377 
                 CB 
                 SER 
                 B 
                 67 
                 59.562 
                 16.388 
                 6.297 
                 1.00 
                 37.25 
                 C 
               
               
                 ATOM 
                 1378 
                 OG 
                 SER 
                 B 
                 67 
                 58.769 
                 15.703 
                 5.328 
                 1.00 
                 38.81 
                 O 
               
               
                 ATOM 
                 1379 
                 C 
                 SER 
                 B 
                 67 
                 57.522 
                 17.681 
                 6.735 
                 1.00 
                 36.30 
                 C 
               
               
                 ATOM 
                 1380 
                 O 
                 SER 
                 B 
                 67 
                 56.477 
                 17.113 
                 6.508 
                 1.00 
                 36.04 
                 O 
               
               
                 ATOM 
                 1381 
                 N 
                 LEU 
                 B 
                 68 
                 57.747 
                 18.944 
                 6.405 
                 1.00 
                 36.52 
                 N 
               
               
                 ATOM 
                 1382 
                 CA 
                 LEU 
                 B 
                 68 
                 56.812 
                 19.747 
                 5.625 
                 1.00 
                 36.48 
                 C 
               
               
                 ATOM 
                 1383 
                 CB 
                 LEU 
                 B 
                 68 
                 56.319 
                 20.943 
                 6.429 
                 1.00 
                 35.99 
                 C 
               
               
                 ATOM 
                 1384 
                 CG 
                 LEU 
                 B 
                 68 
                 55.589 
                 22.029 
                 5.647 
                 1.00 
                 36.04 
                 C 
               
               
                 ATOM 
                 1385 
                 CD1 
                 LEU 
                 B 
                 68 
                 54.180 
                 21.550 
                 5.246 
                 1.00 
                 38.31 
                 C 
               
               
                 ATOM 
                 1386 
                 CD2 
                 LEU 
                 B 
                 68 
                 55.518 
                 23.352 
                 6.412 
                 1.00 
                 35.68 
                 C 
               
               
                 ATOM 
                 1387 
                 C 
                 LEU 
                 B 
                 68 
                 57.520 
                 20.240 
                 4.371 
                 1.00 
                 37.35 
                 C 
               
               
                 ATOM 
                 1388 
                 O 
                 LEU 
                 B 
                 68 
                 58.662 
                 20.744 
                 4.436 
                 1.00 
                 37.12 
                 O 
               
               
                 ATOM 
                 1389 
                 N 
                 ARG 
                 B 
                 69 
                 56.844 
                 20.082 
                 3.232 
                 1.00 
                 37.75 
                 N 
               
               
                 ATOM 
                 1390 
                 CA 
                 ARG 
                 B 
                 69 
                 57.361 
                 20.564 
                 1.965 
                 1.00 
                 38.27 
                 C 
               
               
                 ATOM 
                 1391 
                 CB 
                 ARG 
                 B 
                 69 
                 57.563 
                 19.402 
                 1.011 
                 1.00 
                 38.49 
                 C 
               
               
                 ATOM 
                 1392 
                 CG 
                 ARG 
                 B 
                 69 
                 58.147 
                 19.759 
                 −0.323 
                 1.00 
                 40.65 
                 C 
               
               
                 ATOM 
                 1393 
                 CD 
                 ARG 
                 B 
                 69 
                 58.789 
                 18.518 
                 −0.879 
                 1.00 
                 47.79 
                 C 
               
               
                 ATOM 
                 1394 
                 NE 
                 ARG 
                 B 
                 69 
                 59.309 
                 18.659 
                 −2.242 
                 1.00 
                 54.67 
                 N 
               
               
                 ATOM 
                 1395 
                 CZ 
                 ARG 
                 B 
                 69 
                 60.446 
                 19.288 
                 −2.573 
                 1.00 
                 57.95 
                 C 
               
               
                 ATOM 
                 1396 
                 NH1 
                 ARG 
                 B 
                 69 
                 60.826 
                 19.348 
                 −3.855 
                 1.00 
                 57.88 
                 N 
               
               
                 ATOM 
                 1397 
                 NH2 
                 ARG 
                 B 
                 69 
                 61.199 
                 19.877 
                 −1.634 
                 1.00 
                 58.92 
                 N 
               
               
                 ATOM 
                 1398 
                 C 
                 ARG 
                 B 
                 69 
                 56.400 
                 21.593 
                 1.387 
                 1.00 
                 38.17 
                 C 
               
               
                 ATOM 
                 1399 
                 O 
                 ARG 
                 B 
                 69 
                 55.235 
                 21.297 
                 1.149 
                 1.00 
                 37.57 
                 O 
               
               
                 ATOM 
                 1400 
                 N 
                 ILE 
                 B 
                 70 
                 56.908 
                 22.810 
                 1.184 
                 1.00 
                 39.05 
                 N 
               
               
                 ATOM 
                 1401 
                 CA 
                 ILE 
                 B 
                 70 
                 56.128 
                 23.927 
                 0.615 
                 1.00 
                 39.54 
                 C 
               
               
                 ATOM 
                 1402 
                 CB 
                 ILE 
                 B 
                 70 
                 56.290 
                 25.218 
                 1.432 
                 1.00 
                 39.53 
                 C 
               
               
                 ATOM 
                 1403 
                 CG1 
                 ILE 
                 B 
                 70 
                 55.884 
                 24.995 
                 2.883 
                 1.00 
                 38.64 
                 C 
               
               
                 ATOM 
                 1404 
                 CD1 
                 ILE 
                 B 
                 70 
                 56.532 
                 25.975 
                 3.773 
                 1.00 
                 40.33 
                 C 
               
               
                 ATOM 
                 1405 
                 CG2 
                 ILE 
                 B 
                 70 
                 55.443 
                 26.333 
                 0.848 
                 1.00 
                 40.01 
                 C 
               
               
                 ATOM 
                 1406 
                 C 
                 ILE 
                 B 
                 70 
                 56.579 
                 24.194 
                 −0.810 
                 1.00 
                 39.97 
                 C 
               
               
                 ATOM 
                 1407 
                 O 
                 ILE 
                 B 
                 70 
                 57.765 
                 24.444 
                 −1.075 
                 1.00 
                 40.13 
                 O 
               
               
                 ATOM 
                 1408 
                 N 
                 ARG 
                 B 
                 71 
                 55.633 
                 24.120 
                 −1.732 
                 1.00 
                 40.24 
                 N 
               
               
                 ATOM 
                 1409 
                 CA 
                 ARG 
                 B 
                 71 
                 55.962 
                 24.303 
                 −3.135 
                 1.00 
                 40.82 
                 C 
               
               
                 ATOM 
                 1410 
                 CB 
                 ARG 
                 B 
                 71 
                 55.148 
                 23.348 
                 −3.993 
                 1.00 
                 41.16 
                 C 
               
               
                 ATOM 
                 1411 
                 CG 
                 ARG 
                 B 
                 71 
                 55.337 
                 21.888 
                 −3.639 
                 1.00 
                 44.57 
                 C 
               
               
                 ATOM 
                 1412 
                 CD 
                 ARG 
                 B 
                 71 
                 54.725 
                 20.992 
                 −4.710 
                 1.00 
                 49.70 
                 C 
               
               
                 ATOM 
                 1413 
                 NE 
                 ARG 
                 B 
                 71 
                 54.807 
                 21.588 
                 −6.046 
                 1.00 
                 53.70 
                 N 
               
               
                 ATOM 
                 1414 
                 CZ 
                 ARG 
                 B 
                 71 
                 54.572 
                 20.944 
                 −7.194 
                 1.00 
                 55.90 
                 C 
               
               
                 ATOM 
                 1415 
                 NH1 
                 ARG 
                 B 
                 71 
                 54.674 
                 21.597 
                 −8.352 
                 1.00 
                 56.14 
                 N 
               
               
                 ATOM 
                 1416 
                 NH2 
                 ARG 
                 B 
                 71 
                 54.239 
                 19.652 
                 −7.198 
                 1.00 
                 56.04 
                 N 
               
               
                 ATOM 
                 1417 
                 C 
                 ARG 
                 B 
                 71 
                 55.697 
                 25.725 
                 −3.590 
                 1.00 
                 40.23 
                 C 
               
               
                 ATOM 
                 1418 
                 O 
                 ARG 
                 B 
                 71 
                 54.853 
                 26.410 
                 −3.043 
                 1.00 
                 40.21 
                 O 
               
               
                 ATOM 
                 1419 
                 N 
                 ASP 
                 B 
                 72 
                 56.432 
                 26.166 
                 −4.598 
                 1.00 
                 39.99 
                 N 
               
               
                 ATOM 
                 1420 
                 CA 
                 ASP 
                 B 
                 72 
                 56.074 
                 27.365 
                 −5.311 
                 1.00 
                 39.63 
                 C 
               
               
                 ATOM 
                 1421 
                 CB 
                 ASP 
                 B 
                 72 
                 54.633 
                 27.247 
                 −5.794 
                 1.00 
                 40.12 
                 C 
               
               
                 ATOM 
                 1422 
                 CG 
                 ASP 
                 B 
                 72 
                 54.453 
                 27.755 
                 −7.197 
                 1.00 
                 43.50 
                 C 
               
               
                 ATOM 
                 1423 
                 OD1 
                 ASP 
                 B 
                 72 
                 53.897 
                 26.973 
                 −8.008 
                 1.00 
                 47.76 
                 O 
               
               
                 ATOM 
                 1424 
                 OD2 
                 ASP 
                 B 
                 72 
                 54.870 
                 28.909 
                 −7.500 
                 1.00 
                 45.42 
                 O 
               
               
                 ATOM 
                 1425 
                 C 
                 ASP 
                 B 
                 72 
                 56.216 
                 28.575 
                 −4.419 
                 1.00 
                 38.78 
                 C 
               
               
                 ATOM 
                 1426 
                 O 
                 ASP 
                 B 
                 72 
                 55.359 
                 29.435 
                 −4.391 
                 1.00 
                 39.10 
                 O 
               
               
                 ATOM 
                 1427 
                 N 
                 LEU 
                 B 
                 73 
                 57.306 
                 28.639 
                 −3.681 
                 1.00 
                 38.19 
                 N 
               
               
                 ATOM 
                 1428 
                 CA 
                 LEU 
                 B 
                 73 
                 57.606 
                 29.804 
                 −2.868 
                 1.00 
                 37.69 
                 C 
               
               
                 ATOM 
                 1429 
                 CB 
                 LEU 
                 B 
                 73 
                 59.012 
                 29.684 
                 −2.307 
                 1.00 
                 37.08 
                 C 
               
               
                 ATOM 
                 1430 
                 CG 
                 LEU 
                 B 
                 73 
                 59.129 
                 28.569 
                 −1.283 
                 1.00 
                 35.84 
                 C 
               
               
                 ATOM 
                 1431 
                 CD1 
                 LEU 
                 B 
                 73 
                 60.549 
                 28.541 
                 −0.791 
                 1.00 
                 37.26 
                 C 
               
               
                 ATOM 
                 1432 
                 CD2 
                 LEU 
                 B 
                 73 
                 58.171 
                 28.844 
                 −0.129 
                 1.00 
                 34.44 
                 C 
               
               
                 ATOM 
                 1433 
                 C 
                 LEU 
                 B 
                 73 
                 57.413 
                 31.156 
                 −3.563 
                 1.00 
                 38.01 
                 C 
               
               
                 ATOM 
                 1434 
                 O 
                 LEU 
                 B 
                 73 
                 57.757 
                 31.336 
                 −4.733 
                 1.00 
                 37.97 
                 O 
               
               
                 ATOM 
                 1435 
                 N 
                 ARG 
                 B 
                 74 
                 56.827 
                 32.090 
                 −2.822 
                 1.00 
                 38.54 
                 N 
               
               
                 ATOM 
                 1436 
                 CA 
                 ARG 
                 B 
                 74 
                 56.692 
                 33.480 
                 −3.231 
                 1.00 
                 39.03 
                 C 
               
               
                 ATOM 
                 1437 
                 CB 
                 ARG 
                 B 
                 74 
                 55.210 
                 33.868 
                 −3.329 
                 1.00 
                 39.96 
                 C 
               
               
                 ATOM 
                 1438 
                 CG 
                 ARG 
                 B 
                 74 
                 54.303 
                 32.933 
                 −4.150 
                 1.00 
                 42.17 
                 C 
               
               
                 ATOM 
                 1439 
                 CD 
                 ARG 
                 B 
                 74 
                 53.881 
                 31.746 
                 −3.285 
                 1.00 
                 46.75 
                 C 
               
               
                 ATOM 
                 1440 
                 NE 
                 ARG 
                 B 
                 74 
                 52.745 
                 30.999 
                 −3.823 
                 1.00 
                 50.63 
                 N 
               
               
                 ATOM 
                 1441 
                 CZ 
                 ARG 
                 B 
                 74 
                 51.483 
                 31.425 
                 −3.764 
                 1.00 
                 53.30 
                 C 
               
               
                 ATOM 
                 1442 
                 NH1 
                 ARG 
                 B 
                 74 
                 50.499 
                 30.671 
                 −4.259 
                 1.00 
                 54.24 
                 N 
               
               
                 ATOM 
                 1443 
                 NH2 
                 ARG 
                 B 
                 74 
                 51.201 
                 32.612 
                 −3.214 
                 1.00 
                 53.43 
                 N 
               
               
                 ATOM 
                 1444 
                 C 
                 ARG 
                 B 
                 74 
                 57.359 
                 34.300 
                 −2.150 
                 1.00 
                 38.76 
                 C 
               
               
                 ATOM 
                 1445 
                 O 
                 ARG 
                 B 
                 74 
                 57.595 
                 33.785 
                 −1.062 
                 1.00 
                 38.68 
                 O 
               
               
                 ATOM 
                 1446 
                 N 
                 VAL 
                 B 
                 75 
                 57.666 
                 35.564 
                 −2.409 
                 1.00 
                 39.03 
                 N 
               
               
                 ATOM 
                 1447 
                 CA 
                 VAL 
                 B 
                 75 
                 58.293 
                 36.391 
                 −1.348 
                 1.00 
                 39.94 
                 C 
               
               
                 ATOM 
                 1448 
                 CB 
                 VAL 
                 B 
                 75 
                 58.755 
                 37.808 
                 −1.812 
                 1.00 
                 39.90 
                 C 
               
               
                 ATOM 
                 1449 
                 CG1 
                 VAL 
                 B 
                 75 
                 59.921 
                 37.712 
                 −2.824 
                 1.00 
                 40.00 
                 C 
               
               
                 ATOM 
                 1450 
                 CG2 
                 VAL 
                 B 
                 75 
                 57.599 
                 38.585 
                 −2.382 
                 1.00 
                 40.10 
                 C 
               
               
                 ATOM 
                 1451 
                 C 
                 VAL 
                 B 
                 75 
                 57.447 
                 36.512 
                 −0.072 
                 1.00 
                 40.09 
                 C 
               
               
                 ATOM 
                 1452 
                 O 
                 VAL 
                 B 
                 75 
                 57.986 
                 36.505 
                 1.021 
                 1.00 
                 40.49 
                 O 
               
               
                 ATOM 
                 1453 
                 N 
                 GLU 
                 B 
                 76 
                 56.131 
                 36.583 
                 −0.212 
                 1.00 
                 40.25 
                 N 
               
               
                 ATOM 
                 1454 
                 CA 
                 GLU 
                 B 
                 76 
                 55.243 
                 36.585 
                 0.931 
                 1.00 
                 41.00 
                 C 
               
               
                 ATOM 
                 1455 
                 CB 
                 GLU 
                 B 
                 76 
                 53.794 
                 36.502 
                 0.475 
                 1.00 
                 41.62 
                 C 
               
               
                 ATOM 
                 1456 
                 CG 
                 GLU 
                 B 
                 76 
                 53.401 
                 37.530 
                 −0.549 
                 1.00 
                 46.34 
                 C 
               
               
                 ATOM 
                 1457 
                 CD 
                 GLU 
                 B 
                 76 
                 53.603 
                 37.033 
                 −1.981 
                 1.00 
                 51.96 
                 C 
               
               
                 ATOM 
                 1458 
                 OE1 
                 GLU 
                 B 
                 76 
                 52.868 
                 36.077 
                 −2.374 
                 1.00 
                 53.72 
                 O 
               
               
                 ATOM 
                 1459 
                 OE2 
                 GLU 
                 B 
                 76 
                 54.479 
                 37.611 
                 −2.699 
                 1.00 
                 52.46 
                 O 
               
               
                 ATOM 
                 1460 
                 C 
                 GLU 
                 B 
                 76 
                 55.488 
                 35.438 
                 1.899 
                 1.00 
                 40.60 
                 C 
               
               
                 ATOM 
                 1461 
                 O 
                 GLU 
                 B 
                 76 
                 55.188 
                 35.558 
                 3.068 
                 1.00 
                 40.70 
                 O 
               
               
                 ATOM 
                 1462 
                 N 
                 ASP 
                 B 
                 77 
                 55.995 
                 34.314 
                 1.412 
                 1.00 
                 40.65 
                 N 
               
               
                 ATOM 
                 1463 
                 CA 
                 ASP 
                 B 
                 77 
                 56.168 
                 33.140 
                 2.261 
                 1.00 
                 40.78 
                 C 
               
               
                 ATOM 
                 1464 
                 CB 
                 ASP 
                 B 
                 77 
                 56.366 
                 31.865 
                 1.430 
                 1.00 
                 40.99 
                 C 
               
               
                 ATOM 
                 1465 
                 CG 
                 ASP 
                 B 
                 77 
                 55.160 
                 31.509 
                 0.593 
                 1.00 
                 42.47 
                 C 
               
               
                 ATOM 
                 1466 
                 OD1 
                 ASP 
                 B 
                 77 
                 54.012 
                 31.891 
                 0.925 
                 1.00 
                 43.22 
                 O 
               
               
                 ATOM 
                 1467 
                 OD2 
                 ASP 
                 B 
                 77 
                 55.363 
                 30.813 
                 −0.417 
                 1.00 
                 45.98 
                 O 
               
               
                 ATOM 
                 1468 
                 C 
                 ASP 
                 B 
                 77 
                 57.349 
                 33.282 
                 3.203 
                 1.00 
                 40.48 
                 C 
               
               
                 ATOM 
                 1469 
                 O 
                 ASP 
                 B 
                 77 
                 57.547 
                 32.406 
                 4.062 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 1470 
                 N 
                 SER 
                 B 
                 78 
                 58.144 
                 34.343 
                 3.026 
                 1.00 
                 39.20 
                 N 
               
               
                 ATOM 
                 1471 
                 CA 
                 SER 
                 B 
                 78 
                 59.263 
                 34.613 
                 3.919 
                 1.00 
                 38.61 
                 C 
               
               
                 ATOM 
                 1472 
                 CB 
                 SER 
                 B 
                 78 
                 60.034 
                 35.853 
                 3.479 
                 1.00 
                 38.59 
                 C 
               
               
                 ATOM 
                 1473 
                 OG 
                 SER 
                 B 
                 78 
                 60.749 
                 35.584 
                 2.287 
                 1.00 
                 39.13 
                 O 
               
               
                 ATOM 
                 1474 
                 C 
                 SER 
                 B 
                 78 
                 58.774 
                 34.798 
                 5.349 
                 1.00 
                 38.23 
                 C 
               
               
                 ATOM 
                 1475 
                 O 
                 SER 
                 B 
                 78 
                 57.725 
                 35.412 
                 5.566 
                 1.00 
                 38.16 
                 O 
               
               
                 ATOM 
                 1476 
                 N 
                 GLY 
                 B 
                 79 
                 59.526 
                 34.264 
                 6.310 
                 1.00 
                 37.06 
                 N 
               
               
                 ATOM 
                 1477 
                 CA 
                 GLY 
                 B 
                 79 
                 59.172 
                 34.394 
                 7.702 
                 1.00 
                 36.72 
                 C 
               
               
                 ATOM 
                 1478 
                 C 
                 GLY 
                 B 
                 79 
                 59.642 
                 33.241 
                 8.571 
                 1.00 
                 36.81 
                 C 
               
               
                 ATOM 
                 1479 
                 O 
                 GLY 
                 B 
                 79 
                 60.418 
                 32.386 
                 8.120 
                 1.00 
                 37.01 
                 O 
               
               
                 ATOM 
                 1480 
                 N 
                 THR 
                 B 
                 80 
                 59.182 
                 33.215 
                 9.820 
                 1.00 
                 35.82 
                 N 
               
               
                 ATOM 
                 1481 
                 CA 
                 THR 
                 B 
                 80 
                 59.539 
                 32.136 
                 10.723 
                 1.00 
                 35.70 
                 C 
               
               
                 ATOM 
                 1482 
                 CB 
                 THR 
                 B 
                 80 
                 59.759 
                 32.708 
                 12.113 
                 1.00 
                 35.62 
                 C 
               
               
                 ATOM 
                 1483 
                 OG1 
                 THR 
                 B 
                 80 
                 60.574 
                 33.869 
                 11.970 
                 1.00 
                 35.54 
                 O 
               
               
                 ATOM 
                 1484 
                 CG2 
                 THR 
                 B 
                 80 
                 60.452 
                 31.710 
                 13.024 
                 1.00 
                 34.98 
                 C 
               
               
                 ATOM 
                 1485 
                 C 
                 THR 
                 B 
                 80 
                 58.516 
                 30.983 
                 10.729 
                 1.00 
                 35.72 
                 C 
               
               
                 ATOM 
                 1486 
                 O 
                 THR 
                 B 
                 80 
                 57.311 
                 31.195 
                 10.948 
                 1.00 
                 35.81 
                 O 
               
               
                 ATOM 
                 1487 
                 N 
                 TYR 
                 B 
                 81 
                 59.010 
                 29.773 
                 10.482 
                 1.00 
                 35.54 
                 N 
               
               
                 ATOM 
                 1488 
                 CA 
                 TYR 
                 B 
                 81 
                 58.184 
                 28.569 
                 10.454 
                 1.00 
                 36.16 
                 C 
               
               
                 ATOM 
                 1489 
                 CB 
                 TYR 
                 B 
                 81 
                 58.423 
                 27.801 
                 9.156 
                 1.00 
                 36.56 
                 C 
               
               
                 ATOM 
                 1490 
                 CG 
                 TYR 
                 B 
                 81 
                 57.831 
                 28.448 
                 7.928 
                 1.00 
                 36.94 
                 C 
               
               
                 ATOM 
                 1491 
                 CD1 
                 TYR 
                 B 
                 81 
                 58.527 
                 29.423 
                 7.216 
                 1.00 
                 36.56 
                 C 
               
               
                 ATOM 
                 1492 
                 CE1 
                 TYR 
                 B 
                 81 
                 57.963 
                 30.016 
                 6.076 
                 1.00 
                 37.63 
                 C 
               
               
                 ATOM 
                 1493 
                 CZ 
                 TYR 
                 B 
                 81 
                 56.691 
                 29.622 
                 5.665 
                 1.00 
                 37.70 
                 C 
               
               
                 ATOM 
                 1494 
                 OH 
                 TYR 
                 B 
                 81 
                 56.095 
                 30.186 
                 4.569 
                 1.00 
                 38.04 
                 O 
               
               
                 ATOM 
                 1495 
                 CE2 
                 TYR 
                 B 
                 81 
                 55.998 
                 28.655 
                 6.355 
                 1.00 
                 37.62 
                 C 
               
               
                 ATOM 
                 1496 
                 CD2 
                 TYR 
                 B 
                 81 
                 56.562 
                 28.078 
                 7.477 
                 1.00 
                 37.71 
                 C 
               
               
                 ATOM 
                 1497 
                 C 
                 TYR 
                 B 
                 81 
                 58.519 
                 27.653 
                 11.625 
                 1.00 
                 36.66 
                 C 
               
               
                 ATOM 
                 1498 
                 O 
                 TYR 
                 B 
                 81 
                 59.681 
                 27.295 
                 11.816 
                 1.00 
                 36.33 
                 O 
               
               
                 ATOM 
                 1499 
                 N 
                 LYS 
                 B 
                 82 
                 57.512 
                 27.275 
                 12.416 
                 1.00 
                 37.35 
                 N 
               
               
                 ATOM 
                 1500 
                 CA 
                 LYS 
                 B 
                 82 
                 57.738 
                 26.370 
                 13.551 
                 1.00 
                 37.75 
                 C 
               
               
                 ATOM 
                 1501 
                 CB 
                 LYS 
                 B 
                 82 
                 57.561 
                 27.102 
                 14.872 
                 1.00 
                 37.28 
                 C 
               
               
                 ATOM 
                 1502 
                 CG 
                 LYS 
                 B 
                 82 
                 58.401 
                 28.335 
                 15.050 
                 1.00 
                 36.86 
                 C 
               
               
                 ATOM 
                 1503 
                 CD 
                 LYS 
                 B 
                 82 
                 58.600 
                 28.661 
                 16.530 
                 1.00 
                 37.26 
                 C 
               
               
                 ATOM 
                 1504 
                 CE 
                 LYS 
                 B 
                 82 
                 59.231 
                 30.041 
                 16.696 
                 1.00 
                 38.77 
                 C 
               
               
                 ATOM 
                 1505 
                 NZ 
                 LYS 
                 B 
                 82 
                 60.333 
                 30.124 
                 17.734 
                 1.00 
                 38.13 
                 N 
               
               
                 ATOM 
                 1506 
                 C 
                 LYS 
                 B 
                 82 
                 56.820 
                 25.141 
                 13.513 
                 1.00 
                 38.47 
                 C 
               
               
                 ATOM 
                 1507 
                 O 
                 LYS 
                 B 
                 82 
                 55.628 
                 25.258 
                 13.236 
                 1.00 
                 39.02 
                 O 
               
               
                 ATOM 
                 1508 
                 N 
                 CYS 
                 B 
                 83 
                 57.376 
                 23.967 
                 13.795 
                 1.00 
                 39.00 
                 N 
               
               
                 ATOM 
                 1509 
                 CA 
                 CYS 
                 B 
                 83 
                 56.578 
                 22.739 
                 13.854 
                 1.00 
                 39.64 
                 C 
               
               
                 ATOM 
                 1510 
                 CB 
                 CYS 
                 B 
                 83 
                 57.339 
                 21.546 
                 13.248 
                 1.00 
                 39.79 
                 C 
               
               
                 ATOM 
                 1511 
                 SG 
                 CYS 
                 B 
                 83 
                 58.916 
                 21.142 
                 14.085 
                 1.00 
                 41.25 
                 S 
               
               
                 ATOM 
                 1512 
                 C 
                 CYS 
                 B 
                 83 
                 56.183 
                 22.432 
                 15.302 
                 1.00 
                 39.76 
                 C 
               
               
                 ATOM 
                 1513 
                 O 
                 CYS 
                 B 
                 83 
                 56.962 
                 22.700 
                 16.229 
                 1.00 
                 39.86 
                 O 
               
               
                 ATOM 
                 1514 
                 N 
                 GLY 
                 B 
                 84 
                 54.981 
                 21.879 
                 15.487 
                 1.00 
                 39.61 
                 N 
               
               
                 ATOM 
                 1515 
                 CA 
                 GLY 
                 B 
                 84 
                 54.527 
                 21.428 
                 16.805 
                 1.00 
                 39.36 
                 C 
               
               
                 ATOM 
                 1516 
                 C 
                 GLY 
                 B 
                 84 
                 54.312 
                 19.928 
                 16.816 
                 1.00 
                 39.37 
                 C 
               
               
                 ATOM 
                 1517 
                 O 
                 GLY 
                 B 
                 84 
                 53.726 
                 19.372 
                 15.893 
                 1.00 
                 39.74 
                 O 
               
               
                 ATOM 
                 1518 
                 N 
                 ALA 
                 B 
                 85 
                 54.809 
                 19.262 
                 17.846 
                 1.00 
                 39.35 
                 N 
               
               
                 ATOM 
                 1519 
                 CA 
                 ALA 
                 B 
                 85 
                 54.593 
                 17.833 
                 18.008 
                 1.00 
                 39.38 
                 C 
               
               
                 ATOM 
                 1520 
                 CB 
                 ALA 
                 B 
                 85 
                 55.897 
                 17.091 
                 17.945 
                 1.00 
                 39.21 
                 C 
               
               
                 ATOM 
                 1521 
                 C 
                 ALA 
                 B 
                 85 
                 53.871 
                 17.562 
                 19.327 
                 1.00 
                 39.54 
                 C 
               
               
                 ATOM 
                 1522 
                 O 
                 ALA 
                 B 
                 85 
                 54.252 
                 18.090 
                 20.364 
                 1.00 
                 39.26 
                 O 
               
               
                 ATOM 
                 1523 
                 N 
                 TYR 
                 B 
                 86 
                 52.814 
                 16.755 
                 19.253 
                 1.00 
                 40.01 
                 N 
               
               
                 ATOM 
                 1524 
                 CA 
                 TYR 
                 B 
                 86 
                 51.962 
                 16.400 
                 20.392 
                 1.00 
                 40.48 
                 C 
               
               
                 ATOM 
                 1525 
                 CB 
                 TYR 
                 B 
                 86 
                 50.556 
                 16.923 
                 20.161 
                 1.00 
                 40.34 
                 C 
               
               
                 ATOM 
                 1526 
                 CG 
                 TYR 
                 B 
                 86 
                 50.584 
                 18.401 
                 19.902 
                 1.00 
                 40.96 
                 C 
               
               
                 ATOM 
                 1527 
                 CD1 
                 TYR 
                 B 
                 86 
                 51.003 
                 18.895 
                 18.666 
                 1.00 
                 41.70 
                 C 
               
               
                 ATOM 
                 1528 
                 CE1 
                 TYR 
                 B 
                 86 
                 51.062 
                 20.246 
                 18.420 
                 1.00 
                 42.23 
                 C 
               
               
                 ATOM 
                 1529 
                 CZ 
                 TYR 
                 B 
                 86 
                 50.698 
                 21.129 
                 19.424 
                 1.00 
                 41.82 
                 C 
               
               
                 ATOM 
                 1530 
                 OH 
                 TYR 
                 B 
                 86 
                 50.760 
                 22.479 
                 19.169 
                 1.00 
                 42.60 
                 O 
               
               
                 ATOM 
                 1531 
                 CE2 
                 TYR 
                 B 
                 86 
                 50.269 
                 20.667 
                 20.660 
                 1.00 
                 40.71 
                 C 
               
               
                 ATOM 
                 1532 
                 CD2 
                 TYR 
                 B 
                 86 
                 50.227 
                 19.312 
                 20.896 
                 1.00 
                 40.41 
                 C 
               
               
                 ATOM 
                 1533 
                 C 
                 TYR 
                 B 
                 86 
                 51.951 
                 14.894 
                 20.626 
                 1.00 
                 41.00 
                 C 
               
               
                 ATOM 
                 1534 
                 O 
                 TYR 
                 B 
                 86 
                 51.743 
                 14.103 
                 19.693 
                 1.00 
                 40.55 
                 O 
               
               
                 ATOM 
                 1535 
                 N 
                 PHE 
                 B 
                 87 
                 52.190 
                 14.506 
                 21.877 
                 1.00 
                 41.83 
                 N 
               
               
                 ATOM 
                 1536 
                 CA 
                 PHE 
                 B 
                 87 
                 52.457 
                 13.106 
                 22.201 
                 1.00 
                 42.83 
                 C 
               
               
                 ATOM 
                 1537 
                 CB 
                 PHE 
                 B 
                 87 
                 53.977 
                 12.835 
                 22.309 
                 1.00 
                 42.90 
                 C 
               
               
                 ATOM 
                 1538 
                 CG 
                 PHE 
                 B 
                 87 
                 54.726 
                 13.842 
                 23.133 
                 1.00 
                 43.47 
                 C 
               
               
                 ATOM 
                 1539 
                 CD1 
                 PHE 
                 B 
                 87 
                 55.350 
                 14.932 
                 22.522 
                 1.00 
                 43.68 
                 C 
               
               
                 ATOM 
                 1540 
                 CE1 
                 PHE 
                 B 
                 87 
                 56.058 
                 15.887 
                 23.293 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 1541 
                 CZ 
                 PHE 
                 B 
                 87 
                 56.141 
                 15.741 
                 24.701 
                 1.00 
                 45.10 
                 C 
               
               
                 ATOM 
                 1542 
                 CE2 
                 PHE 
                 B 
                 87 
                 55.516 
                 14.636 
                 25.316 
                 1.00 
                 45.18 
                 C 
               
               
                 ATOM 
                 1543 
                 CD2 
                 PHE 
                 B 
                 87 
                 54.817 
                 13.699 
                 24.524 
                 1.00 
                 43.90 
                 C 
               
               
                 ATOM 
                 1544 
                 C 
                 PHE 
                 B 
                 87 
                 51.726 
                 12.583 
                 23.432 
                 1.00 
                 43.25 
                 C 
               
               
                 ATOM 
                 1545 
                 O 
                 PHE 
                 B 
                 87 
                 51.548 
                 13.314 
                 24.408 
                 1.00 
                 43.61 
                 O 
               
               
                 ATOM 
                 1546 
                 N 
                 SER 
                 B 
                 88 
                 51.315 
                 11.312 
                 23.360 
                 1.00 
                 43.83 
                 N 
               
               
                 ATOM 
                 1547 
                 CA 
                 SER 
                 B 
                 88 
                 50.744 
                 10.558 
                 24.482 
                 1.00 
                 44.35 
                 C 
               
               
                 ATOM 
                 1548 
                 CB 
                 SER 
                 B 
                 88 
                 49.311 
                 10.125 
                 24.156 
                 1.00 
                 44.34 
                 C 
               
               
                 ATOM 
                 1549 
                 OG 
                 SER 
                 B 
                 88 
                 49.310 
                 9.090 
                 23.186 
                 1.00 
                 44.40 
                 O 
               
               
                 ATOM 
                 1550 
                 C 
                 SER 
                 B 
                 88 
                 51.610 
                 9.322 
                 24.808 
                 1.00 
                 44.75 
                 C 
               
               
                 ATOM 
                 1551 
                 O 
                 SER 
                 B 
                 88 
                 51.280 
                 8.488 
                 25.676 
                 1.00 
                 45.27 
                 O 
               
               
                 ATOM 
                 1552 
                 N 
                 PRO 
                 B 
                 99 
                 50.592 
                 16.449 
                 26.451 
                 1.00 
                 49.45 
                 N 
               
               
                 ATOM 
                 1553 
                 CA 
                 PRO 
                 B 
                 99 
                 51.216 
                 17.750 
                 26.211 
                 1.00 
                 48.89 
                 C 
               
               
                 ATOM 
                 1554 
                 CB 
                 PRO 
                 B 
                 99 
                 52.227 
                 17.885 
                 27.369 
                 1.00 
                 49.12 
                 C 
               
               
                 ATOM 
                 1555 
                 CG 
                 PRO 
                 B 
                 99 
                 52.424 
                 16.435 
                 27.917 
                 1.00 
                 49.96 
                 C 
               
               
                 ATOM 
                 1556 
                 CD 
                 PRO 
                 B 
                 99 
                 51.517 
                 15.505 
                 27.109 
                 1.00 
                 49.56 
                 C 
               
               
                 ATOM 
                 1557 
                 C 
                 PRO 
                 B 
                 99 
                 51.926 
                 17.713 
                 24.875 
                 1.00 
                 48.30 
                 C 
               
               
                 ATOM 
                 1558 
                 O 
                 PRO 
                 B 
                 99 
                 51.682 
                 16.788 
                 24.100 
                 1.00 
                 47.97 
                 O 
               
               
                 ATOM 
                 1559 
                 N 
                 GLY 
                 B 
                 100 
                 52.795 
                 18.696 
                 24.616 
                 1.00 
                 47.85 
                 N 
               
               
                 ATOM 
                 1560 
                 CA 
                 GLY 
                 B 
                 100 
                 53.472 
                 18.823 
                 23.322 
                 1.00 
                 47.04 
                 C 
               
               
                 ATOM 
                 1561 
                 C 
                 GLY 
                 B 
                 100 
                 54.567 
                 19.872 
                 23.223 
                 1.00 
                 46.58 
                 C 
               
               
                 ATOM 
                 1562 
                 O 
                 GLY 
                 B 
                 100 
                 54.601 
                 20.824 
                 23.997 
                 1.00 
                 46.58 
                 O 
               
               
                 ATOM 
                 1563 
                 N 
                 GLU 
                 B 
                 101 
                 55.432 
                 19.709 
                 22.226 
                 1.00 
                 46.07 
                 N 
               
               
                 ATOM 
                 1564 
                 CA 
                 GLU 
                 B 
                 101 
                 56.662 
                 20.482 
                 22.107 
                 1.00 
                 45.71 
                 C 
               
               
                 ATOM 
                 1565 
                 CB 
                 GLU 
                 B 
                 101 
                 57.818 
                 19.564 
                 22.490 
                 1.00 
                 45.87 
                 C 
               
               
                 ATOM 
                 1566 
                 CG 
                 GLU 
                 B 
                 101 
                 58.927 
                 20.251 
                 23.221 
                 1.00 
                 47.85 
                 C 
               
               
                 ATOM 
                 1567 
                 CD 
                 GLU 
                 B 
                 101 
                 58.610 
                 20.469 
                 24.686 
                 1.00 
                 50.59 
                 C 
               
               
                 ATOM 
                 1568 
                 OE1 
                 GLU 
                 B 
                 101 
                 58.886 
                 21.582 
                 25.191 
                 1.00 
                 52.40 
                 O 
               
               
                 ATOM 
                 1569 
                 OE2 
                 GLU 
                 B 
                 101 
                 58.096 
                 19.533 
                 25.337 
                 1.00 
                 51.15 
                 O 
               
               
                 ATOM 
                 1570 
                 C 
                 GLU 
                 B 
                 101 
                 56.892 
                 21.092 
                 20.691 
                 1.00 
                 44.89 
                 C 
               
               
                 ATOM 
                 1571 
                 O 
                 GLU 
                 B 
                 101 
                 56.642 
                 20.439 
                 19.685 
                 1.00 
                 44.67 
                 O 
               
               
                 ATOM 
                 1572 
                 N 
                 LYS 
                 B 
                 102 
                 57.376 
                 22.336 
                 20.630 
                 1.00 
                 44.18 
                 N 
               
               
                 ATOM 
                 1573 
                 CA 
                 LYS 
                 B 
                 102 
                 57.632 
                 23.060 
                 19.367 
                 1.00 
                 43.65 
                 C 
               
               
                 ATOM 
                 1574 
                 CB 
                 LYS 
                 B 
                 102 
                 57.152 
                 24.511 
                 19.470 
                 1.00 
                 43.65 
                 C 
               
               
                 ATOM 
                 1575 
                 CG 
                 LYS 
                 B 
                 102 
                 55.651 
                 24.743 
                 19.306 
                 1.00 
                 44.74 
                 C 
               
               
                 ATOM 
                 1576 
                 CD 
                 LYS 
                 B 
                 102 
                 55.342 
                 26.238 
                 19.111 
                 1.00 
                 45.16 
                 C 
               
               
                 ATOM 
                 1577 
                 CE 
                 LYS 
                 B 
                 102 
                 53.864 
                 26.562 
                 19.392 
                 1.00 
                 49.60 
                 C 
               
               
                 ATOM 
                 1578 
                 NZ 
                 LYS 
                 B 
                 102 
                 53.568 
                 28.028 
                 19.318 
                 1.00 
                 50.55 
                 N 
               
               
                 ATOM 
                 1579 
                 C 
                 LYS 
                 B 
                 102 
                 59.113 
                 23.095 
                 18.990 
                 1.00 
                 42.61 
                 C 
               
               
                 ATOM 
                 1580 
                 O 
                 LYS 
                 B 
                 102 
                 59.981 
                 23.114 
                 19.859 
                 1.00 
                 42.56 
                 O 
               
               
                 ATOM 
                 1581 
                 N 
                 GLY 
                 B 
                 103 
                 59.410 
                 23.128 
                 17.696 
                 1.00 
                 41.72 
                 N 
               
               
                 ATOM 
                 1582 
                 CA 
                 GLY 
                 B 
                 103 
                 60.808 
                 23.232 
                 17.259 
                 1.00 
                 40.69 
                 C 
               
               
                 ATOM 
                 1583 
                 C 
                 GLY 
                 B 
                 103 
                 61.291 
                 24.672 
                 17.305 
                 1.00 
                 39.71 
                 C 
               
               
                 ATOM 
                 1584 
                 O 
                 GLY 
                 B 
                 103 
                 60.478 
                 25.592 
                 17.294 
                 1.00 
                 39.87 
                 O 
               
               
                 ATOM 
                 1585 
                 N 
                 ALA 
                 B 
                 104 
                 62.601 
                 24.884 
                 17.338 
                 1.00 
                 38.38 
                 N 
               
               
                 ATOM 
                 1586 
                 CA 
                 ALA 
                 B 
                 104 
                 63.122 
                 26.246 
                 17.337 
                 1.00 
                 37.74 
                 C 
               
               
                 ATOM 
                 1587 
                 CB 
                 ALA 
                 B 
                 104 
                 64.632 
                 26.254 
                 17.379 
                 1.00 
                 37.58 
                 C 
               
               
                 ATOM 
                 1588 
                 C 
                 ALA 
                 B 
                 104 
                 62.620 
                 27.082 
                 16.151 
                 1.00 
                 37.52 
                 C 
               
               
                 ATOM 
                 1589 
                 O 
                 ALA 
                 B 
                 104 
                 62.298 
                 28.245 
                 16.315 
                 1.00 
                 38.11 
                 O 
               
               
                 ATOM 
                 1590 
                 N 
                 GLY 
                 B 
                 105 
                 62.558 
                 26.513 
                 14.957 
                 1.00 
                 36.98 
                 N 
               
               
                 ATOM 
                 1591 
                 CA 
                 GLY 
                 B 
                 105 
                 62.085 
                 27.286 
                 13.830 
                 1.00 
                 36.46 
                 C 
               
               
                 ATOM 
                 1592 
                 C 
                 GLY 
                 B 
                 105 
                 63.021 
                 27.273 
                 12.645 
                 1.00 
                 36.61 
                 C 
               
               
                 ATOM 
                 1593 
                 O 
                 GLY 
                 B 
                 105 
                 64.185 
                 26.891 
                 12.750 
                 1.00 
                 36.81 
                 O 
               
               
                 ATOM 
                 1594 
                 N 
                 THR 
                 B 
                 106 
                 62.488 
                 27.689 
                 11.507 
                 1.00 
                 36.30 
                 N 
               
               
                 ATOM 
                 1595 
                 CA 
                 THR 
                 B 
                 106 
                 63.245 
                 27.842 
                 10.289 
                 1.00 
                 35.99 
                 C 
               
               
                 ATOM 
                 1596 
                 CB 
                 THR 
                 B 
                 106 
                 62.713 
                 26.880 
                 9.195 
                 1.00 
                 36.37 
                 C 
               
               
                 ATOM 
                 1597 
                 OG1 
                 THR 
                 B 
                 106 
                 62.974 
                 25.531 
                 9.571 
                 1.00 
                 35.72 
                 O 
               
               
                 ATOM 
                 1598 
                 CG2 
                 THR 
                 B 
                 106 
                 63.395 
                 27.128 
                 7.874 
                 1.00 
                 37.55 
                 C 
               
               
                 ATOM 
                 1599 
                 C 
                 THR 
                 B 
                 106 
                 62.994 
                 29.269 
                 9.859 
                 1.00 
                 35.39 
                 C 
               
               
                 ATOM 
                 1600 
                 O 
                 THR 
                 B 
                 106 
                 61.844 
                 29.677 
                 9.772 
                 1.00 
                 35.20 
                 O 
               
               
                 ATOM 
                 1601 
                 N 
                 VAL 
                 B 
                 107 
                 64.051 
                 30.042 
                 9.624 
                 1.00 
                 34.99 
                 N 
               
               
                 ATOM 
                 1602 
                 CA 
                 VAL 
                 B 
                 107 
                 63.879 
                 31.398 
                 9.085 
                 1.00 
                 34.84 
                 C 
               
               
                 ATOM 
                 1603 
                 CB 
                 VAL 
                 B 
                 107 
                 64.838 
                 32.416 
                 9.701 
                 1.00 
                 34.41 
                 C 
               
               
                 ATOM 
                 1604 
                 CG1 
                 VAL 
                 B 
                 107 
                 64.662 
                 33.759 
                 9.026 
                 1.00 
                 33.11 
                 C 
               
               
                 ATOM 
                 1605 
                 CG2 
                 VAL 
                 B 
                 107 
                 64.589 
                 32.524 
                 11.189 
                 1.00 
                 33.77 
                 C 
               
               
                 ATOM 
                 1606 
                 C 
                 VAL 
                 B 
                 107 
                 64.046 
                 31.362 
                 7.568 
                 1.00 
                 35.66 
                 C 
               
               
                 ATOM 
                 1607 
                 O 
                 VAL 
                 B 
                 107 
                 65.165 
                 31.227 
                 7.029 
                 1.00 
                 35.61 
                 O 
               
               
                 ATOM 
                 1608 
                 N 
                 LEU 
                 B 
                 108 
                 62.914 
                 31.458 
                 6.879 
                 1.00 
                 36.39 
                 N 
               
               
                 ATOM 
                 1609 
                 CA 
                 LEU 
                 B 
                 108 
                 62.894 
                 31.320 
                 5.427 
                 1.00 
                 37.02 
                 C 
               
               
                 ATOM 
                 1610 
                 CB 
                 LEU 
                 B 
                 108 
                 61.650 
                 30.552 
                 4.959 
                 1.00 
                 36.96 
                 C 
               
               
                 ATOM 
                 1611 
                 CG 
                 LEU 
                 B 
                 108 
                 61.371 
                 30.622 
                 3.453 
                 1.00 
                 37.20 
                 C 
               
               
                 ATOM 
                 1612 
                 CD1 
                 LEU 
                 B 
                 108 
                 62.500 
                 29.997 
                 2.636 
                 1.00 
                 36.00 
                 C 
               
               
                 ATOM 
                 1613 
                 CD2 
                 LEU 
                 B 
                 108 
                 60.030 
                 29.999 
                 3.113 
                 1.00 
                 36.84 
                 C 
               
               
                 ATOM 
                 1614 
                 C 
                 LEU 
                 B 
                 108 
                 62.908 
                 32.685 
                 4.794 
                 1.00 
                 37.27 
                 C 
               
               
                 ATOM 
                 1615 
                 O 
                 LEU 
                 B 
                 108 
                 62.029 
                 33.513 
                 5.069 
                 1.00 
                 37.99 
                 O 
               
               
                 ATOM 
                 1616 
                 N 
                 THR 
                 B 
                 109 
                 63.897 
                 32.932 
                 3.951 
                 1.00 
                 37.20 
                 N 
               
               
                 ATOM 
                 1617 
                 CA 
                 THR 
                 B 
                 109 
                 63.800 
                 34.092 
                 3.081 
                 1.00 
                 37.29 
                 C 
               
               
                 ATOM 
                 1618 
                 CB 
                 THR 
                 B 
                 109 
                 64.859 
                 35.169 
                 3.392 
                 1.00 
                 37.40 
                 C 
               
               
                 ATOM 
                 1619 
                 OG1 
                 THR 
                 B 
                 109 
                 65.039 
                 35.985 
                 2.230 
                 1.00 
                 38.63 
                 O 
               
               
                 ATOM 
                 1620 
                 CG2 
                 THR 
                 B 
                 109 
                 66.182 
                 34.552 
                 3.782 
                 1.00 
                 37.84 
                 C 
               
               
                 ATOM 
                 1621 
                 C 
                 THR 
                 B 
                 109 
                 63.716 
                 33.702 
                 1.584 
                 1.00 
                 36.85 
                 C 
               
               
                 ATOM 
                 1622 
                 O 
                 THR 
                 B 
                 109 
                 64.405 
                 32.776 
                 1.110 
                 1.00 
                 36.94 
                 O 
               
               
                 ATOM 
                 1623 
                 N 
                 VAL 
                 B 
                 110 
                 62.823 
                 34.388 
                 0.867 
                 1.00 
                 36.01 
                 N 
               
               
                 ATOM 
                 1624 
                 CA 
                 VAL 
                 B 
                 110 
                 62.546 
                 34.084 
                 −0.551 
                 1.00 
                 35.02 
                 C 
               
               
                 ATOM 
                 1625 
                 CB 
                 VAL 
                 B 
                 110 
                 61.059 
                 33.691 
                 −0.773 
                 1.00 
                 34.55 
                 C 
               
               
                 ATOM 
                 1626 
                 CG1 
                 VAL 
                 B 
                 110 
                 60.822 
                 33.302 
                 −2.206 
                 1.00 
                 33.34 
                 C 
               
               
                 ATOM 
                 1627 
                 CG2 
                 VAL 
                 B 
                 110 
                 60.697 
                 32.549 
                 0.109 
                 1.00 
                 34.63 
                 C 
               
               
                 ATOM 
                 1628 
                 C 
                 VAL 
                 B 
                 110 
                 62.946 
                 35.212 
                 −1.532 
                 1.00 
                 34.56 
                 C 
               
               
                 ATOM 
                 1629 
                 O 
                 VAL 
                 B 
                 110 
                 62.394 
                 36.325 
                 −1.477 
                 1.00 
                 34.65 
                 O 
               
               
                 ATOM 
                 1630 
                 N 
                 LYS 
                 B 
                 111 
                 63.918 
                 34.887 
                 −2.390 
                 1.00 
                 33.54 
                 N 
               
               
                 ATOM 
                 1631 
                 CA 
                 LYS 
                 B 
                 111 
                 64.353 
                 35.612 
                 −3.609 
                 1.00 
                 32.70 
                 C 
               
               
                 ATOM 
                 1632 
                 CB 
                 LYS 
                 B 
                 111 
                 63.710 
                 36.984 
                 −3.859 
                 1.00 
                 32.41 
                 C 
               
               
                 ATOM 
                 1633 
                 CG 
                 LYS 
                 B 
                 111 
                 62.878 
                 37.004 
                 −5.146 
                 1.00 
                 31.57 
                 C 
               
               
                 ATOM 
                 1634 
                 CD 
                 LYS 
                 B 
                 111 
                 62.464 
                 38.390 
                 −5.630 
                 1.00 
                 31.59 
                 C 
               
               
                 ATOM 
                 1635 
                 CE 
                 LYS 
                 B 
                 111 
                 63.615 
                 39.127 
                 −6.288 
                 1.00 
                 29.56 
                 C 
               
               
                 ATOM 
                 1636 
                 NZ 
                 LYS 
                 B 
                 111 
                 64.096 
                 38.345 
                 −7.446 
                 1.00 
                 28.53 
                 N 
               
               
                 ATOM 
                 1637 
                 C 
                 LYS 
                 B 
                 111 
                 65.872 
                 35.660 
                 −3.696 
                 1.00 
                 33.30 
                 C 
               
               
                 ATOM 
                 1638 
                 O 
                 LYS 
                 B 
                 111 
                 66.523 
                 36.251 
                 −2.841 
                 1.00 
                 33.69 
                 O 
               
               
                 ATOM 
                 1639 
                 N 
                 ALA 
                 C 
                 1 
                 27.731 
                 10.932 
                 10.845 
                 1.00 
                 36.73 
                 N 
               
               
                 ATOM 
                 1640 
                 CA 
                 ALA 
                 C 
                 1 
                 26.819 
                 11.600 
                 11.783 
                 1.00 
                 37.06 
                 C 
               
               
                 ATOM 
                 1641 
                 CB 
                 ALA 
                 C 
                 1 
                 26.956 
                 10.995 
                 13.140 
                 1.00 
                 36.58 
                 C 
               
               
                 ATOM 
                 1642 
                 C 
                 ALA 
                 C 
                 1 
                 27.172 
                 13.073 
                 11.784 
                 1.00 
                 37.88 
                 C 
               
               
                 ATOM 
                 1643 
                 O 
                 ALA 
                 C 
                 1 
                 28.275 
                 13.436 
                 11.393 
                 1.00 
                 38.55 
                 O 
               
               
                 ATOM 
                 1644 
                 N 
                 TRP 
                 C 
                 2 
                 26.234 
                 13.929 
                 12.184 
                 1.00 
                 38.85 
                 N 
               
               
                 ATOM 
                 1645 
                 CA 
                 TRP 
                 C 
                 2 
                 26.434 
                 15.391 
                 12.169 
                 1.00 
                 39.92 
                 C 
               
               
                 ATOM 
                 1646 
                 CB 
                 TRP 
                 C 
                 2 
                 26.369 
                 15.963 
                 10.730 
                 1.00 
                 39.79 
                 C 
               
               
                 ATOM 
                 1647 
                 CG 
                 TRP 
                 C 
                 2 
                 25.004 
                 15.897 
                 10.161 
                 1.00 
                 39.52 
                 C 
               
               
                 ATOM 
                 1648 
                 CD1 
                 TRP 
                 C 
                 2 
                 24.394 
                 14.800 
                 9.651 
                 1.00 
                 39.33 
                 C 
               
               
                 ATOM 
                 1649 
                 NE1 
                 TRP 
                 C 
                 2 
                 23.119 
                 15.102 
                 9.263 
                 1.00 
                 39.75 
                 N 
               
               
                 ATOM 
                 1650 
                 CE2 
                 TRP 
                 C 
                 2 
                 22.882 
                 16.424 
                 9.523 
                 1.00 
                 40.28 
                 C 
               
               
                 ATOM 
                 1651 
                 CD2 
                 TRP 
                 C 
                 2 
                 24.048 
                 16.955 
                 10.092 
                 1.00 
                 39.55 
                 C 
               
               
                 ATOM 
                 1652 
                 CE3 
                 TRP 
                 C 
                 2 
                 24.067 
                 18.304 
                 10.444 
                 1.00 
                 39.87 
                 C 
               
               
                 ATOM 
                 1653 
                 CZ3 
                 TRP 
                 C 
                 2 
                 22.936 
                 19.067 
                 10.220 
                 1.00 
                 38.76 
                 C 
               
               
                 ATOM 
                 1654 
                 CH2 
                 TRP 
                 C 
                 2 
                 21.800 
                 18.517 
                 9.656 
                 1.00 
                 39.45 
                 C 
               
               
                 ATOM 
                 1655 
                 CZ2 
                 TRP 
                 C 
                 2 
                 21.745 
                 17.196 
                 9.298 
                 1.00 
                 40.40 
                 C 
               
               
                 ATOM 
                 1656 
                 C 
                 TRP 
                 C 
                 2 
                 25.350 
                 16.008 
                 13.051 
                 1.00 
                 40.73 
                 C 
               
               
                 ATOM 
                 1657 
                 O 
                 TRP 
                 C 
                 2 
                 24.265 
                 15.425 
                 13.181 
                 1.00 
                 41.56 
                 O 
               
               
                 ATOM 
                 1658 
                 N 
                 VAL 
                 C 
                 3 
                 25.635 
                 17.161 
                 13.664 
                 1.00 
                 41.60 
                 N 
               
               
                 ATOM 
                 1659 
                 CA 
                 VAL 
                 C 
                 3 
                 24.695 
                 17.809 
                 14.601 
                 1.00 
                 42.64 
                 C 
               
               
                 ATOM 
                 1660 
                 CB 
                 VAL 
                 C 
                 3 
                 25.381 
                 18.237 
                 15.920 
                 1.00 
                 42.63 
                 C 
               
               
                 ATOM 
                 1661 
                 CG1 
                 VAL 
                 C 
                 3 
                 24.368 
                 18.848 
                 16.874 
                 1.00 
                 43.03 
                 C 
               
               
                 ATOM 
                 1662 
                 CG2 
                 VAL 
                 C 
                 3 
                 26.027 
                 17.038 
                 16.593 
                 1.00 
                 42.94 
                 C 
               
               
                 ATOM 
                 1663 
                 C 
                 VAL 
                 C 
                 3 
                 23.982 
                 19.013 
                 13.975 
                 1.00 
                 43.23 
                 C 
               
               
                 ATOM 
                 1664 
                 O 
                 VAL 
                 C 
                 3 
                 24.639 
                 19.915 
                 13.460 
                 1.00 
                 44.10 
                 O 
               
               
                 ATOM 
                 1665 
                 N 
                 ASP 
                 C 
                 4 
                 22.646 
                 19.001 
                 14.000 
                 1.00 
                 43.73 
                 N 
               
               
                 ATOM 
                 1666 
                 CA 
                 ASP 
                 C 
                 4 
                 21.816 
                 20.094 
                 13.498 
                 1.00 
                 43.97 
                 C 
               
               
                 ATOM 
                 1667 
                 CB 
                 ASP 
                 C 
                 4 
                 20.470 
                 19.545 
                 13.016 
                 1.00 
                 43.97 
                 C 
               
               
                 ATOM 
                 1668 
                 CG 
                 ASP 
                 C 
                 4 
                 19.696 
                 20.533 
                 12.151 
                 1.00 
                 45.56 
                 C 
               
               
                 ATOM 
                 1669 
                 OD1 
                 ASP 
                 C 
                 4 
                 18.573 
                 20.188 
                 11.732 
                 1.00 
                 46.90 
                 O 
               
               
                 ATOM 
                 1670 
                 OD2 
                 ASP 
                 C 
                 4 
                 20.190 
                 21.651 
                 11.867 
                 1.00 
                 48.30 
                 O 
               
               
                 ATOM 
                 1671 
                 C 
                 ASP 
                 C 
                 4 
                 21.575 
                 21.057 
                 14.651 
                 1.00 
                 44.27 
                 C 
               
               
                 ATOM 
                 1672 
                 O 
                 ASP 
                 C 
                 4 
                 20.836 
                 20.719 
                 15.580 
                 1.00 
                 44.63 
                 O 
               
               
                 ATOM 
                 1673 
                 N 
                 GLN 
                 C 
                 5 
                 22.187 
                 22.245 
                 14.611 
                 1.00 
                 44.42 
                 N 
               
               
                 ATOM 
                 1674 
                 CA 
                 GLN 
                 C 
                 5 
                 21.982 
                 23.243 
                 15.675 
                 1.00 
                 44.16 
                 C 
               
               
                 ATOM 
                 1675 
                 CB 
                 GLN 
                 C 
                 5 
                 23.317 
                 23.653 
                 16.240 
                 1.00 
                 44.58 
                 C 
               
               
                 ATOM 
                 1676 
                 CG 
                 GLN 
                 C 
                 5 
                 23.245 
                 24.644 
                 17.374 
                 1.00 
                 44.79 
                 C 
               
               
                 ATOM 
                 1677 
                 CD 
                 GLN 
                 C 
                 5 
                 24.625 
                 25.031 
                 17.833 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 1678 
                 OE1 
                 GLN 
                 C 
                 5 
                 25.593 
                 24.300 
                 17.586 
                 1.00 
                 42.96 
                 O 
               
               
                 ATOM 
                 1679 
                 NE2 
                 GLN 
                 C 
                 5 
                 24.733 
                 26.188 
                 18.496 
                 1.00 
                 45.43 
                 N 
               
               
                 ATOM 
                 1680 
                 C 
                 GLN 
                 C 
                 5 
                 21.209 
                 24.490 
                 15.245 
                 1.00 
                 43.80 
                 C 
               
               
                 ATOM 
                 1681 
                 O 
                 GLN 
                 C 
                 5 
                 21.529 
                 25.095 
                 14.240 
                 1.00 
                 43.89 
                 O 
               
               
                 ATOM 
                 1682 
                 N 
                 THR 
                 C 
                 6 
                 20.190 
                 24.850 
                 16.020 
                 1.00 
                 43.48 
                 N 
               
               
                 ATOM 
                 1683 
                 CA 
                 THR 
                 C 
                 6 
                 19.359 
                 26.039 
                 15.793 
                 1.00 
                 43.34 
                 C 
               
               
                 ATOM 
                 1684 
                 CB 
                 THR 
                 C 
                 6 
                 17.908 
                 25.659 
                 15.350 
                 1.00 
                 43.54 
                 C 
               
               
                 ATOM 
                 1685 
                 OG1 
                 THR 
                 C 
                 6 
                 17.288 
                 24.832 
                 16.341 
                 1.00 
                 42.46 
                 O 
               
               
                 ATOM 
                 1686 
                 CG2 
                 THR 
                 C 
                 6 
                 17.890 
                 24.904 
                 14.013 
                 1.00 
                 43.93 
                 C 
               
               
                 ATOM 
                 1687 
                 C 
                 THR 
                 C 
                 6 
                 19.277 
                 26.803 
                 17.122 
                 1.00 
                 43.40 
                 C 
               
               
                 ATOM 
                 1688 
                 O 
                 THR 
                 C 
                 6 
                 19.339 
                 26.165 
                 18.188 
                 1.00 
                 43.20 
                 O 
               
               
                 ATOM 
                 1689 
                 N 
                 PRO 
                 C 
                 7 
                 19.166 
                 28.159 
                 17.086 
                 1.00 
                 43.22 
                 N 
               
               
                 ATOM 
                 1690 
                 CA 
                 PRO 
                 C 
                 7 
                 19.201 
                 29.027 
                 15.922 
                 1.00 
                 43.33 
                 C 
               
               
                 ATOM 
                 1691 
                 CB 
                 PRO 
                 C 
                 7 
                 18.603 
                 30.348 
                 16.434 
                 1.00 
                 43.14 
                 C 
               
               
                 ATOM 
                 1692 
                 CG 
                 PRO 
                 C 
                 7 
                 18.411 
                 30.213 
                 17.881 
                 1.00 
                 42.62 
                 C 
               
               
                 ATOM 
                 1693 
                 CD 
                 PRO 
                 C 
                 7 
                 19.035 
                 28.945 
                 18.329 
                 1.00 
                 43.17 
                 C 
               
               
                 ATOM 
                 1694 
                 C 
                 PRO 
                 C 
                 7 
                 20.644 
                 29.269 
                 15.507 
                 1.00 
                 43.73 
                 C 
               
               
                 ATOM 
                 1695 
                 O 
                 PRO 
                 C 
                 7 
                 21.538 
                 29.273 
                 16.358 
                 1.00 
                 44.00 
                 O 
               
               
                 ATOM 
                 1696 
                 N 
                 ARG 
                 C 
                 8 
                 20.875 
                 29.441 
                 14.213 
                 1.00 
                 43.91 
                 N 
               
               
                 ATOM 
                 1697 
                 CA 
                 ARG 
                 C 
                 8 
                 22.203 
                 29.804 
                 13.741 
                 1.00 
                 44.42 
                 C 
               
               
                 ATOM 
                 1698 
                 CB 
                 ARG 
                 C 
                 8 
                 22.288 
                 29.736 
                 12.203 
                 1.00 
                 44.66 
                 C 
               
               
                 ATOM 
                 1699 
                 CG 
                 ARG 
                 C 
                 8 
                 21.908 
                 28.355 
                 11.559 
                 1.00 
                 47.05 
                 C 
               
               
                 ATOM 
                 1700 
                 CD 
                 ARG 
                 C 
                 8 
                 23.002 
                 27.235 
                 11.669 
                 1.00 
                 48.64 
                 C 
               
               
                 ATOM 
                 1701 
                 NE 
                 ARG 
                 C 
                 8 
                 24.326 
                 27.765 
                 12.042 
                 1.00 
                 50.62 
                 N 
               
               
                 ATOM 
                 1702 
                 CZ 
                 ARG 
                 C 
                 8 
                 25.368 
                 27.927 
                 11.221 
                 1.00 
                 49.49 
                 C 
               
               
                 ATOM 
                 1703 
                 NH1 
                 ARG 
                 C 
                 8 
                 26.492 
                 28.442 
                 11.696 
                 1.00 
                 47.43 
                 N 
               
               
                 ATOM 
                 1704 
                 NH2 
                 ARG 
                 C 
                 8 
                 25.306 
                 27.560 
                 9.943 
                 1.00 
                 49.11 
                 N 
               
               
                 ATOM 
                 1705 
                 C 
                 ARG 
                 C 
                 8 
                 22.622 
                 31.191 
                 14.313 
                 1.00 
                 43.96 
                 C 
               
               
                 ATOM 
                 1706 
                 O 
                 ARG 
                 C 
                 8 
                 23.704 
                 31.331 
                 14.886 
                 1.00 
                 44.32 
                 O 
               
               
                 ATOM 
                 1707 
                 N 
                 SER 
                 C 
                 9 
                 21.774 
                 32.205 
                 14.189 
                 1.00 
                 43.09 
                 N 
               
               
                 ATOM 
                 1708 
                 CA 
                 SER 
                 C 
                 9 
                 22.056 
                 33.463 
                 14.876 
                 1.00 
                 42.40 
                 C 
               
               
                 ATOM 
                 1709 
                 CB 
                 SER 
                 C 
                 9 
                 22.735 
                 34.495 
                 13.951 
                 1.00 
                 42.53 
                 C 
               
               
                 ATOM 
                 1710 
                 OG 
                 SER 
                 C 
                 9 
                 21.816 
                 35.166 
                 13.109 
                 1.00 
                 42.75 
                 O 
               
               
                 ATOM 
                 1711 
                 C 
                 SER 
                 C 
                 9 
                 20.802 
                 34.007 
                 15.545 
                 1.00 
                 41.72 
                 C 
               
               
                 ATOM 
                 1712 
                 O 
                 SER 
                 C 
                 9 
                 19.681 
                 33.687 
                 15.126 
                 1.00 
                 41.94 
                 O 
               
               
                 ATOM 
                 1713 
                 N 
                 VAL 
                 C 
                 10 
                 20.995 
                 34.806 
                 16.593 
                 1.00 
                 40.57 
                 N 
               
               
                 ATOM 
                 1714 
                 CA 
                 VAL 
                 C 
                 10 
                 19.877 
                 35.325 
                 17.371 
                 1.00 
                 39.60 
                 C 
               
               
                 ATOM 
                 1715 
                 CB 
                 VAL 
                 C 
                 10 
                 19.254 
                 34.205 
                 18.270 
                 1.00 
                 39.41 
                 C 
               
               
                 ATOM 
                 1716 
                 CG1 
                 VAL 
                 C 
                 10 
                 20.299 
                 33.568 
                 19.163 
                 1.00 
                 39.02 
                 C 
               
               
                 ATOM 
                 1717 
                 CG2 
                 VAL 
                 C 
                 10 
                 18.079 
                 34.712 
                 19.075 
                 1.00 
                 38.83 
                 C 
               
               
                 ATOM 
                 1718 
                 C 
                 VAL 
                 C 
                 10 
                 20.258 
                 36.565 
                 18.174 
                 1.00 
                 39.27 
                 C 
               
               
                 ATOM 
                 1719 
                 O 
                 VAL 
                 C 
                 10 
                 21.374 
                 36.694 
                 18.670 
                 1.00 
                 39.55 
                 O 
               
               
                 ATOM 
                 1720 
                 N 
                 THR 
                 C 
                 11 
                 19.317 
                 37.488 
                 18.275 
                 1.00 
                 38.96 
                 N 
               
               
                 ATOM 
                 1721 
                 CA 
                 THR 
                 C 
                 11 
                 19.461 
                 38.661 
                 19.129 
                 1.00 
                 38.39 
                 C 
               
               
                 ATOM 
                 1722 
                 CB 
                 THR 
                 C 
                 11 
                 19.299 
                 39.939 
                 18.320 
                 1.00 
                 38.22 
                 C 
               
               
                 ATOM 
                 1723 
                 OG1 
                 THR 
                 C 
                 11 
                 20.199 
                 39.883 
                 17.211 
                 1.00 
                 38.20 
                 O 
               
               
                 ATOM 
                 1724 
                 CG2 
                 THR 
                 C 
                 11 
                 19.625 
                 41.165 
                 19.161 
                 1.00 
                 38.24 
                 C 
               
               
                 ATOM 
                 1725 
                 C 
                 THR 
                 C 
                 11 
                 18.445 
                 38.597 
                 20.269 
                 1.00 
                 38.23 
                 C 
               
               
                 ATOM 
                 1726 
                 O 
                 THR 
                 C 
                 11 
                 17.265 
                 38.289 
                 20.052 
                 1.00 
                 38.08 
                 O 
               
               
                 ATOM 
                 1727 
                 N 
                 LYS 
                 C 
                 12 
                 18.924 
                 38.844 
                 21.485 
                 1.00 
                 38.02 
                 N 
               
               
                 ATOM 
                 1728 
                 CA 
                 LYS 
                 C 
                 12 
                 18.089 
                 38.828 
                 22.677 
                 1.00 
                 38.13 
                 C 
               
               
                 ATOM 
                 1729 
                 CB 
                 LYS 
                 C 
                 12 
                 18.255 
                 37.518 
                 23.457 
                 1.00 
                 38.13 
                 C 
               
               
                 ATOM 
                 1730 
                 CG 
                 LYS 
                 C 
                 12 
                 17.558 
                 36.338 
                 22.799 
                 1.00 
                 38.06 
                 C 
               
               
                 ATOM 
                 1731 
                 CD 
                 LYS 
                 C 
                 12 
                 16.847 
                 35.434 
                 23.786 
                 1.00 
                 37.36 
                 C 
               
               
                 ATOM 
                 1732 
                 CE 
                 LYS 
                 C 
                 12 
                 15.673 
                 34.699 
                 23.122 
                 1.00 
                 36.90 
                 C 
               
               
                 ATOM 
                 1733 
                 NZ 
                 LYS 
                 C 
                 12 
                 14.422 
                 35.519 
                 23.128 
                 1.00 
                 37.18 
                 N 
               
               
                 ATOM 
                 1734 
                 C 
                 LYS 
                 C 
                 12 
                 18.465 
                 39.995 
                 23.549 
                 1.00 
                 38.34 
                 C 
               
               
                 ATOM 
                 1735 
                 O 
                 LYS 
                 C 
                 12 
                 19.636 
                 40.304 
                 23.688 
                 1.00 
                 38.48 
                 O 
               
               
                 ATOM 
                 1736 
                 N 
                 GLU 
                 C 
                 13 
                 17.473 
                 40.650 
                 24.134 
                 1.00 
                 38.77 
                 N 
               
               
                 ATOM 
                 1737 
                 CA 
                 GLU 
                 C 
                 13 
                 17.743 
                 41.773 
                 25.018 
                 1.00 
                 39.16 
                 C 
               
               
                 ATOM 
                 1738 
                 CB 
                 GLU 
                 C 
                 13 
                 16.521 
                 42.674 
                 25.120 
                 1.00 
                 39.34 
                 C 
               
               
                 ATOM 
                 1739 
                 CG 
                 GLU 
                 C 
                 13 
                 16.396 
                 43.631 
                 23.945 
                 1.00 
                 40.22 
                 C 
               
               
                 ATOM 
                 1740 
                 CD 
                 GLU 
                 C 
                 13 
                 14.957 
                 43.847 
                 23.517 
                 1.00 
                 41.71 
                 C 
               
               
                 ATOM 
                 1741 
                 OE1 
                 GLU 
                 C 
                 13 
                 14.657 
                 44.910 
                 22.915 
                 1.00 
                 41.36 
                 O 
               
               
                 ATOM 
                 1742 
                 OE2 
                 GLU 
                 C 
                 13 
                 14.126 
                 42.948 
                 23.784 
                 1.00 
                 42.65 
                 O 
               
               
                 ATOM 
                 1743 
                 C 
                 GLU 
                 C 
                 13 
                 18.207 
                 41.306 
                 26.391 
                 1.00 
                 39.19 
                 C 
               
               
                 ATOM 
                 1744 
                 O 
                 GLU 
                 C 
                 13 
                 17.979 
                 40.158 
                 26.771 
                 1.00 
                 39.29 
                 O 
               
               
                 ATOM 
                 1745 
                 N 
                 THR 
                 C 
                 14 
                 18.884 
                 42.194 
                 27.111 
                 1.00 
                 39.39 
                 N 
               
               
                 ATOM 
                 1746 
                 CA 
                 THR 
                 C 
                 14 
                 19.417 
                 41.901 
                 28.436 
                 1.00 
                 39.66 
                 C 
               
               
                 ATOM 
                 1747 
                 CB 
                 THR 
                 C 
                 14 
                 20.096 
                 43.159 
                 29.020 
                 1.00 
                 39.57 
                 C 
               
               
                 ATOM 
                 1748 
                 OG1 
                 THR 
                 C 
                 14 
                 21.151 
                 43.562 
                 28.138 
                 1.00 
                 39.75 
                 O 
               
               
                 ATOM 
                 1749 
                 CG2 
                 THR 
                 C 
                 14 
                 20.671 
                 42.907 
                 30.415 
                 1.00 
                 39.37 
                 C 
               
               
                 ATOM 
                 1750 
                 C 
                 THR 
                 C 
                 14 
                 18.313 
                 41.392 
                 29.358 
                 1.00 
                 40.11 
                 C 
               
               
                 ATOM 
                 1751 
                 O 
                 THR 
                 C 
                 14 
                 17.199 
                 41.920 
                 29.347 
                 1.00 
                 40.08 
                 O 
               
               
                 ATOM 
                 1752 
                 N 
                 GLY 
                 C 
                 15 
                 18.614 
                 40.346 
                 30.124 
                 1.00 
                 40.51 
                 N 
               
               
                 ATOM 
                 1753 
                 CA 
                 GLY 
                 C 
                 15 
                 17.666 
                 39.811 
                 31.098 
                 1.00 
                 41.18 
                 C 
               
               
                 ATOM 
                 1754 
                 C 
                 GLY 
                 C 
                 15 
                 16.780 
                 38.700 
                 30.563 
                 1.00 
                 41.82 
                 C 
               
               
                 ATOM 
                 1755 
                 O 
                 GLY 
                 C 
                 15 
                 16.190 
                 37.945 
                 31.337 
                 1.00 
                 42.17 
                 O 
               
               
                 ATOM 
                 1756 
                 N 
                 GLU 
                 C 
                 16 
                 16.679 
                 38.593 
                 29.241 
                 1.00 
                 42.08 
                 N 
               
               
                 ATOM 
                 1757 
                 CA 
                 GLU 
                 C 
                 16 
                 15.961 
                 37.491 
                 28.613 
                 1.00 
                 42.31 
                 C 
               
               
                 ATOM 
                 1758 
                 CB 
                 GLU 
                 C 
                 16 
                 15.680 
                 37.811 
                 27.148 
                 1.00 
                 42.35 
                 C 
               
               
                 ATOM 
                 1759 
                 CG 
                 GLU 
                 C 
                 16 
                 14.839 
                 39.050 
                 26.948 
                 1.00 
                 42.99 
                 C 
               
               
                 ATOM 
                 1760 
                 CD 
                 GLU 
                 C 
                 16 
                 14.079 
                 39.046 
                 25.640 
                 1.00 
                 44.31 
                 C 
               
               
                 ATOM 
                 1761 
                 OE1 
                 GLU 
                 C 
                 16 
                 13.949 
                 40.129 
                 25.026 
                 1.00 
                 44.89 
                 O 
               
               
                 ATOM 
                 1762 
                 OE2 
                 GLU 
                 C 
                 16 
                 13.600 
                 37.966 
                 25.232 
                 1.00 
                 44.98 
                 O 
               
               
                 ATOM 
                 1763 
                 C 
                 GLU 
                 C 
                 16 
                 16.795 
                 36.222 
                 28.738 
                 1.00 
                 42.46 
                 C 
               
               
                 ATOM 
                 1764 
                 O 
                 GLU 
                 C 
                 16 
                 17.864 
                 36.247 
                 29.343 
                 1.00 
                 42.47 
                 O 
               
               
                 ATOM 
                 1765 
                 N 
                 SER 
                 C 
                 17 
                 16.311 
                 35.115 
                 28.180 
                 1.00 
                 42.67 
                 N 
               
               
                 ATOM 
                 1766 
                 CA 
                 SER 
                 C 
                 17 
                 17.070 
                 33.867 
                 28.200 
                 1.00 
                 43.22 
                 C 
               
               
                 ATOM 
                 1767 
                 CB 
                 SER 
                 C 
                 17 
                 16.598 
                 32.956 
                 29.336 
                 1.00 
                 43.10 
                 C 
               
               
                 ATOM 
                 1768 
                 OG 
                 SER 
                 C 
                 17 
                 15.213 
                 32.696 
                 29.259 
                 1.00 
                 43.49 
                 C 
               
               
                 ATOM 
                 1769 
                 C 
                 SER 
                 C 
                 17 
                 17.028 
                 33.133 
                 26.867 
                 1.00 
                 43.49 
                 C 
               
               
                 ATOM 
                 1770 
                 O 
                 SER 
                 C 
                 17 
                 16.053 
                 33.244 
                 26.138 
                 1.00 
                 43.98 
                 O 
               
               
                 ATOM 
                 1771 
                 N 
                 LEU 
                 C 
                 18 
                 18.088 
                 32.386 
                 26.559 
                 1.00 
                 43.91 
                 N 
               
               
                 ATOM 
                 1772 
                 CA 
                 LEU 
                 C 
                 18 
                 18.195 
                 31.625 
                 25.300 
                 1.00 
                 44.39 
                 C 
               
               
                 ATOM 
                 1773 
                 CB 
                 LEU 
                 C 
                 18 
                 19.588 
                 31.817 
                 24.686 
                 1.00 
                 43.94 
                 C 
               
               
                 ATOM 
                 1774 
                 CG 
                 LEU 
                 C 
                 18 
                 19.822 
                 32.059 
                 23.187 
                 1.00 
                 43.64 
                 C 
               
               
                 ATOM 
                 1775 
                 CD1 
                 LEU 
                 C 
                 18 
                 21.247 
                 31.649 
                 22.849 
                 1.00 
                 44.22 
                 C 
               
               
                 ATOM 
                 1776 
                 CD2 
                 LEU 
                 C 
                 18 
                 18.821 
                 31.411 
                 22.214 
                 1.00 
                 42.64 
                 C 
               
               
                 ATOM 
                 1777 
                 C 
                 LEU 
                 C 
                 18 
                 17.988 
                 30.115 
                 25.485 
                 1.00 
                 44.89 
                 C 
               
               
                 ATOM 
                 1778 
                 O 
                 LEU 
                 C 
                 18 
                 18.428 
                 29.525 
                 26.491 
                 1.00 
                 45.55 
                 O 
               
               
                 ATOM 
                 1779 
                 N 
                 THR 
                 C 
                 19 
                 17.345 
                 29.491 
                 24.507 
                 1.00 
                 44.93 
                 N 
               
               
                 ATOM 
                 1780 
                 CA 
                 THR 
                 C 
                 19 
                 17.395 
                 28.044 
                 24.375 
                 1.00 
                 45.04 
                 C 
               
               
                 ATOM 
                 1781 
                 CB 
                 THR 
                 C 
                 19 
                 15.991 
                 27.418 
                 24.390 
                 1.00 
                 44.97 
                 C 
               
               
                 ATOM 
                 1782 
                 OG1 
                 THR 
                 C 
                 19 
                 15.299 
                 27.824 
                 25.571 
                 1.00 
                 45.74 
                 O 
               
               
                 ATOM 
                 1783 
                 CG2 
                 THR 
                 C 
                 19 
                 16.080 
                 25.921 
                 24.401 
                 1.00 
                 45.54 
                 C 
               
               
                 ATOM 
                 1784 
                 C 
                 THR 
                 C 
                 19 
                 18.080 
                 27.704 
                 23.066 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 1785 
                 O 
                 THR 
                 C 
                 19 
                 17.667 
                 28.159 
                 22.012 
                 1.00 
                 45.60 
                 O 
               
               
                 ATOM 
                 1786 
                 N 
                 ILE 
                 C 
                 20 
                 19.137 
                 26.919 
                 23.135 
                 1.00 
                 45.26 
                 N 
               
               
                 ATOM 
                 1787 
                 CA 
                 ILE 
                 C 
                 20 
                 19.728 
                 26.320 
                 21.949 
                 1.00 
                 45.56 
                 C 
               
               
                 ATOM 
                 1788 
                 CB 
                 ILE 
                 C 
                 20 
                 21.280 
                 26.416 
                 21.988 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 1789 
                 CG1 
                 ILE 
                 C 
                 20 
                 21.706 
                 27.836 
                 22.365 
                 1.00 
                 45.10 
                 C 
               
               
                 ATOM 
                 1790 
                 CD1 
                 ILE 
                 C 
                 20 
                 23.194 
                 28.035 
                 22.546 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 1791 
                 CG2 
                 ILE 
                 C 
                 20 
                 21.888 
                 26.037 
                 20.644 
                 1.00 
                 45.52 
                 C 
               
               
                 ATOM 
                 1792 
                 C 
                 ILE 
                 C 
                 20 
                 19.255 
                 24.851 
                 21.904 
                 1.00 
                 46.07 
                 C 
               
               
                 ATOM 
                 1793 
                 O 
                 ILE 
                 C 
                 20 
                 19.294 
                 24.158 
                 22.916 
                 1.00 
                 46.16 
                 O 
               
               
                 ATOM 
                 1794 
                 N 
                 ASN 
                 C 
                 21 
                 18.781 
                 24.393 
                 20.747 
                 1.00 
                 46.49 
                 N 
               
               
                 ATOM 
                 1795 
                 CA 
                 ASN 
                 C 
                 21 
                 18.442 
                 22.980 
                 20.551 
                 1.00 
                 46.90 
                 C 
               
               
                 ATOM 
                 1796 
                 CB 
                 ASN 
                 C 
                 21 
                 17.019 
                 22.815 
                 20.012 
                 1.00 
                 46.94 
                 C 
               
               
                 ATOM 
                 1797 
                 CG 
                 ASN 
                 C 
                 21 
                 15.994 
                 23.612 
                 20.799 
                 1.00 
                 48.31 
                 C 
               
               
                 ATOM 
                 1798 
                 OD1 
                 ASN 
                 C 
                 21 
                 15.564 
                 24.676 
                 20.361 
                 1.00 
                 49.34 
                 O 
               
               
                 ATOM 
                 1799 
                 ND2 
                 ASN 
                 C 
                 21 
                 15.592 
                 23.100 
                 21.965 
                 1.00 
                 49.90 
                 N 
               
               
                 ATOM 
                 1800 
                 C 
                 ASN 
                 C 
                 21 
                 19.390 
                 22.387 
                 19.542 
                 1.00 
                 46.87 
                 C 
               
               
                 ATOM 
                 1801 
                 O 
                 ASN 
                 C 
                 21 
                 19.539 
                 22.928 
                 18.468 
                 1.00 
                 47.41 
                 O 
               
               
                 ATOM 
                 1802 
                 N 
                 CYS 
                 C 
                 22 
                 20.035 
                 21.282 
                 19.883 
                 1.00 
                 46.92 
                 N 
               
               
                 ATOM 
                 1803 
                 CA 
                 CYS 
                 C 
                 22 
                 20.816 
                 20.516 
                 18.917 
                 1.00 
                 46.98 
                 C 
               
               
                 ATOM 
                 1804 
                 CB 
                 CYS 
                 C 
                 22 
                 22.261 
                 20.348 
                 19.412 
                 1.00 
                 47.47 
                 C 
               
               
                 ATOM 
                 1805 
                 SG 
                 CYS 
                 C 
                 22 
                 23.260 
                 21.888 
                 19.588 
                 1.00 
                 53.20 
                 S 
               
               
                 ATOM 
                 1806 
                 C 
                 CYS 
                 C 
                 22 
                 20.188 
                 19.123 
                 18.685 
                 1.00 
                 45.66 
                 C 
               
               
                 ATOM 
                 1807 
                 O 
                 CYS 
                 C 
                 22 
                 19.582 
                 18.548 
                 19.599 
                 1.00 
                 45.62 
                 O 
               
               
                 ATOM 
                 1808 
                 N 
                 ALA 
                 C 
                 23 
                 20.335 
                 18.579 
                 17.477 
                 1.00 
                 43.90 
                 N 
               
               
                 ATOM 
                 1809 
                 CA 
                 ALA 
                 C 
                 23 
                 19.989 
                 17.185 
                 17.252 
                 1.00 
                 42.45 
                 C 
               
               
                 ATOM 
                 1810 
                 CB 
                 ALA 
                 C 
                 23 
                 18.682 
                 17.045 
                 16.532 
                 1.00 
                 42.68 
                 C 
               
               
                 ATOM 
                 1811 
                 C 
                 ALA 
                 C 
                 23 
                 21.095 
                 16.436 
                 16.524 
                 1.00 
                 42.11 
                 C 
               
               
                 ATOM 
                 1812 
                 O 
                 ALA 
                 C 
                 23 
                 21.709 
                 16.947 
                 15.561 
                 1.00 
                 41.96 
                 O 
               
               
                 ATOM 
                 1813 
                 N 
                 LEU 
                 C 
                 24 
                 21.359 
                 15.222 
                 17.019 
                 1.00 
                 40.74 
                 N 
               
               
                 ATOM 
                 1814 
                 CA 
                 LEU 
                 C 
                 24 
                 22.336 
                 14.323 
                 16.417 
                 1.00 
                 39.93 
                 C 
               
               
                 ATOM 
                 1815 
                 CB 
                 LEU 
                 C 
                 24 
                 22.925 
                 13.351 
                 17.474 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 1816 
                 CG 
                 LEU 
                 C 
                 24 
                 24.008 
                 12.327 
                 17.060 
                 1.00 
                 38.90 
                 C 
               
               
                 ATOM 
                 1817 
                 CD1 
                 LEU 
                 C 
                 24 
                 24.451 
                 11.459 
                 18.251 
                 1.00 
                 36.33 
                 C 
               
               
                 ATOM 
                 1818 
                 CD2 
                 LEU 
                 C 
                 24 
                 25.205 
                 12.958 
                 16.367 
                 1.00 
                 32.90 
                 C 
               
               
                 ATOM 
                 1819 
                 C 
                 LEU 
                 C 
                 24 
                 21.636 
                 13.575 
                 15.281 
                 1.00 
                 39.20 
                 C 
               
               
                 ATOM 
                 1820 
                 O 
                 LEU 
                 C 
                 24 
                 20.666 
                 12.842 
                 15.537 
                 1.00 
                 38.96 
                 O 
               
               
                 ATOM 
                 1821 
                 N 
                 LYS 
                 C 
                 25 
                 22.095 
                 13.789 
                 14.042 
                 1.00 
                 37.85 
                 N 
               
               
                 ATOM 
                 1822 
                 CA 
                 LYS 
                 C 
                 25 
                 21.501 
                 13.105 
                 12.903 
                 1.00 
                 37.40 
                 C 
               
               
                 ATOM 
                 1823 
                 CB 
                 LYS 
                 C 
                 25 
                 20.947 
                 14.081 
                 11.875 
                 1.00 
                 37.17 
                 C 
               
               
                 ATOM 
                 1824 
                 CG 
                 LYS 
                 C 
                 25 
                 20.575 
                 15.394 
                 12.436 
                 1.00 
                 38.56 
                 C 
               
               
                 ATOM 
                 1825 
                 CD 
                 LYS 
                 C 
                 25 
                 19.242 
                 15.866 
                 11.907 
                 1.00 
                 41.52 
                 C 
               
               
                 ATOM 
                 1826 
                 CE 
                 LYS 
                 C 
                 25 
                 18.086 
                 15.341 
                 12.746 
                 1.00 
                 41.53 
                 C 
               
               
                 ATOM 
                 1827 
                 NZ 
                 LYS 
                 C 
                 25 
                 17.003 
                 16.347 
                 12.725 
                 1.00 
                 44.19 
                 N 
               
               
                 ATOM 
                 1828 
                 C 
                 LYS 
                 C 
                 25 
                 22.475 
                 12.155 
                 12.219 
                 1.00 
                 37.29 
                 C 
               
               
                 ATOM 
                 1829 
                 O 
                 LYS 
                 C 
                 25 
                 23.690 
                 12.393 
                 12.187 
                 1.00 
                 36.68 
                 O 
               
               
                 ATOM 
                 1830 
                 N 
                 ASN 
                 C 
                 26 
                 21.899 
                 11.096 
                 11.648 
                 1.00 
                 37.08 
                 N 
               
               
                 ATOM 
                 1831 
                 CA 
                 ASN 
                 C 
                 26 
                 22.619 
                 10.045 
                 10.951 
                 1.00 
                 36.94 
                 C 
               
               
                 ATOM 
                 1832 
                 CB 
                 ASN 
                 C 
                 26 
                 23.183 
                 10.554 
                 9.637 
                 1.00 
                 36.73 
                 C 
               
               
                 ATOM 
                 1833 
                 CG 
                 ASN 
                 C 
                 26 
                 23.422 
                 9.445 
                 8.640 
                 1.00 
                 36.96 
                 C 
               
               
                 ATOM 
                 1834 
                 OD1 
                 ASN 
                 C 
                 26 
                 24.386 
                 9.500 
                 7.886 
                 1.00 
                 37.38 
                 O 
               
               
                 ATOM 
                 1835 
                 ND2 
                 ASN 
                 C 
                 26 
                 22.554 
                 8.429 
                 8.630 
                 1.00 
                 37.00 
                 N 
               
               
                 ATOM 
                 1836 
                 C 
                 ASN 
                 C 
                 26 
                 23.693 
                 9.383 
                 11.800 
                 1.00 
                 37.21 
                 C 
               
               
                 ATOM 
                 1837 
                 O 
                 ASN 
                 C 
                 26 
                 24.818 
                 9.162 
                 11.347 
                 1.00 
                 37.58 
                 O 
               
               
                 ATOM 
                 1838 
                 N 
                 ALA 
                 C 
                 27 
                 23.324 
                 9.063 
                 13.036 
                 1.00 
                 37.26 
                 N 
               
               
                 ATOM 
                 1839 
                 CA 
                 ALA 
                 C 
                 27 
                 24.168 
                 8.297 
                 13.926 
                 1.00 
                 37.54 
                 C 
               
               
                 ATOM 
                 1840 
                 CB 
                 ALA 
                 C 
                 27 
                 24.279 
                 9.001 
                 15.233 
                 1.00 
                 37.73 
                 C 
               
               
                 ATOM 
                 1841 
                 C 
                 ALA 
                 C 
                 27 
                 23.610 
                 6.889 
                 14.126 
                 1.00 
                 37.64 
                 C 
               
               
                 ATOM 
                 1842 
                 O 
                 ALA 
                 C 
                 27 
                 22.456 
                 6.720 
                 14.500 
                 1.00 
                 37.87 
                 O 
               
               
                 ATOM 
                 1843 
                 N 
                 ALA 
                 C 
                 28 
                 24.427 
                 5.877 
                 13.860 
                 1.00 
                 38.19 
                 N 
               
               
                 ATOM 
                 1844 
                 CA 
                 ALA 
                 C 
                 28 
                 24.031 
                 4.483 
                 14.114 
                 1.00 
                 38.86 
                 C 
               
               
                 ATOM 
                 1845 
                 CB 
                 ALA 
                 C 
                 28 
                 25.016 
                 3.490 
                 13.457 
                 1.00 
                 38.12 
                 C 
               
               
                 ATOM 
                 1846 
                 C 
                 ALA 
                 C 
                 28 
                 23.966 
                 4.271 
                 15.621 
                 1.00 
                 39.37 
                 C 
               
               
                 ATOM 
                 1847 
                 O 
                 ALA 
                 C 
                 28 
                 23.060 
                 3.640 
                 16.125 
                 1.00 
                 39.79 
                 O 
               
               
                 ATOM 
                 1848 
                 N 
                 ASP 
                 C 
                 29 
                 24.917 
                 4.867 
                 16.329 
                 1.00 
                 39.97 
                 N 
               
               
                 ATOM 
                 1849 
                 CA 
                 ASP 
                 C 
                 29 
                 25.115 
                 4.646 
                 17.740 
                 1.00 
                 40.44 
                 C 
               
               
                 ATOM 
                 1850 
                 CB 
                 ASP 
                 C 
                 29 
                 26.597 
                 4.825 
                 18.041 
                 1.00 
                 40.96 
                 C 
               
               
                 ATOM 
                 1851 
                 CG 
                 ASP 
                 C 
                 29 
                 27.479 
                 3.880 
                 17.226 
                 1.00 
                 43.39 
                 C 
               
               
                 ATOM 
                 1852 
                 OD1 
                 ASP 
                 C 
                 29 
                 27.169 
                 2.654 
                 17.165 
                 1.00 
                 44.27 
                 O 
               
               
                 ATOM 
                 1853 
                 OD2 
                 ASP 
                 C 
                 29 
                 28.495 
                 4.369 
                 16.657 
                 1.00 
                 46.39 
                 O 
               
               
                 ATOM 
                 1854 
                 C 
                 ASP 
                 C 
                 29 
                 24.293 
                 5.571 
                 18.634 
                 1.00 
                 40.24 
                 C 
               
               
                 ATOM 
                 1855 
                 O 
                 ASP 
                 C 
                 29 
                 23.689 
                 6.523 
                 18.171 
                 1.00 
                 39.90 
                 O 
               
               
                 ATOM 
                 1856 
                 N 
                 ASP 
                 C 
                 30 
                 24.312 
                 5.275 
                 19.929 
                 1.00 
                 40.41 
                 N 
               
               
                 ATOM 
                 1857 
                 CA 
                 ASP 
                 C 
                 30 
                 23.546 
                 5.989 
                 20.938 
                 1.00 
                 40.34 
                 C 
               
               
                 ATOM 
                 1858 
                 CB 
                 ASP 
                 C 
                 30 
                 23.311 
                 5.049 
                 22.117 
                 1.00 
                 40.32 
                 C 
               
               
                 ATOM 
                 1859 
                 CG 
                 ASP 
                 C 
                 30 
                 22.420 
                 3.865 
                 21.764 
                 1.00 
                 42.22 
                 C 
               
               
                 ATOM 
                 1860 
                 OD1 
                 ASP 
                 C 
                 30 
                 22.419 
                 2.885 
                 22.530 
                 1.00 
                 43.42 
                 O 
               
               
                 ATOM 
                 1861 
                 OD2 
                 ASP 
                 C 
                 30 
                 21.694 
                 3.901 
                 20.742 
                 1.00 
                 45.93 
                 O 
               
               
                 ATOM 
                 1862 
                 C 
                 ASP 
                 C 
                 30 
                 24.234 
                 7.271 
                 21.441 
                 1.00 
                 40.30 
                 C 
               
               
                 ATOM 
                 1863 
                 O 
                 ASP 
                 C 
                 30 
                 25.457 
                 7.289 
                 21.620 
                 1.00 
                 40.36 
                 O 
               
               
                 ATOM 
                 1864 
                 N 
                 LEU 
                 C 
                 31 
                 23.444 
                 8.326 
                 21.680 
                 1.00 
                 40.03 
                 N 
               
               
                 ATOM 
                 1865 
                 CA 
                 LEU 
                 C 
                 31 
                 23.909 
                 9.550 
                 22.316 
                 1.00 
                 40.03 
                 C 
               
               
                 ATOM 
                 1866 
                 CB 
                 LEU 
                 C 
                 31 
                 22.763 
                 10.513 
                 22.468 
                 1.00 
                 39.83 
                 C 
               
               
                 ATOM 
                 1867 
                 CG 
                 LEU 
                 C 
                 31 
                 22.910 
                 12.041 
                 22.408 
                 1.00 
                 40.23 
                 C 
               
               
                 ATOM 
                 1868 
                 CD1 
                 LEU 
                 C 
                 31 
                 24.306 
                 12.606 
                 22.614 
                 1.00 
                 38.68 
                 C 
               
               
                 ATOM 
                 1869 
                 CD2 
                 LEU 
                 C 
                 31 
                 21.917 
                 12.646 
                 23.374 
                 1.00 
                 39.10 
                 C 
               
               
                 ATOM 
                 1870 
                 C 
                 LEU 
                 C 
                 31 
                 24.411 
                 9.204 
                 23.703 
                 1.00 
                 40.85 
                 C 
               
               
                 ATOM 
                 1871 
                 O 
                 LEU 
                 C 
                 31 
                 23.685 
                 8.625 
                 24.518 
                 1.00 
                 40.98 
                 O 
               
               
                 ATOM 
                 1872 
                 N 
                 GLU 
                 C 
                 32 
                 25.657 
                 9.566 
                 23.973 
                 1.00 
                 41.58 
                 N 
               
               
                 ATOM 
                 1873 
                 CA 
                 GLU 
                 C 
                 32 
                 26.345 
                 9.082 
                 25.147 
                 1.00 
                 42.36 
                 C 
               
               
                 ATOM 
                 1874 
                 CB 
                 GLU 
                 C 
                 32 
                 27.489 
                 8.170 
                 24.722 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 1875 
                 CG 
                 GLU 
                 C 
                 32 
                 28.036 
                 7.284 
                 25.826 
                 1.00 
                 45.19 
                 C 
               
               
                 ATOM 
                 1876 
                 CD 
                 GLU 
                 C 
                 32 
                 27.062 
                 6.205 
                 26.317 
                 1.00 
                 48.72 
                 C 
               
               
                 ATOM 
                 1877 
                 OE1 
                 GLU 
                 C 
                 32 
                 27.214 
                 5.790 
                 27.491 
                 1.00 
                 49.89 
                 O 
               
               
                 ATOM 
                 1878 
                 OE2 
                 GLU 
                 C 
                 32 
                 26.165 
                 5.763 
                 25.549 
                 1.00 
                 49.60 
                 O 
               
               
                 ATOM 
                 1879 
                 C 
                 GLU 
                 C 
                 32 
                 26.868 
                 10.200 
                 26.015 
                 1.00 
                 42.59 
                 C 
               
               
                 ATOM 
                 1880 
                 O 
                 GLU 
                 C 
                 32 
                 26.954 
                 10.040 
                 27.222 
                 1.00 
                 42.66 
                 O 
               
               
                 ATOM 
                 1881 
                 N 
                 ARG 
                 C 
                 33 
                 27.219 
                 11.326 
                 25.400 
                 1.00 
                 43.15 
                 N 
               
               
                 ATOM 
                 1882 
                 CA 
                 ARG 
                 C 
                 33 
                 27.768 
                 12.463 
                 26.119 
                 1.00 
                 44.02 
                 C 
               
               
                 ATOM 
                 1883 
                 CB 
                 ARG 
                 C 
                 33 
                 29.297 
                 12.366 
                 26.188 
                 1.00 
                 43.78 
                 C 
               
               
                 ATOM 
                 1884 
                 CG 
                 ARG 
                 C 
                 33 
                 29.835 
                 12.760 
                 27.549 
                 1.00 
                 45.32 
                 C 
               
               
                 ATOM 
                 1885 
                 CD 
                 ARG 
                 C 
                 33 
                 31.358 
                 12.861 
                 27.670 
                 1.00 
                 45.61 
                 C 
               
               
                 ATOM 
                 1886 
                 NE 
                 ARG 
                 C 
                 33 
                 31.932 
                 13.600 
                 26.555 
                 1.00 
                 50.54 
                 N 
               
               
                 ATOM 
                 1887 
                 CZ 
                 ARG 
                 C 
                 33 
                 32.936 
                 13.160 
                 25.790 
                 1.00 
                 53.62 
                 C 
               
               
                 ATOM 
                 1888 
                 NH1 
                 ARG 
                 C 
                 33 
                 33.538 
                 11.995 
                 26.050 
                 1.00 
                 53.13 
                 N 
               
               
                 ATOM 
                 1889 
                 NH2 
                 ARG 
                 C 
                 33 
                 33.358 
                 13.903 
                 24.765 
                 1.00 
                 55.14 
                 N 
               
               
                 ATOM 
                 1890 
                 C 
                 ARG 
                 C 
                 33 
                 27.351 
                 13.751 
                 25.436 
                 1.00 
                 44.08 
                 C 
               
               
                 ATOM 
                 1891 
                 O 
                 ARG 
                 C 
                 33 
                 27.274 
                 13.827 
                 24.214 
                 1.00 
                 43.84 
                 O 
               
               
                 ATOM 
                 1892 
                 N 
                 THR 
                 C 
                 34 
                 27.061 
                 14.775 
                 26.222 
                 1.00 
                 44.90 
                 N 
               
               
                 ATOM 
                 1893 
                 CA 
                 THR 
                 C 
                 34 
                 26.716 
                 16.070 
                 25.638 
                 1.00 
                 45.49 
                 C 
               
               
                 ATOM 
                 1894 
                 CB 
                 THR 
                 C 
                 34 
                 25.222 
                 16.398 
                 25.769 
                 1.00 
                 45.88 
                 C 
               
               
                 ATOM 
                 1895 
                 OG1 
                 THR 
                 C 
                 34 
                 24.788 
                 16.134 
                 27.120 
                 1.00 
                 46.31 
                 O 
               
               
                 ATOM 
                 1896 
                 CG2 
                 THR 
                 C 
                 34 
                 24.389 
                 15.552 
                 24.764 
                 1.00 
                 45.54 
                 C 
               
               
                 ATOM 
                 1897 
                 C 
                 THR 
                 C 
                 34 
                 27.523 
                 17.126 
                 26.324 
                 1.00 
                 45.65 
                 C 
               
               
                 ATOM 
                 1898 
                 O 
                 THR 
                 C 
                 34 
                 27.620 
                 17.130 
                 27.542 
                 1.00 
                 46.28 
                 O 
               
               
                 ATOM 
                 1899 
                 N 
                 ASP 
                 C 
                 35 
                 28.131 
                 17.987 
                 25.526 
                 1.00 
                 45.98 
                 N 
               
               
                 ATOM 
                 1900 
                 CA 
                 ASP 
                 C 
                 35 
                 28.961 
                 19.075 
                 25.991 
                 1.00 
                 46.47 
                 C 
               
               
                 ATOM 
                 1901 
                 CB 
                 ASP 
                 C 
                 35 
                 30.409 
                 18.798 
                 25.635 
                 1.00 
                 47.14 
                 C 
               
               
                 ATOM 
                 1902 
                 CG 
                 ASP 
                 C 
                 35 
                 31.034 
                 17.710 
                 26.502 
                 1.00 
                 50.19 
                 C 
               
               
                 ATOM 
                 1903 
                 OD1 
                 ASP 
                 C 
                 35 
                 32.229 
                 17.369 
                 26.281 
                 1.00 
                 53.29 
                 O 
               
               
                 ATOM 
                 1904 
                 OD2 
                 ASP 
                 C 
                 35 
                 30.348 
                 17.206 
                 27.421 
                 1.00 
                 52.72 
                 O 
               
               
                 ATOM 
                 1905 
                 C 
                 ASP 
                 C 
                 35 
                 28.517 
                 20.367 
                 25.319 
                 1.00 
                 46.41 
                 C 
               
               
                 ATOM 
                 1906 
                 O 
                 ASP 
                 C 
                 35 
                 27.873 
                 20.354 
                 24.265 
                 1.00 
                 46.40 
                 O 
               
               
                 ATOM 
                 1907 
                 N 
                 TRP 
                 C 
                 36 
                 28.838 
                 21.493 
                 25.944 
                 1.00 
                 46.29 
                 N 
               
               
                 ATOM 
                 1908 
                 CA 
                 TRP 
                 C 
                 36 
                 28.516 
                 22.792 
                 25.370 
                 1.00 
                 45.80 
                 C 
               
               
                 ATOM 
                 1909 
                 CB 
                 TRP 
                 C 
                 36 
                 27.312 
                 23.395 
                 26.055 
                 1.00 
                 45.82 
                 C 
               
               
                 ATOM 
                 1910 
                 CG 
                 TRP 
                 C 
                 36 
                 26.112 
                 22.609 
                 25.833 
                 1.00 
                 45.99 
                 C 
               
               
                 ATOM 
                 1911 
                 CD1 
                 TRP 
                 C 
                 36 
                 25.717 
                 21.508 
                 26.528 
                 1.00 
                 46.28 
                 C 
               
               
                 ATOM 
                 1912 
                 NE1 
                 TRP 
                 C 
                 36 
                 24.519 
                 21.038 
                 26.036 
                 1.00 
                 46.83 
                 N 
               
               
                 ATOM 
                 1913 
                 CE2 
                 TRP 
                 C 
                 36 
                 24.122 
                 21.842 
                 25.002 
                 1.00 
                 46.87 
                 C 
               
               
                 ATOM 
                 1914 
                 CD2 
                 TRP 
                 C 
                 36 
                 25.113 
                 22.844 
                 24.843 
                 1.00 
                 47.02 
                 C 
               
               
                 ATOM 
                 1915 
                 CE3 
                 TRP 
                 C 
                 36 
                 24.947 
                 23.815 
                 23.840 
                 1.00 
                 46.90 
                 C 
               
               
                 ATOM 
                 1916 
                 CZ3 
                 TRP 
                 C 
                 36 
                 23.798 
                 23.755 
                 23.030 
                 1.00 
                 46.94 
                 C 
               
               
                 ATOM 
                 1917 
                 CH2 
                 TRP 
                 C 
                 36 
                 22.833 
                 22.738 
                 23.216 
                 1.00 
                 47.13 
                 C 
               
               
                 ATOM 
                 1918 
                 CZ2 
                 TRP 
                 C 
                 36 
                 22.979 
                 21.776 
                 24.197 
                 1.00 
                 46.61 
                 C 
               
               
                 ATOM 
                 1919 
                 C 
                 TRP 
                 C 
                 36 
                 29.697 
                 23.706 
                 25.502 
                 1.00 
                 45.48 
                 C 
               
               
                 ATOM 
                 1920 
                 O 
                 TRP 
                 C 
                 36 
                 30.303 
                 23.798 
                 26.569 
                 1.00 
                 45.64 
                 O 
               
               
                 ATOM 
                 1921 
                 N 
                 TYR 
                 C 
                 37 
                 30.034 
                 24.366 
                 24.403 
                 1.00 
                 45.28 
                 N 
               
               
                 ATOM 
                 1922 
                 CA 
                 TYR 
                 C 
                 37 
                 31.184 
                 25.251 
                 24.366 
                 1.00 
                 45.14 
                 C 
               
               
                 ATOM 
                 1923 
                 CB 
                 TYR 
                 C 
                 37 
                 32.265 
                 24.695 
                 23.430 
                 1.00 
                 45.42 
                 C 
               
               
                 ATOM 
                 1924 
                 CG 
                 TYR 
                 C 
                 37 
                 32.608 
                 23.242 
                 23.684 
                 1.00 
                 46.04 
                 C 
               
               
                 ATOM 
                 1925 
                 CD1 
                 TYR 
                 C 
                 37 
                 33.584 
                 22.885 
                 24.635 
                 1.00 
                 47.25 
                 C 
               
               
                 ATOM 
                 1926 
                 CE1 
                 TYR 
                 C 
                 37 
                 33.911 
                 21.545 
                 24.887 
                 1.00 
                 46.32 
                 C 
               
               
                 ATOM 
                 1927 
                 CZ 
                 TYR 
                 C 
                 37 
                 33.257 
                 20.541 
                 24.177 
                 1.00 
                 47.31 
                 C 
               
               
                 ATOM 
                 1928 
                 OH 
                 TYR 
                 C 
                 37 
                 33.571 
                 19.210 
                 24.415 
                 1.00 
                 47.35 
                 O 
               
               
                 ATOM 
                 1929 
                 CE2 
                 TYR 
                 C 
                 37 
                 32.278 
                 20.869 
                 23.222 
                 1.00 
                 47.25 
                 C 
               
               
                 ATOM 
                 1930 
                 CD2 
                 TYR 
                 C 
                 37 
                 31.962 
                 22.218 
                 22.984 
                 1.00 
                 45.98 
                 C 
               
               
                 ATOM 
                 1931 
                 C 
                 TYR 
                 C 
                 37 
                 30.748 
                 26.670 
                 23.972 
                 1.00 
                 44.95 
                 C 
               
               
                 ATOM 
                 1932 
                 O 
                 TYR 
                 C 
                 37 
                 29.651 
                 26.877 
                 23.426 
                 1.00 
                 44.59 
                 O 
               
               
                 ATOM 
                 1933 
                 N 
                 ARG 
                 C 
                 38 
                 31.610 
                 27.641 
                 24.278 
                 1.00 
                 44.40 
                 N 
               
               
                 ATOM 
                 1934 
                 CA 
                 ARG 
                 C 
                 38 
                 31.307 
                 29.039 
                 24.092 
                 1.00 
                 43.78 
                 C 
               
               
                 ATOM 
                 1935 
                 CB 
                 ARG 
                 C 
                 38 
                 30.628 
                 29.570 
                 25.337 
                 1.00 
                 43.85 
                 C 
               
               
                 ATOM 
                 1936 
                 CG 
                 ARG 
                 C 
                 38 
                 30.200 
                 31.012 
                 25.249 
                 1.00 
                 45.64 
                 C 
               
               
                 ATOM 
                 1937 
                 CD 
                 ARG 
                 C 
                 38 
                 29.858 
                 31.527 
                 26.618 
                 1.00 
                 49.42 
                 C 
               
               
                 ATOM 
                 1938 
                 NE 
                 ARG 
                 C 
                 38 
                 31.043 
                 31.607 
                 27.462 
                 1.00 
                 53.90 
                 N 
               
               
                 ATOM 
                 1939 
                 CZ 
                 ARG 
                 C 
                 38 
                 31.040 
                 31.582 
                 28.791 
                 1.00 
                 56.65 
                 C 
               
               
                 ATOM 
                 1940 
                 NH1 
                 ARG 
                 C 
                 38 
                 29.903 
                 31.460 
                 29.479 
                 1.00 
                 57.56 
                 N 
               
               
                 ATOM 
                 1941 
                 NH2 
                 ARG 
                 C 
                 38 
                 32.193 
                 31.662 
                 29.440 
                 1.00 
                 58.12 
                 N 
               
               
                 ATOM 
                 1942 
                 C 
                 ARG 
                 C 
                 38 
                 32.576 
                 29.832 
                 23.839 
                 1.00 
                 43.49 
                 C 
               
               
                 ATOM 
                 1943 
                 O 
                 ARG 
                 C 
                 38 
                 33.589 
                 29.651 
                 24.519 
                 1.00 
                 42.68 
                 O 
               
               
                 ATOM 
                 1944 
                 N 
                 THR 
                 C 
                 39 
                 32.510 
                 30.716 
                 22.849 
                 1.00 
                 43.42 
                 N 
               
               
                 ATOM 
                 1945 
                 CA 
                 THR 
                 C 
                 39 
                 33.577 
                 31.660 
                 22.624 
                 1.00 
                 43.33 
                 C 
               
               
                 ATOM 
                 1946 
                 CB 
                 THR 
                 C 
                 39 
                 34.408 
                 31.326 
                 21.347 
                 1.00 
                 43.01 
                 C 
               
               
                 ATOM 
                 1947 
                 OG1 
                 THR 
                 C 
                 39 
                 35.397 
                 32.334 
                 21.135 
                 1.00 
                 42.59 
                 O 
               
               
                 ATOM 
                 1948 
                 CG2 
                 THR 
                 C 
                 39 
                 33.536 
                 31.219 
                 20.132 
                 1.00 
                 43.58 
                 C 
               
               
                 ATOM 
                 1949 
                 C 
                 THR 
                 C 
                 39 
                 33.029 
                 33.087 
                 22.701 
                 1.00 
                 43.51 
                 C 
               
               
                 ATOM 
                 1950 
                 O 
                 THR 
                 C 
                 39 
                 32.229 
                 33.508 
                 21.877 
                 1.00 
                 43.35 
                 O 
               
               
                 ATOM 
                 1951 
                 N 
                 THR 
                 C 
                 40 
                 33.459 
                 33.781 
                 23.756 
                 1.00 
                 44.12 
                 N 
               
               
                 ATOM 
                 1952 
                 CA 
                 THR 
                 C 
                 40 
                 33.087 
                 35.157 
                 24.122 
                 1.00 
                 44.52 
                 C 
               
               
                 ATOM 
                 1953 
                 CB 
                 THR 
                 C 
                 40 
                 33.779 
                 35.506 
                 25.480 
                 1.00 
                 44.65 
                 C 
               
               
                 ATOM 
                 1954 
                 OG1 
                 THR 
                 C 
                 40 
                 33.014 
                 34.951 
                 26.554 
                 1.00 
                 45.14 
                 O 
               
               
                 ATOM 
                 1955 
                 CG2 
                 THR 
                 C 
                 40 
                 33.954 
                 37.006 
                 25.708 
                 1.00 
                 44.21 
                 C 
               
               
                 ATOM 
                 1956 
                 C 
                 THR 
                 C 
                 40 
                 33.487 
                 36.188 
                 23.076 
                 1.00 
                 44.68 
                 C 
               
               
                 ATOM 
                 1957 
                 O 
                 THR 
                 C 
                 40 
                 34.551 
                 36.065 
                 22.477 
                 1.00 
                 44.77 
                 O 
               
               
                 ATOM 
                 1958 
                 N 
                 LEU 
                 C 
                 41 
                 32.643 
                 37.201 
                 22.864 
                 1.00 
                 45.08 
                 N 
               
               
                 ATOM 
                 1959 
                 CA 
                 LEU 
                 C 
                 41 
                 33.025 
                 38.378 
                 22.051 
                 1.00 
                 45.59 
                 C 
               
               
                 ATOM 
                 1960 
                 CB 
                 LEU 
                 C 
                 41 
                 31.924 
                 39.452 
                 22.017 
                 1.00 
                 45.38 
                 C 
               
               
                 ATOM 
                 1961 
                 CG 
                 LEU 
                 C 
                 41 
                 30.982 
                 39.627 
                 20.817 
                 1.00 
                 45.01 
                 C 
               
               
                 ATOM 
                 1962 
                 CD1 
                 LEU 
                 C 
                 41 
                 30.413 
                 41.035 
                 20.861 
                 1.00 
                 44.32 
                 C 
               
               
                 ATOM 
                 1963 
                 CD2 
                 LEU 
                 C 
                 41 
                 31.648 
                 39.368 
                 19.461 
                 1.00 
                 44.21 
                 C 
               
               
                 ATOM 
                 1964 
                 C 
                 LEU 
                 C 
                 41 
                 34.334 
                 39.029 
                 22.525 
                 1.00 
                 46.09 
                 C 
               
               
                 ATOM 
                 1965 
                 O 
                 LEU 
                 C 
                 41 
                 34.413 
                 39.563 
                 23.642 
                 1.00 
                 46.07 
                 O 
               
               
                 ATOM 
                 1966 
                 N 
                 GLY 
                 C 
                 42 
                 35.345 
                 38.988 
                 21.658 
                 1.00 
                 46.41 
                 N 
               
               
                 ATOM 
                 1967 
                 CA 
                 GLY 
                 C 
                 42 
                 36.662 
                 39.511 
                 21.981 
                 1.00 
                 46.86 
                 C 
               
               
                 ATOM 
                 1968 
                 C 
                 GLY 
                 C 
                 42 
                 37.653 
                 38.393 
                 22.218 
                 1.00 
                 47.32 
                 C 
               
               
                 ATOM 
                 1969 
                 O 
                 GLY 
                 C 
                 42 
                 38.805 
                 38.480 
                 21.808 
                 1.00 
                 47.49 
                 O 
               
               
                 ATOM 
                 1970 
                 N 
                 SER 
                 C 
                 43 
                 37.196 
                 37.334 
                 22.875 
                 1.00 
                 47.84 
                 N 
               
               
                 ATOM 
                 1971 
                 CA 
                 SER 
                 C 
                 43 
                 38.051 
                 36.205 
                 23.232 
                 1.00 
                 48.37 
                 C 
               
               
                 ATOM 
                 1972 
                 CB 
                 SER 
                 C 
                 43 
                 37.381 
                 35.356 
                 24.333 
                 1.00 
                 48.73 
                 C 
               
               
                 ATOM 
                 1973 
                 OG 
                 SER 
                 C 
                 43 
                 38.327 
                 34.801 
                 25.247 
                 1.00 
                 49.16 
                 O 
               
               
                 ATOM 
                 1974 
                 C 
                 SER 
                 C 
                 43 
                 38.353 
                 35.339 
                 22.008 
                 1.00 
                 48.25 
                 C 
               
               
                 ATOM 
                 1975 
                 O 
                 SER 
                 C 
                 43 
                 37.471 
                 35.057 
                 21.198 
                 1.00 
                 48.08 
                 O 
               
               
                 ATOM 
                 1976 
                 N 
                 THR 
                 C 
                 44 
                 39.608 
                 34.932 
                 21.881 
                 1.00 
                 48.32 
                 N 
               
               
                 ATOM 
                 1977 
                 CA 
                 THR 
                 C 
                 44 
                 40.017 
                 34.007 
                 20.826 
                 1.00 
                 48.49 
                 C 
               
               
                 ATOM 
                 1978 
                 CB 
                 THR 
                 C 
                 44 
                 41.540 
                 34.209 
                 20.436 
                 1.00 
                 48.64 
                 C 
               
               
                 ATOM 
                 1979 
                 OG1 
                 THR 
                 C 
                 44 
                 42.070 
                 33.032 
                 19.818 
                 1.00 
                 48.40 
                 O 
               
               
                 ATOM 
                 1980 
                 CG2 
                 THR 
                 C 
                 44 
                 42.410 
                 34.586 
                 21.648 
                 1.00 
                 48.71 
                 C 
               
               
                 ATOM 
                 1981 
                 C 
                 THR 
                 C 
                 44 
                 39.665 
                 32.550 
                 21.192 
                 1.00 
                 48.58 
                 C 
               
               
                 ATOM 
                 1982 
                 O 
                 THR 
                 C 
                 44 
                 39.325 
                 31.741 
                 20.315 
                 1.00 
                 48.51 
                 O 
               
               
                 ATOM 
                 1983 
                 N 
                 ASN 
                 C 
                 45 
                 39.702 
                 32.245 
                 22.493 
                 1.00 
                 48.49 
                 N 
               
               
                 ATOM 
                 1984 
                 CA 
                 ASN 
                 C 
                 45 
                 39.609 
                 30.870 
                 22.991 
                 1.00 
                 48.39 
                 C 
               
               
                 ATOM 
                 1985 
                 CB 
                 ASN 
                 C 
                 45 
                 40.476 
                 30.692 
                 24.234 
                 1.00 
                 48.45 
                 C 
               
               
                 ATOM 
                 1986 
                 CG 
                 ASN 
                 C 
                 45 
                 41.908 
                 30.257 
                 23.900 
                 1.00 
                 48.98 
                 C 
               
               
                 ATOM 
                 1987 
                 OD1 
                 ASN 
                 C 
                 45 
                 42.128 
                 29.275 
                 23.172 
                 1.00 
                 50.20 
                 O 
               
               
                 ATOM 
                 1988 
                 ND2 
                 ASN 
                 C 
                 45 
                 42.884 
                 30.978 
                 24.444 
                 1.00 
                 47.76 
                 N 
               
               
                 ATOM 
                 1989 
                 C 
                 ASN 
                 C 
                 45 
                 38.205 
                 30.403 
                 23.290 
                 1.00 
                 48.21 
                 C 
               
               
                 ATOM 
                 1990 
                 O 
                 ASN 
                 C 
                 45 
                 37.398 
                 31.158 
                 23.829 
                 1.00 
                 48.83 
                 O 
               
               
                 ATOM 
                 1991 
                 N 
                 GLU 
                 C 
                 46 
                 37.926 
                 29.153 
                 22.935 
                 1.00 
                 47.64 
                 N 
               
               
                 ATOM 
                 1992 
                 CA 
                 GLU 
                 C 
                 46 
                 36.613 
                 28.541 
                 23.128 
                 1.00 
                 47.23 
                 C 
               
               
                 ATOM 
                 1993 
                 CB 
                 GLU 
                 C 
                 46 
                 36.369 
                 27.536 
                 22.021 
                 1.00 
                 47.36 
                 C 
               
               
                 ATOM 
                 1994 
                 CG 
                 GLU 
                 C 
                 46 
                 34.963 
                 27.003 
                 21.947 
                 1.00 
                 49.62 
                 C 
               
               
                 ATOM 
                 1995 
                 CD 
                 GLU 
                 C 
                 46 
                 34.877 
                 25.764 
                 21.083 
                 1.00 
                 52.95 
                 C 
               
               
                 ATOM 
                 1996 
                 OE1 
                 GLU 
                 C 
                 46 
                 35.885 
                 25.005 
                 21.073 
                 1.00 
                 54.92 
                 O 
               
               
                 ATOM 
                 1997 
                 OE2 
                 GLU 
                 C 
                 46 
                 33.822 
                 25.558 
                 20.419 
                 1.00 
                 52.26 
                 O 
               
               
                 ATOM 
                 1998 
                 C 
                 GLU 
                 C 
                 46 
                 36.576 
                 27.839 
                 24.480 
                 1.00 
                 46.59 
                 C 
               
               
                 ATOM 
                 1999 
                 O 
                 GLU 
                 C 
                 46 
                 37.566 
                 27.244 
                 24.880 
                 1.00 
                 46.90 
                 O 
               
               
                 ATOM 
                 2000 
                 N 
                 GLN 
                 C 
                 47 
                 35.442 
                 27.896 
                 25.174 
                 1.00 
                 45.60 
                 N 
               
               
                 ATOM 
                 2001 
                 CA 
                 GLN 
                 C 
                 47 
                 35.379 
                 27.529 
                 26.589 
                 1.00 
                 45.13 
                 C 
               
               
                 ATOM 
                 2002 
                 CB 
                 GLN 
                 C 
                 47 
                 35.248 
                 28.810 
                 27.441 
                 1.00 
                 45.06 
                 C 
               
               
                 ATOM 
                 2003 
                 CG 
                 GLN 
                 C 
                 47 
                 34.469 
                 28.693 
                 28.769 
                 1.00 
                 46.54 
                 C 
               
               
                 ATOM 
                 2004 
                 CD 
                 GLN 
                 C 
                 47 
                 34.892 
                 29.728 
                 29.833 
                 1.00 
                 47.69 
                 C 
               
               
                 ATOM 
                 2005 
                 OE1 
                 GLN 
                 C 
                 47 
                 35.066 
                 29.383 
                 31.013 
                 1.00 
                 50.91 
                 O 
               
               
                 ATOM 
                 2006 
                 NE2 
                 GLN 
                 C 
                 47 
                 35.058 
                 30.998 
                 29.422 
                 1.00 
                 50.13 
                 N 
               
               
                 ATOM 
                 2007 
                 C 
                 GLN 
                 C 
                 47 
                 34.267 
                 26.542 
                 26.895 
                 1.00 
                 43.75 
                 C 
               
               
                 ATOM 
                 2008 
                 O 
                 GLN 
                 C 
                 47 
                 33.147 
                 26.682 
                 26.408 
                 1.00 
                 43.68 
                 O 
               
               
                 ATOM 
                 2009 
                 N 
                 LYS 
                 C 
                 48 
                 34.558 
                 25.546 
                 27.717 
                 1.00 
                 42.65 
                 N 
               
               
                 ATOM 
                 2010 
                 CA 
                 LYS 
                 C 
                 48 
                 33.512 
                 24.584 
                 28.070 
                 1.00 
                 42.13 
                 C 
               
               
                 ATOM 
                 2011 
                 CB 
                 LYS 
                 C 
                 48 
                 34.111 
                 23.260 
                 28.577 
                 1.00 
                 42.14 
                 C 
               
               
                 ATOM 
                 2012 
                 CG 
                 LYS 
                 C 
                 48 
                 33.146 
                 22.080 
                 28.531 
                 1.00 
                 42.28 
                 C 
               
               
                 ATOM 
                 2013 
                 CD 
                 LYS 
                 C 
                 48 
                 33.755 
                 20.854 
                 29.227 
                 1.00 
                 42.97 
                 C 
               
               
                 ATOM 
                 2014 
                 CE 
                 LYS 
                 C 
                 48 
                 32.995 
                 19.550 
                 28.896 
                 1.00 
                 44.44 
                 C 
               
               
                 ATOM 
                 2015 
                 NZ 
                 LYS 
                 C 
                 48 
                 31.730 
                 19.382 
                 29.689 
                 1.00 
                 41.90 
                 N 
               
               
                 ATOM 
                 2016 
                 C 
                 LYS 
                 C 
                 48 
                 32.529 
                 25.167 
                 29.088 
                 1.00 
                 40.86 
                 C 
               
               
                 ATOM 
                 2017 
                 O 
                 LYS 
                 C 
                 48 
                 32.927 
                 25.559 
                 30.186 
                 1.00 
                 41.16 
                 O 
               
               
                 ATOM 
                 2018 
                 N 
                 ILE 
                 C 
                 49 
                 31.258 
                 25.234 
                 28.704 
                 1.00 
                 39.24 
                 N 
               
               
                 ATOM 
                 2019 
                 CA 
                 ILE 
                 C 
                 49 
                 30.177 
                 25.610 
                 29.612 
                 1.00 
                 38.21 
                 C 
               
               
                 ATOM 
                 2020 
                 CB 
                 ILE 
                 C 
                 49 
                 28.876 
                 25.902 
                 28.832 
                 1.00 
                 38.04 
                 C 
               
               
                 ATOM 
                 2021 
                 CG1 
                 ILE 
                 C 
                 49 
                 29.063 
                 27.160 
                 27.970 
                 1.00 
                 37.36 
                 C 
               
               
                 ATOM 
                 2022 
                 CD1 
                 ILE 
                 C 
                 49 
                 27.998 
                 27.395 
                 26.955 
                 1.00 
                 35.52 
                 C 
               
               
                 ATOM 
                 2023 
                 CG2 
                 ILE 
                 C 
                 49 
                 27.708 
                 26.058 
                 29.785 
                 1.00 
                 37.96 
                 C 
               
               
                 ATOM 
                 2024 
                 C 
                 ILE 
                 C 
                 49 
                 29.946 
                 24.511 
                 30.657 
                 1.00 
                 37.86 
                 C 
               
               
                 ATOM 
                 2025 
                 O 
                 ILE 
                 C 
                 49 
                 29.840 
                 23.332 
                 30.336 
                 1.00 
                 38.22 
                 O 
               
               
                 ATOM 
                 2026 
                 N 
                 SER 
                 C 
                 50 
                 29.871 
                 24.893 
                 31.914 
                 1.00 
                 36.99 
                 N 
               
               
                 ATOM 
                 2027 
                 CA 
                 SER 
                 C 
                 50 
                 29.823 
                 23.911 
                 32.974 
                 1.00 
                 36.24 
                 C 
               
               
                 ATOM 
                 2028 
                 CB 
                 SER 
                 C 
                 50 
                 30.936 
                 24.211 
                 33.985 
                 1.00 
                 36.03 
                 C 
               
               
                 ATOM 
                 2029 
                 OG 
                 SER 
                 C 
                 50 
                 30.705 
                 23.597 
                 35.226 
                 1.00 
                 35.67 
                 O 
               
               
                 ATOM 
                 2030 
                 C 
                 SER 
                 C 
                 50 
                 28.423 
                 23.953 
                 33.586 
                 1.00 
                 36.12 
                 C 
               
               
                 ATOM 
                 2031 
                 O 
                 SER 
                 C 
                 50 
                 28.101 
                 24.893 
                 34.305 
                 1.00 
                 36.47 
                 O 
               
               
                 ATOM 
                 2032 
                 N 
                 ILE 
                 C 
                 51 
                 27.604 
                 22.937 
                 33.276 
                 1.00 
                 35.77 
                 N 
               
               
                 ATOM 
                 2033 
                 CA 
                 ILE 
                 C 
                 51 
                 26.161 
                 22.887 
                 33.591 
                 1.00 
                 35.08 
                 C 
               
               
                 ATOM 
                 2034 
                 CB 
                 ILE 
                 C 
                 51 
                 25.489 
                 21.636 
                 32.962 
                 1.00 
                 34.76 
                 C 
               
               
                 ATOM 
                 2035 
                 CG1 
                 ILE 
                 C 
                 51 
                 25.814 
                 21.504 
                 31.470 
                 1.00 
                 35.07 
                 C 
               
               
                 ATOM 
                 2036 
                 CD1 
                 ILE 
                 C 
                 51 
                 25.313 
                 22.612 
                 30.586 
                 1.00 
                 34.14 
                 C 
               
               
                 ATOM 
                 2037 
                 CG2 
                 ILE 
                 C 
                 51 
                 23.998 
                 21.633 
                 33.170 
                 1.00 
                 34.35 
                 C 
               
               
                 ATOM 
                 2038 
                 C 
                 ILE 
                 C 
                 51 
                 25.862 
                 22.927 
                 35.089 
                 1.00 
                 35.53 
                 C 
               
               
                 ATOM 
                 2039 
                 O 
                 ILE 
                 C 
                 51 
                 26.594 
                 22.356 
                 35.904 
                 1.00 
                 36.01 
                 O 
               
               
                 ATOM 
                 2040 
                 N 
                 GLY 
                 C 
                 52 
                 24.764 
                 23.590 
                 35.433 
                 1.00 
                 35.65 
                 N 
               
               
                 ATOM 
                 2041 
                 CA 
                 GLY 
                 C 
                 52 
                 24.432 
                 23.962 
                 36.802 
                 1.00 
                 36.14 
                 C 
               
               
                 ATOM 
                 2042 
                 C 
                 GLY 
                 C 
                 52 
                 24.077 
                 25.434 
                 36.781 
                 1.00 
                 36.66 
                 C 
               
               
                 ATOM 
                 2043 
                 O 
                 GLY 
                 C 
                 52 
                 24.461 
                 26.143 
                 35.855 
                 1.00 
                 37.19 
                 O 
               
               
                 ATOM 
                 2044 
                 N 
                 GLY 
                 C 
                 53 
                 23.337 
                 25.905 
                 37.775 
                 1.00 
                 37.19 
                 N 
               
               
                 ATOM 
                 2045 
                 CA 
                 GLY 
                 C 
                 53 
                 23.034 
                 27.339 
                 37.883 
                 1.00 
                 38.04 
                 C 
               
               
                 ATOM 
                 2046 
                 C 
                 GLY 
                 C 
                 53 
                 22.202 
                 27.937 
                 36.755 
                 1.00 
                 38.59 
                 C 
               
               
                 ATOM 
                 2047 
                 O 
                 GLY 
                 C 
                 53 
                 21.063 
                 27.520 
                 36.526 
                 1.00 
                 38.17 
                 O 
               
               
                 ATOM 
                 2048 
                 N 
                 ARG 
                 C 
                 54 
                 22.770 
                 28.924 
                 36.058 
                 1.00 
                 39.36 
                 N 
               
               
                 ATOM 
                 2049 
                 CA 
                 ARG 
                 C 
                 54 
                 22.070 
                 29.587 
                 34.952 
                 1.00 
                 40.47 
                 C 
               
               
                 ATOM 
                 2050 
                 CB 
                 ARG 
                 C 
                 54 
                 22.486 
                 31.070 
                 34.796 
                 1.00 
                 40.52 
                 C 
               
               
                 ATOM 
                 2051 
                 CG 
                 ARG 
                 C 
                 54 
                 23.987 
                 31.389 
                 34.836 
                 1.00 
                 42.08 
                 C 
               
               
                 ATOM 
                 2052 
                 CD 
                 ARG 
                 C 
                 54 
                 24.603 
                 31.668 
                 33.450 
                 1.00 
                 44.40 
                 C 
               
               
                 ATOM 
                 2053 
                 NE 
                 ARG 
                 C 
                 54 
                 24.062 
                 32.872 
                 32.798 
                 1.00 
                 45.39 
                 N 
               
               
                 ATOM 
                 2054 
                 CZ 
                 ARG 
                 C 
                 54 
                 24.681 
                 33.569 
                 31.840 
                 1.00 
                 44.83 
                 C 
               
               
                 ATOM 
                 2055 
                 NH1 
                 ARG 
                 C 
                 54 
                 25.889 
                 33.225 
                 31.399 
                 1.00 
                 43.88 
                 N 
               
               
                 ATOM 
                 2056 
                 NH2 
                 ARG 
                 C 
                 54 
                 24.083 
                 34.626 
                 31.317 
                 1.00 
                 44.61 
                 N 
               
               
                 ATOM 
                 2057 
                 C 
                 ARG 
                 C 
                 54 
                 22.091 
                 28.819 
                 33.612 
                 1.00 
                 40.93 
                 C 
               
               
                 ATOM 
                 2058 
                 O 
                 ARG 
                 C 
                 54 
                 21.457 
                 29.234 
                 32.642 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 2059 
                 N 
                 TYR 
                 C 
                 55 
                 22.801 
                 27.699 
                 33.559 
                 1.00 
                 41.75 
                 N 
               
               
                 ATOM 
                 2060 
                 CA 
                 TYR 
                 C 
                 55 
                 22.718 
                 26.824 
                 32.397 
                 1.00 
                 42.73 
                 C 
               
               
                 ATOM 
                 2061 
                 CB 
                 TYR 
                 C 
                 55 
                 24.098 
                 26.431 
                 31.892 
                 1.00 
                 43.59 
                 C 
               
               
                 ATOM 
                 2062 
                 CG 
                 TYR 
                 C 
                 55 
                 25.028 
                 27.569 
                 31.597 
                 1.00 
                 45.26 
                 C 
               
               
                 ATOM 
                 2063 
                 CD1 
                 TYR 
                 C 
                 55 
                 25.972 
                 27.983 
                 32.547 
                 1.00 
                 46.23 
                 C 
               
               
                 ATOM 
                 2064 
                 CE1 
                 TYR 
                 C 
                 55 
                 26.853 
                 29.032 
                 32.277 
                 1.00 
                 47.06 
                 C 
               
               
                 ATOM 
                 2065 
                 CZ 
                 TYR 
                 C 
                 55 
                 26.803 
                 29.669 
                 31.035 
                 1.00 
                 47.17 
                 C 
               
               
                 ATOM 
                 2066 
                 OH 
                 TYR 
                 C 
                 55 
                 27.678 
                 30.699 
                 30.758 
                 1.00 
                 47.13 
                 O 
               
               
                 ATOM 
                 2067 
                 CE2 
                 TYR 
                 C 
                 55 
                 25.877 
                 29.270 
                 30.072 
                 1.00 
                 47.60 
                 C 
               
               
                 ATOM 
                 2068 
                 CD2 
                 TYR 
                 C 
                 55 
                 24.994 
                 28.220 
                 30.356 
                 1.00 
                 46.94 
                 C 
               
               
                 ATOM 
                 2069 
                 C 
                 TYR 
                 C 
                 55 
                 21.971 
                 25.549 
                 32.739 
                 1.00 
                 42.70 
                 C 
               
               
                 ATOM 
                 2070 
                 O 
                 TYR 
                 C 
                 55 
                 22.483 
                 24.719 
                 33.478 
                 1.00 
                 42.39 
                 O 
               
               
                 ATOM 
                 2071 
                 N 
                 VAL 
                 C 
                 56 
                 20.765 
                 25.382 
                 32.209 
                 1.00 
                 43.05 
                 N 
               
               
                 ATOM 
                 2072 
                 CA 
                 VAL 
                 C 
                 56 
                 20.072 
                 24.108 
                 32.374 
                 1.00 
                 43.44 
                 C 
               
               
                 ATOM 
                 2073 
                 CB 
                 VAL 
                 C 
                 56 
                 18.679 
                 24.247 
                 33.084 
                 1.00 
                 43.19 
                 C 
               
               
                 ATOM 
                 2074 
                 CG1 
                 VAL 
                 C 
                 56 
                 18.404 
                 25.681 
                 33.477 
                 1.00 
                 42.32 
                 C 
               
               
                 ATOM 
                 2075 
                 CG2 
                 VAL 
                 C 
                 56 
                 17.554 
                 23.658 
                 32.252 
                 1.00 
                 43.66 
                 C 
               
               
                 ATOM 
                 2076 
                 C 
                 VAL 
                 C 
                 56 
                 20.073 
                 23.330 
                 31.053 
                 1.00 
                 43.90 
                 C 
               
               
                 ATOM 
                 2077 
                 O 
                 VAL 
                 C 
                 56 
                 19.914 
                 23.910 
                 29.984 
                 1.00 
                 44.29 
                 O 
               
               
                 ATOM 
                 2078 
                 N 
                 GLU 
                 C 
                 57 
                 20.332 
                 22.029 
                 31.134 
                 1.00 
                 44.13 
                 N 
               
               
                 ATOM 
                 2079 
                 CA 
                 GLU 
                 C 
                 57 
                 20.446 
                 21.205 
                 29.944 
                 1.00 
                 44.49 
                 C 
               
               
                 ATOM 
                 2080 
                 CB 
                 GLU 
                 C 
                 57 
                 21.808 
                 20.522 
                 29.886 
                 1.00 
                 44.65 
                 C 
               
               
                 ATOM 
                 2081 
                 CG 
                 GLU 
                 C 
                 57 
                 22.020 
                 19.738 
                 28.595 
                 1.00 
                 46.62 
                 C 
               
               
                 ATOM 
                 2082 
                 CD 
                 GLU 
                 C 
                 57 
                 23.221 
                 18.801 
                 28.631 
                 1.00 
                 48.99 
                 C 
               
               
                 ATOM 
                 2083 
                 OE1 
                 GLU 
                 C 
                 57 
                 23.449 
                 18.116 
                 29.660 
                 1.00 
                 50.79 
                 O 
               
               
                 ATOM 
                 2084 
                 OE2 
                 GLU 
                 C 
                 57 
                 23.929 
                 18.739 
                 27.609 
                 1.00 
                 48.49 
                 O 
               
               
                 ATOM 
                 2085 
                 C 
                 GLU 
                 C 
                 57 
                 19.371 
                 20.151 
                 29.952 
                 1.00 
                 44.38 
                 C 
               
               
                 ATOM 
                 2086 
                 O 
                 GLU 
                 C 
                 57 
                 19.189 
                 19.466 
                 30.957 
                 1.00 
                 44.68 
                 O 
               
               
                 ATOM 
                 2087 
                 N 
                 THR 
                 C 
                 58 
                 18.659 
                 20.008 
                 28.842 
                 1.00 
                 44.32 
                 N 
               
               
                 ATOM 
                 2088 
                 CA 
                 THR 
                 C 
                 58 
                 17.661 
                 18.956 
                 28.754 
                 1.00 
                 44.58 
                 C 
               
               
                 ATOM 
                 2089 
                 CB 
                 THR 
                 C 
                 58 
                 16.228 
                 19.474 
                 28.495 
                 1.00 
                 44.59 
                 C 
               
               
                 ATOM 
                 2090 
                 OG1 
                 THR 
                 C 
                 58 
                 15.977 
                 20.647 
                 29.276 
                 1.00 
                 44.71 
                 O 
               
               
                 ATOM 
                 2091 
                 CG2 
                 THR 
                 C 
                 58 
                 15.209 
                 18.400 
                 28.881 
                 1.00 
                 44.79 
                 C 
               
               
                 ATOM 
                 2092 
                 C 
                 THR 
                 C 
                 58 
                 18.065 
                 18.005 
                 27.661 
                 1.00 
                 44.55 
                 C 
               
               
                 ATOM 
                 2093 
                 O 
                 THR 
                 C 
                 58 
                 18.231 
                 18.413 
                 26.525 
                 1.00 
                 44.96 
                 O 
               
               
                 ATOM 
                 2094 
                 N 
                 VAL 
                 C 
                 59 
                 18.233 
                 16.736 
                 28.016 
                 1.00 
                 44.53 
                 N 
               
               
                 ATOM 
                 2095 
                 CA 
                 VAL 
                 C 
                 59 
                 18.661 
                 15.736 
                 27.054 
                 1.00 
                 44.23 
                 C 
               
               
                 ATOM 
                 2096 
                 CB 
                 VAL 
                 C 
                 59 
                 20.023 
                 15.095 
                 27.445 
                 1.00 
                 44.24 
                 C 
               
               
                 ATOM 
                 2097 
                 CG1 
                 VAL 
                 C 
                 59 
                 20.517 
                 14.143 
                 26.360 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 2098 
                 CG2 
                 VAL 
                 C 
                 59 
                 21.062 
                 16.196 
                 27.706 
                 1.00 
                 44.53 
                 C 
               
               
                 ATOM 
                 2099 
                 C 
                 VAL 
                 C 
                 59 
                 17.587 
                 14.681 
                 26.850 
                 1.00 
                 44.53 
                 C 
               
               
                 ATOM 
                 2100 
                 O 
                 VAL 
                 C 
                 59 
                 16.892 
                 14.274 
                 27.784 
                 1.00 
                 44.23 
                 O 
               
               
                 ATOM 
                 2101 
                 N 
                 ASN 
                 C 
                 60 
                 17.454 
                 14.271 
                 25.594 
                 1.00 
                 44.94 
                 N 
               
               
                 ATOM 
                 2102 
                 CA 
                 ASN 
                 C 
                 60 
                 16.609 
                 13.153 
                 25.202 
                 1.00 
                 44.74 
                 C 
               
               
                 ATOM 
                 2103 
                 CB 
                 ASN 
                 C 
                 60 
                 15.389 
                 13.655 
                 24.428 
                 1.00 
                 44.71 
                 C 
               
               
                 ATOM 
                 2104 
                 CG 
                 ASN 
                 C 
                 60 
                 14.358 
                 12.588 
                 24.221 
                 1.00 
                 45.15 
                 C 
               
               
                 ATOM 
                 2105 
                 OD1 
                 ASN 
                 C 
                 60 
                 14.689 
                 11.424 
                 24.010 
                 1.00 
                 45.39 
                 O 
               
               
                 ATOM 
                 2106 
                 ND2 
                 ASN 
                 C 
                 60 
                 13.085 
                 12.974 
                 24.284 
                 1.00 
                 46.47 
                 N 
               
               
                 ATOM 
                 2107 
                 C 
                 ASN 
                 C 
                 60 
                 17.438 
                 12.204 
                 24.346 
                 1.00 
                 44.60 
                 C 
               
               
                 ATOM 
                 2108 
                 O 
                 ASN 
                 C 
                 60 
                 17.329 
                 12.215 
                 23.106 
                 1.00 
                 44.87 
                 O 
               
               
                 ATOM 
                 2109 
                 N 
                 LYS 
                 C 
                 61 
                 18.315 
                 11.434 
                 25.004 
                 1.00 
                 44.25 
                 N 
               
               
                 ATOM 
                 2110 
                 CA 
                 LYS 
                 C 
                 61 
                 18.902 
                 10.245 
                 24.388 
                 1.00 
                 43.60 
                 C 
               
               
                 ATOM 
                 2111 
                 CB 
                 LYS 
                 C 
                 61 
                 19.676 
                 9.391 
                 25.396 
                 1.00 
                 42.97 
                 C 
               
               
                 ATOM 
                 2112 
                 CG 
                 LYS 
                 C 
                 61 
                 20.685 
                 10.109 
                 26.240 
                 1.00 
                 41.15 
                 C 
               
               
                 ATOM 
                 2113 
                 CD 
                 LYS 
                 C 
                 61 
                 21.355 
                 9.167 
                 27.219 
                 1.00 
                 36.07 
                 C 
               
               
                 ATOM 
                 2114 
                 CE 
                 LYS 
                 C 
                 61 
                 22.521 
                 9.853 
                 27.842 
                 1.00 
                 33.75 
                 C 
               
               
                 ATOM 
                 2115 
                 NZ 
                 LYS 
                 C 
                 61 
                 22.941 
                 9.168 
                 29.069 
                 1.00 
                 33.84 
                 N 
               
               
                 ATOM 
                 2116 
                 C 
                 LYS 
                 C 
                 61 
                 17.678 
                 9.457 
                 23.981 
                 1.00 
                 44.03 
                 C 
               
               
                 ATOM 
                 2117 
                 O 
                 LYS 
                 C 
                 61 
                 16.789 
                 9.233 
                 24.809 
                 1.00 
                 45.15 
                 O 
               
               
                 ATOM 
                 2118 
                 N 
                 GLY 
                 C 
                 62 
                 17.578 
                 9.052 
                 22.733 
                 1.00 
                 43.61 
                 N 
               
               
                 ATOM 
                 2119 
                 CA 
                 GLY 
                 C 
                 62 
                 16.386 
                 8.324 
                 22.349 
                 1.00 
                 43.74 
                 C 
               
               
                 ATOM 
                 2120 
                 C 
                 GLY 
                 C 
                 62 
                 15.924 
                 8.921 
                 21.068 
                 1.00 
                 43.99 
                 C 
               
               
                 ATOM 
                 2121 
                 O 
                 GLY 
                 C 
                 62 
                 15.804 
                 8.220 
                 20.077 
                 1.00 
                 44.34 
                 O 
               
               
                 ATOM 
                 2122 
                 N 
                 SER 
                 C 
                 63 
                 15.682 
                 10.226 
                 21.085 
                 1.00 
                 44.18 
                 N 
               
               
                 ATOM 
                 2123 
                 CA 
                 SER 
                 C 
                 63 
                 15.540 
                 10.990 
                 19.854 
                 1.00 
                 44.37 
                 C 
               
               
                 ATOM 
                 2124 
                 CB 
                 SER 
                 C 
                 63 
                 14.384 
                 11.981 
                 19.985 
                 1.00 
                 44.33 
                 C 
               
               
                 ATOM 
                 2125 
                 OG 
                 SER 
                 C 
                 63 
                 14.601 
                 12.876 
                 21.053 
                 1.00 
                 45.03 
                 O 
               
               
                 ATOM 
                 2126 
                 C 
                 SER 
                 C 
                 63 
                 16.865 
                 11.692 
                 19.512 
                 1.00 
                 44.34 
                 C 
               
               
                 ATOM 
                 2127 
                 O 
                 SER 
                 C 
                 63 
                 16.941 
                 12.475 
                 18.573 
                 1.00 
                 44.35 
                 O 
               
               
                 ATOM 
                 2128 
                 N 
                 LYS 
                 C 
                 64 
                 17.910 
                 11.374 
                 20.278 
                 1.00 
                 44.70 
                 N 
               
               
                 ATOM 
                 2129 
                 CA 
                 LYS 
                 C 
                 64 
                 19.263 
                 11.956 
                 20.120 
                 1.00 
                 44.84 
                 C 
               
               
                 ATOM 
                 2130 
                 CB 
                 LYS 
                 C 
                 64 
                 20.001 
                 11.365 
                 18.913 
                 1.00 
                 44.66 
                 C 
               
               
                 ATOM 
                 2131 
                 CG 
                 LYS 
                 C 
                 64 
                 20.685 
                 10.054 
                 19.177 
                 1.00 
                 43.38 
                 C 
               
               
                 ATOM 
                 2132 
                 CD 
                 LYS 
                 C 
                 64 
                 20.732 
                 9.199 
                 17.938 
                 1.00 
                 40.42 
                 C 
               
               
                 ATOM 
                 2133 
                 CE 
                 LYS 
                 C 
                 64 
                 20.708 
                 7.747 
                 18.313 
                 1.00 
                 39.27 
                 C 
               
               
                 ATOM 
                 2134 
                 NZ 
                 LYS 
                 C 
                 64 
                 20.923 
                 6.914 
                 17.106 
                 1.00 
                 40.81 
                 N 
               
               
                 ATOM 
                 2135 
                 C 
                 LYS 
                 C 
                 64 
                 19.224 
                 13.475 
                 20.021 
                 1.00 
                 45.39 
                 C 
               
               
                 ATOM 
                 2136 
                 O 
                 LYS 
                 C 
                 64 
                 19.916 
                 14.079 
                 19.195 
                 1.00 
                 45.63 
                 O 
               
               
                 ATOM 
                 2137 
                 N 
                 SER 
                 C 
                 65 
                 18.391 
                 14.092 
                 20.853 
                 1.00 
                 45.61 
                 N 
               
               
                 ATOM 
                 2138 
                 CA 
                 SER 
                 C 
                 65 
                 18.313 
                 15.543 
                 20.860 
                 1.00 
                 45.22 
                 C 
               
               
                 ATOM 
                 2139 
                 CB 
                 SER 
                 C 
                 65 
                 17.015 
                 16.014 
                 20.197 
                 1.00 
                 45.32 
                 C 
               
               
                 ATOM 
                 2140 
                 OG 
                 SER 
                 C 
                 65 
                 15.940 
                 15.981 
                 21.107 
                 1.00 
                 45.97 
                 O 
               
               
                 ATOM 
                 2141 
                 C 
                 SER 
                 C 
                 65 
                 18.483 
                 16.105 
                 22.275 
                 1.00 
                 44.72 
                 C 
               
               
                 ATOM 
                 2142 
                 O 
                 SER 
                 C 
                 65 
                 18.097 
                 15.479 
                 23.274 
                 1.00 
                 44.33 
                 O 
               
               
                 ATOM 
                 2143 
                 N 
                 PHE 
                 C 
                 66 
                 19.082 
                 17.285 
                 22.341 
                 1.00 
                 44.16 
                 N 
               
               
                 ATOM 
                 2144 
                 CA 
                 PHE 
                 C 
                 66 
                 19.394 
                 17.928 
                 23.606 
                 1.00 
                 43.60 
                 C 
               
               
                 ATOM 
                 2145 
                 CB 
                 PHE 
                 C 
                 66 
                 20.721 
                 17.387 
                 24.160 
                 1.00 
                 44.01 
                 C 
               
               
                 ATOM 
                 2146 
                 CG 
                 PHE 
                 C 
                 66 
                 21.873 
                 17.540 
                 23.220 
                 1.00 
                 44.66 
                 C 
               
               
                 ATOM 
                 2147 
                 CD1 
                 PHE 
                 C 
                 66 
                 22.961 
                 18.342 
                 23.571 
                 1.00 
                 46.00 
                 C 
               
               
                 ATOM 
                 2148 
                 CE1 
                 PHE 
                 C 
                 66 
                 24.045 
                 18.504 
                 22.703 
                 1.00 
                 47.22 
                 C 
               
               
                 ATOM 
                 2149 
                 CZ 
                 PHE 
                 C 
                 66 
                 24.025 
                 17.865 
                 21.454 
                 1.00 
                 47.14 
                 C 
               
               
                 ATOM 
                 2150 
                 CE2 
                 PHE 
                 C 
                 66 
                 22.922 
                 17.064 
                 21.084 
                 1.00 
                 45.67 
                 C 
               
               
                 ATOM 
                 2151 
                 CD2 
                 PHE 
                 C 
                 66 
                 21.866 
                 16.904 
                 21.974 
                 1.00 
                 45.23 
                 C 
               
               
                 ATOM 
                 2152 
                 C 
                 PHE 
                 C 
                 66 
                 19.448 
                 19.431 
                 23.413 
                 1.00 
                 42.65 
                 C 
               
               
                 ATOM 
                 2153 
                 O 
                 PHE 
                 C 
                 66 
                 19.643 
                 19.916 
                 22.290 
                 1.00 
                 41.90 
                 O 
               
               
                 ATOM 
                 2154 
                 N 
                 SER 
                 C 
                 67 
                 19.265 
                 20.164 
                 24.508 
                 1.00 
                 42.04 
                 N 
               
               
                 ATOM 
                 2155 
                 CA 
                 SER 
                 C 
                 67 
                 19.212 
                 21.634 
                 24.453 
                 1.00 
                 41.52 
                 C 
               
               
                 ATOM 
                 2156 
                 CB 
                 SER 
                 C 
                 67 
                 17.773 
                 22.110 
                 24.283 
                 1.00 
                 41.21 
                 C 
               
               
                 ATOM 
                 2157 
                 OG 
                 SER 
                 C 
                 67 
                 17.141 
                 22.180 
                 25.545 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 2158 
                 C 
                 SER 
                 C 
                 67 
                 19.821 
                 22.316 
                 25.671 
                 1.00 
                 40.87 
                 C 
               
               
                 ATOM 
                 2159 
                 O 
                 SER 
                 C 
                 67 
                 19.828 
                 21.765 
                 26.756 
                 1.00 
                 40.62 
                 O 
               
               
                 ATOM 
                 2160 
                 N 
                 LEU 
                 C 
                 68 
                 20.314 
                 23.528 
                 25.474 
                 1.00 
                 40.64 
                 N 
               
               
                 ATOM 
                 2161 
                 CA 
                 LEU 
                 C 
                 68 
                 20.846 
                 24.326 
                 26.563 
                 1.00 
                 41.10 
                 C 
               
               
                 ATOM 
                 2162 
                 CB 
                 LEU 
                 C 
                 68 
                 22.261 
                 24.794 
                 26.222 
                 1.00 
                 40.90 
                 C 
               
               
                 ATOM 
                 2163 
                 CG 
                 LEU 
                 C 
                 68 
                 22.953 
                 25.633 
                 27.287 
                 1.00 
                 40.77 
                 C 
               
               
                 ATOM 
                 2164 
                 CD1 
                 LEU 
                 C 
                 68 
                 23.220 
                 24.788 
                 28.519 
                 1.00 
                 40.99 
                 C 
               
               
                 ATOM 
                 2165 
                 CD2 
                 LEU 
                 C 
                 68 
                 24.238 
                 26.207 
                 26.730 
                 1.00 
                 41.39 
                 C 
               
               
                 ATOM 
                 2166 
                 C 
                 LEU 
                 C 
                 68 
                 19.965 
                 25.529 
                 26.797 
                 1.00 
                 41.39 
                 C 
               
               
                 ATOM 
                 2167 
                 O 
                 LEU 
                 C 
                 68 
                 19.555 
                 26.174 
                 25.862 
                 1.00 
                 41.94 
                 O 
               
               
                 ATOM 
                 2168 
                 N 
                 ARG 
                 C 
                 69 
                 19.657 
                 25.835 
                 28.038 
                 1.00 
                 42.12 
                 N 
               
               
                 ATOM 
                 2169 
                 CA 
                 ARG 
                 C 
                 69 
                 18.930 
                 27.057 
                 28.318 
                 1.00 
                 43.31 
                 C 
               
               
                 ATOM 
                 2170 
                 CB 
                 ARG 
                 C 
                 69 
                 17.610 
                 26.778 
                 29.037 
                 1.00 
                 43.32 
                 C 
               
               
                 ATOM 
                 2171 
                 CG 
                 ARG 
                 C 
                 69 
                 16.830 
                 28.037 
                 29.423 
                 1.00 
                 43.69 
                 C 
               
               
                 ATOM 
                 2172 
                 CD 
                 ARG 
                 C 
                 69 
                 15.456 
                 27.700 
                 29.985 
                 1.00 
                 44.45 
                 C 
               
               
                 ATOM 
                 2173 
                 NE 
                 ARG 
                 C 
                 69 
                 14.953 
                 28.792 
                 30.821 
                 1.00 
                 49.97 
                 N 
               
               
                 ATOM 
                 2174 
                 CZ 
                 ARG 
                 C 
                 69 
                 13.979 
                 29.651 
                 30.485 
                 1.00 
                 52.04 
                 C 
               
               
                 ATOM 
                 2175 
                 NH1 
                 ARG 
                 C 
                 69 
                 13.348 
                 29.550 
                 29.313 
                 1.00 
                 52.62 
                 N 
               
               
                 ATOM 
                 2176 
                 NH2 
                 ARG 
                 C 
                 69 
                 13.619 
                 30.613 
                 31.337 
                 1.00 
                 51.20 
                 N 
               
               
                 ATOM 
                 2177 
                 C 
                 ARG 
                 C 
                 69 
                 19.820 
                 27.926 
                 29.177 
                 1.00 
                 43.74 
                 C 
               
               
                 ATOM 
                 2178 
                 O 
                 ARG 
                 C 
                 69 
                 20.365 
                 27.445 
                 30.181 
                 1.00 
                 43.66 
                 O 
               
               
                 ATOM 
                 2179 
                 N 
                 ILE 
                 C 
                 70 
                 19.986 
                 29.190 
                 28.775 
                 1.00 
                 44.17 
                 N 
               
               
                 ATOM 
                 2180 
                 CA 
                 ILE 
                 C 
                 70 
                 20.771 
                 30.139 
                 29.568 
                 1.00 
                 44.24 
                 C 
               
               
                 ATOM 
                 2181 
                 CB 
                 ILE 
                 C 
                 70 
                 21.924 
                 30.764 
                 28.766 
                 1.00 
                 44.29 
                 C 
               
               
                 ATOM 
                 2182 
                 CG1 
                 ILE 
                 C 
                 70 
                 22.500 
                 29.748 
                 27.767 
                 1.00 
                 44.55 
                 C 
               
               
                 ATOM 
                 2183 
                 CD1 
                 ILE 
                 C 
                 70 
                 23.618 
                 30.268 
                 26.893 
                 1.00 
                 44.09 
                 C 
               
               
                 ATOM 
                 2184 
                 CG2 
                 ILE 
                 C 
                 70 
                 22.985 
                 31.293 
                 29.727 
                 1.00 
                 44.12 
                 C 
               
               
                 ATOM 
                 2185 
                 C 
                 ILE 
                 C 
                 70 
                 19.888 
                 31.247 
                 30.090 
                 1.00 
                 44.26 
                 C 
               
               
                 ATOM 
                 2186 
                 O 
                 ILE 
                 C 
                 70 
                 19.388 
                 32.025 
                 29.305 
                 1.00 
                 44.12 
                 O 
               
               
                 ATOM 
                 2187 
                 N 
                 ARG 
                 C 
                 71 
                 19.689 
                 31.296 
                 31.406 
                 1.00 
                 44.56 
                 N 
               
               
                 ATOM 
                 2188 
                 CA 
                 ARG 
                 C 
                 71 
                 18.986 
                 32.406 
                 32.067 
                 1.00 
                 45.41 
                 C 
               
               
                 ATOM 
                 2189 
                 CB 
                 ARG 
                 C 
                 71 
                 18.490 
                 31.964 
                 33.444 
                 1.00 
                 46.04 
                 C 
               
               
                 ATOM 
                 2190 
                 CG 
                 ARG 
                 C 
                 71 
                 17.001 
                 31.601 
                 33.524 
                 1.00 
                 49.75 
                 C 
               
               
                 ATOM 
                 2191 
                 CD 
                 ARG 
                 C 
                 71 
                 16.720 
                 30.125 
                 33.165 
                 1.00 
                 54.75 
                 C 
               
               
                 ATOM 
                 2192 
                 NE 
                 ARG 
                 C 
                 71 
                 17.547 
                 29.154 
                 33.902 
                 1.00 
                 58.55 
                 N 
               
               
                 ATOM 
                 2193 
                 CZ 
                 ARG 
                 C 
                 71 
                 17.526 
                 28.965 
                 35.227 
                 1.00 
                 60.09 
                 C 
               
               
                 ATOM 
                 2194 
                 NH1 
                 ARG 
                 C 
                 71 
                 18.324 
                 28.047 
                 35.771 
                 1.00 
                 60.34 
                 N 
               
               
                 ATOM 
                 2195 
                 NH2 
                 ARG 
                 C 
                 71 
                 16.729 
                 29.700 
                 36.014 
                 1.00 
                 60.07 
                 N 
               
               
                 ATOM 
                 2196 
                 C 
                 ARG 
                 C 
                 71 
                 19.818 
                 33.693 
                 32.251 
                 1.00 
                 45.00 
                 C 
               
               
                 ATOM 
                 2197 
                 O 
                 ARG 
                 C 
                 71 
                 21.059 
                 33.651 
                 32.249 
                 1.00 
                 44.88 
                 O 
               
               
                 ATOM 
                 2198 
                 N 
                 ASP 
                 C 
                 72 
                 19.118 
                 34.823 
                 32.420 
                 1.00 
                 44.67 
                 N 
               
               
                 ATOM 
                 2199 
                 CA 
                 ASP 
                 C 
                 72 
                 19.710 
                 36.111 
                 32.831 
                 1.00 
                 44.50 
                 C 
               
               
                 ATOM 
                 2200 
                 CB 
                 ASP 
                 C 
                 72 
                 20.197 
                 36.015 
                 34.283 
                 1.00 
                 44.75 
                 C 
               
               
                 ATOM 
                 2201 
                 CG 
                 ASP 
                 C 
                 72 
                 20.246 
                 37.369 
                 34.988 
                 1.00 
                 47.01 
                 C 
               
               
                 ATOM 
                 2202 
                 OD1 
                 ASP 
                 C 
                 72 
                 20.443 
                 37.358 
                 36.224 
                 1.00 
                 49.08 
                 O 
               
               
                 ATOM 
                 2203 
                 OD2 
                 ASP 
                 C 
                 72 
                 20.089 
                 38.440 
                 34.337 
                 1.00 
                 48.36 
                 O 
               
               
                 ATOM 
                 2204 
                 C 
                 ASP 
                 C 
                 72 
                 20.829 
                 36.639 
                 31.906 
                 1.00 
                 43.99 
                 C 
               
               
                 ATOM 
                 2205 
                 O 
                 ASP 
                 C 
                 72 
                 21.917 
                 36.997 
                 32.360 
                 1.00 
                 43.48 
                 O 
               
               
                 ATOM 
                 2206 
                 N 
                 LEU 
                 C 
                 73 
                 20.536 
                 36.697 
                 30.612 
                 1.00 
                 43.65 
                 N 
               
               
                 ATOM 
                 2207 
                 CA 
                 LEU 
                 C 
                 73 
                 21.500 
                 37.109 
                 29.608 
                 1.00 
                 43.40 
                 C 
               
               
                 ATOM 
                 2208 
                 CB 
                 LEU 
                 C 
                 73 
                 20.887 
                 36.973 
                 28.222 
                 1.00 
                 43.00 
                 C 
               
               
                 ATOM 
                 2209 
                 CG 
                 LEU 
                 C 
                 73 
                 20.582 
                 35.582 
                 27.701 
                 1.00 
                 42.57 
                 C 
               
               
                 ATOM 
                 2210 
                 CD1 
                 LEU 
                 C 
                 73 
                 19.672 
                 35.690 
                 26.497 
                 1.00 
                 42.05 
                 C 
               
               
                 ATOM 
                 2211 
                 CD2 
                 LEU 
                 C 
                 73 
                 21.878 
                 34.850 
                 27.348 
                 1.00 
                 42.76 
                 C 
               
               
                 ATOM 
                 2212 
                 C 
                 LEU 
                 C 
                 73 
                 21.970 
                 38.546 
                 29.785 
                 1.00 
                 43.85 
                 C 
               
               
                 ATOM 
                 2213 
                 O 
                 LEU 
                 C 
                 73 
                 21.148 
                 39.456 
                 29.963 
                 1.00 
                 44.05 
                 O 
               
               
                 ATOM 
                 2214 
                 N 
                 ARG 
                 C 
                 74 
                 23.288 
                 38.744 
                 29.738 
                 1.00 
                 44.09 
                 N 
               
               
                 ATOM 
                 2215 
                 CA 
                 ARG 
                 C 
                 74 
                 23.878 
                 40.083 
                 29.681 
                 1.00 
                 44.58 
                 C 
               
               
                 ATOM 
                 2216 
                 CB 
                 ARG 
                 C 
                 74 
                 24.739 
                 40.384 
                 30.906 
                 1.00 
                 45.11 
                 C 
               
               
                 ATOM 
                 2217 
                 CG 
                 ARG 
                 C 
                 74 
                 24.366 
                 39.609 
                 32.152 
                 1.00 
                 48.62 
                 C 
               
               
                 ATOM 
                 2218 
                 CD 
                 ARG 
                 C 
                 74 
                 25.269 
                 38.395 
                 32.294 
                 1.00 
                 54.44 
                 C 
               
               
                 ATOM 
                 2219 
                 NE 
                 ARG 
                 C 
                 74 
                 24.804 
                 37.482 
                 33.336 
                 1.00 
                 59.52 
                 N 
               
               
                 ATOM 
                 2220 
                 CZ 
                 ARG 
                 C 
                 74 
                 25.390 
                 36.322 
                 33.637 
                 1.00 
                 62.37 
                 C 
               
               
                 ATOM 
                 2221 
                 NH1 
                 ARG 
                 C 
                 74 
                 26.477 
                 35.920 
                 32.979 
                 1.00 
                 63.92 
                 N 
               
               
                 ATOM 
                 2222 
                 NH2 
                 ARG 
                 C 
                 74 
                 24.877 
                 35.550 
                 34.589 
                 1.00 
                 62.66 
                 N 
               
               
                 ATOM 
                 2223 
                 C 
                 ARG 
                 C 
                 74 
                 24.720 
                 40.168 
                 28.423 
                 1.00 
                 43.88 
                 C 
               
               
                 ATOM 
                 2224 
                 O 
                 ARG 
                 C 
                 74 
                 25.009 
                 39.136 
                 27.822 
                 1.00 
                 43.92 
                 O 
               
               
                 ATOM 
                 2225 
                 N 
                 VAL 
                 C 
                 75 
                 25.100 
                 41.389 
                 28.028 
                 1.00 
                 43.11 
                 N 
               
               
                 ATOM 
                 2226 
                 CA 
                 VAL 
                 C 
                 75 
                 25.871 
                 41.629 
                 26.797 
                 1.00 
                 42.05 
                 C 
               
               
                 ATOM 
                 2227 
                 CB 
                 VAL 
                 C 
                 75 
                 26.188 
                 43.144 
                 26.576 
                 1.00 
                 42.25 
                 C 
               
               
                 ATOM 
                 2228 
                 CG1 
                 VAL 
                 C 
                 75 
                 24.909 
                 43.964 
                 26.518 
                 1.00 
                 41.91 
                 C 
               
               
                 ATOM 
                 2229 
                 CG2 
                 VAL 
                 C 
                 75 
                 27.026 
                 43.369 
                 25.298 
                 1.00 
                 42.12 
                 C 
               
               
                 ATOM 
                 2230 
                 C 
                 VAL 
                 C 
                 75 
                 27.152 
                 40.794 
                 26.807 
                 1.00 
                 41.41 
                 C 
               
               
                 ATOM 
                 2231 
                 O 
                 VAL 
                 C 
                 75 
                 27.569 
                 40.274 
                 25.766 
                 1.00 
                 41.57 
                 O 
               
               
                 ATOM 
                 2232 
                 N 
                 GLU 
                 C 
                 76 
                 27.742 
                 40.634 
                 27.990 
                 1.00 
                 40.22 
                 N 
               
               
                 ATOM 
                 2233 
                 CA 
                 GLU 
                 C 
                 76 
                 28.939 
                 39.824 
                 28.146 
                 1.00 
                 39.57 
                 C 
               
               
                 ATOM 
                 2234 
                 CB 
                 GLU 
                 C 
                 76 
                 29.438 
                 39.893 
                 29.583 
                 1.00 
                 39.22 
                 C 
               
               
                 ATOM 
                 2235 
                 CG 
                 GLU 
                 C 
                 76 
                 28.705 
                 38.991 
                 30.548 
                 1.00 
                 38.56 
                 C 
               
               
                 ATOM 
                 2236 
                 CD 
                 GLU 
                 C 
                 76 
                 29.132 
                 39.200 
                 31.985 
                 1.00 
                 37.76 
                 C 
               
               
                 ATOM 
                 2237 
                 OE1 
                 GLU 
                 C 
                 76 
                 28.491 
                 38.596 
                 32.881 
                 1.00 
                 37.15 
                 O 
               
               
                 ATOM 
                 2238 
                 OE2 
                 GLU 
                 C 
                 76 
                 30.098 
                 39.971 
                 32.217 
                 1.00 
                 36.57 
                 O 
               
               
                 ATOM 
                 2239 
                 C 
                 GLU 
                 C 
                 76 
                 28.770 
                 38.353 
                 27.706 
                 1.00 
                 39.68 
                 C 
               
               
                 ATOM 
                 2240 
                 O 
                 GLU 
                 C 
                 76 
                 29.759 
                 37.642 
                 27.548 
                 1.00 
                 39.67 
                 O 
               
               
                 ATOM 
                 2241 
                 N 
                 ASP 
                 C 
                 77 
                 27.529 
                 37.906 
                 27.511 
                 1.00 
                 39.47 
                 N 
               
               
                 ATOM 
                 2242 
                 CA 
                 ASP 
                 C 
                 77 
                 27.264 
                 36.553 
                 27.029 
                 1.00 
                 39.18 
                 C 
               
               
                 ATOM 
                 2243 
                 CB 
                 ASP 
                 C 
                 77 
                 25.975 
                 36.015 
                 27.621 
                 1.00 
                 39.36 
                 C 
               
               
                 ATOM 
                 2244 
                 CG 
                 ASP 
                 C 
                 77 
                 26.069 
                 35.792 
                 29.095 
                 1.00 
                 40.54 
                 C 
               
               
                 ATOM 
                 2245 
                 OD1 
                 ASP 
                 C 
                 77 
                 27.103 
                 35.279 
                 29.564 
                 1.00 
                 43.00 
                 O 
               
               
                 ATOM 
                 2246 
                 OD2 
                 ASP 
                 C 
                 77 
                 25.097 
                 36.120 
                 29.795 
                 1.00 
                 42.29 
                 O 
               
               
                 ATOM 
                 2247 
                 C 
                 ASP 
                 C 
                 77 
                 27.187 
                 36.459 
                 25.510 
                 1.00 
                 38.97 
                 C 
               
               
                 ATOM 
                 2248 
                 O 
                 ASP 
                 C 
                 77 
                 26.956 
                 35.371 
                 24.969 
                 1.00 
                 38.86 
                 O 
               
               
                 ATOM 
                 2249 
                 N 
                 SER 
                 C 
                 78 
                 27.362 
                 37.590 
                 24.823 
                 1.00 
                 38.67 
                 N 
               
               
                 ATOM 
                 2250 
                 CA 
                 SER 
                 C 
                 78 
                 27.479 
                 37.581 
                 23.362 
                 1.00 
                 38.39 
                 C 
               
               
                 ATOM 
                 2251 
                 CB 
                 SER 
                 C 
                 78 
                 27.564 
                 38.997 
                 22.814 
                 1.00 
                 38.08 
                 C 
               
               
                 ATOM 
                 2252 
                 OG 
                 SER 
                 C 
                 78 
                 26.390 
                 39.703 
                 23.145 
                 1.00 
                 37.55 
                 O 
               
               
                 ATOM 
                 2253 
                 C 
                 SER 
                 C 
                 78 
                 28.691 
                 36.771 
                 22.905 
                 1.00 
                 38.40 
                 C 
               
               
                 ATOM 
                 2254 
                 O 
                 SER 
                 C 
                 78 
                 29.781 
                 36.858 
                 23.489 
                 1.00 
                 38.36 
                 O 
               
               
                 ATOM 
                 2255 
                 N 
                 GLY 
                 C 
                 79 
                 28.490 
                 35.973 
                 21.867 
                 1.00 
                 38.28 
                 N 
               
               
                 ATOM 
                 2256 
                 CA 
                 GLY 
                 C 
                 79 
                 29.555 
                 35.151 
                 21.334 
                 1.00 
                 38.15 
                 C 
               
               
                 ATOM 
                 2257 
                 C 
                 GLY 
                 C 
                 79 
                 28.959 
                 33.959 
                 20.654 
                 1.00 
                 38.36 
                 C 
               
               
                 ATOM 
                 2258 
                 O 
                 GLY 
                 C 
                 79 
                 27.741 
                 33.866 
                 20.490 
                 1.00 
                 38.35 
                 O 
               
               
                 ATOM 
                 2259 
                 N 
                 THR 
                 C 
                 80 
                 29.823 
                 33.041 
                 20.249 
                 1.00 
                 38.98 
                 N 
               
               
                 ATOM 
                 2260 
                 CA 
                 THR 
                 C 
                 80 
                 29.392 
                 31.847 
                 19.538 
                 1.00 
                 39.37 
                 C 
               
               
                 ATOM 
                 2261 
                 CB 
                 THR 
                 C 
                 80 
                 30.273 
                 31.554 
                 18.304 
                 1.00 
                 39.13 
                 C 
               
               
                 ATOM 
                 2262 
                 OG1 
                 THR 
                 C 
                 80 
                 30.166 
                 32.641 
                 17.377 
                 1.00 
                 38.93 
                 O 
               
               
                 ATOM 
                 2263 
                 CG2 
                 THR 
                 C 
                 80 
                 29.814 
                 30.290 
                 17.600 
                 1.00 
                 39.77 
                 C 
               
               
                 ATOM 
                 2264 
                 C 
                 THR 
                 C 
                 80 
                 29.366 
                 30.674 
                 20.496 
                 1.00 
                 39.89 
                 C 
               
               
                 ATOM 
                 2265 
                 O 
                 THR 
                 C 
                 80 
                 30.323 
                 30.457 
                 21.243 
                 1.00 
                 40.12 
                 O 
               
               
                 ATOM 
                 2266 
                 N 
                 TYR 
                 C 
                 81 
                 28.245 
                 29.946 
                 20.463 
                 1.00 
                 40.31 
                 N 
               
               
                 ATOM 
                 2267 
                 CA 
                 TYR 
                 C 
                 81 
                 27.987 
                 28.748 
                 21.270 
                 1.00 
                 40.42 
                 C 
               
               
                 ATOM 
                 2268 
                 CB 
                 TYR 
                 C 
                 81 
                 26.673 
                 28.921 
                 22.051 
                 1.00 
                 40.48 
                 C 
               
               
                 ATOM 
                 2269 
                 CG 
                 TYR 
                 C 
                 81 
                 26.736 
                 29.991 
                 23.111 
                 1.00 
                 40.67 
                 C 
               
               
                 ATOM 
                 2270 
                 CD1 
                 TYR 
                 C 
                 81 
                 26.667 
                 29.655 
                 24.463 
                 1.00 
                 39.50 
                 C 
               
               
                 ATOM 
                 2271 
                 CE1 
                 TYR 
                 C 
                 81 
                 26.752 
                 30.623 
                 25.444 
                 1.00 
                 38.60 
                 C 
               
               
                 ATOM 
                 2272 
                 CZ 
                 TYR 
                 C 
                 81 
                 26.911 
                 31.954 
                 25.085 
                 1.00 
                 40.20 
                 C 
               
               
                 ATOM 
                 2273 
                 OH 
                 TYR 
                 C 
                 81 
                 26.993 
                 32.905 
                 26.065 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 2274 
                 CE2 
                 TYR 
                 C 
                 81 
                 26.992 
                 32.330 
                 23.753 
                 1.00 
                 40.63 
                 C 
               
               
                 ATOM 
                 2275 
                 CD2 
                 TYR 
                 C 
                 81 
                 26.905 
                 31.344 
                 22.767 
                 1.00 
                 41.34 
                 C 
               
               
                 ATOM 
                 2276 
                 C 
                 TYR 
                 C 
                 81 
                 27.887 
                 27.500 
                 20.384 
                 1.00 
                 40.61 
                 C 
               
               
                 ATOM 
                 2277 
                 O 
                 TYR 
                 C 
                 81 
                 27.270 
                 27.534 
                 19.317 
                 1.00 
                 40.48 
                 O 
               
               
                 ATOM 
                 2278 
                 N 
                 LYS 
                 C 
                 82 
                 28.486 
                 26.400 
                 20.830 
                 1.00 
                 40.98 
                 N 
               
               
                 ATOM 
                 2279 
                 CA 
                 LYS 
                 C 
                 82 
                 28.456 
                 25.142 
                 20.082 
                 1.00 
                 41.31 
                 C 
               
               
                 ATOM 
                 2280 
                 CB 
                 LYS 
                 C 
                 82 
                 29.769 
                 24.890 
                 19.354 
                 1.00 
                 40.81 
                 C 
               
               
                 ATOM 
                 2281 
                 CG 
                 LYS 
                 C 
                 82 
                 29.929 
                 25.735 
                 18.144 
                 1.00 
                 41.85 
                 C 
               
               
                 ATOM 
                 2282 
                 CD 
                 LYS 
                 C 
                 82 
                 31.152 
                 25.386 
                 17.339 
                 1.00 
                 42.31 
                 C 
               
               
                 ATOM 
                 2283 
                 CE 
                 LYS 
                 C 
                 82 
                 31.591 
                 26.597 
                 16.549 
                 1.00 
                 42.93 
                 C 
               
               
                 ATOM 
                 2284 
                 NZ 
                 LYS 
                 C 
                 82 
                 32.191 
                 26.236 
                 15.242 
                 1.00 
                 45.16 
                 N 
               
               
                 ATOM 
                 2285 
                 C 
                 LYS 
                 C 
                 82 
                 28.209 
                 23.989 
                 21.020 
                 1.00 
                 42.03 
                 C 
               
               
                 ATOM 
                 2286 
                 O 
                 LYS 
                 C 
                 82 
                 28.641 
                 24.009 
                 22.173 
                 1.00 
                 42.66 
                 O 
               
               
                 ATOM 
                 2287 
                 N 
                 CYS 
                 C 
                 83 
                 27.522 
                 22.976 
                 20.513 
                 1.00 
                 42.37 
                 N 
               
               
                 ATOM 
                 2288 
                 CA 
                 CYS 
                 C 
                 83 
                 27.318 
                 21.760 
                 21.230 
                 1.00 
                 42.93 
                 C 
               
               
                 ATOM 
                 2289 
                 CB 
                 CYS 
                 C 
                 83 
                 25.854 
                 21.368 
                 21.137 
                 1.00 
                 43.61 
                 C 
               
               
                 ATOM 
                 2290 
                 SG 
                 CYS 
                 C 
                 83 
                 25.278 
                 21.291 
                 19.462 
                 1.00 
                 48.55 
                 S 
               
               
                 ATOM 
                 2291 
                 C 
                 CYS 
                 C 
                 83 
                 28.179 
                 20.680 
                 20.613 
                 1.00 
                 42.42 
                 C 
               
               
                 ATOM 
                 2292 
                 O 
                 CYS 
                 C 
                 83 
                 28.563 
                 20.766 
                 19.447 
                 1.00 
                 41.85 
                 O 
               
               
                 ATOM 
                 2293 
                 N 
                 GLY 
                 C 
                 84 
                 28.480 
                 19.664 
                 21.418 
                 1.00 
                 42.34 
                 N 
               
               
                 ATOM 
                 2294 
                 CA 
                 GLY 
                 C 
                 84 
                 29.137 
                 18.459 
                 20.952 
                 1.00 
                 41.90 
                 C 
               
               
                 ATOM 
                 2295 
                 C 
                 GLY 
                 C 
                 84 
                 28.389 
                 17.233 
                 21.437 
                 1.00 
                 41.74 
                 C 
               
               
                 ATOM 
                 2296 
                 O 
                 GLY 
                 C 
                 84 
                 28.168 
                 17.077 
                 22.622 
                 1.00 
                 41.50 
                 O 
               
               
                 ATOM 
                 2297 
                 N 
                 ALA 
                 C 
                 85 
                 28.009 
                 16.359 
                 20.510 
                 1.00 
                 42.01 
                 N 
               
               
                 ATOM 
                 2298 
                 CA 
                 ALA 
                 C 
                 85 
                 27.327 
                 15.111 
                 20.825 
                 1.00 
                 42.63 
                 C 
               
               
                 ATOM 
                 2299 
                 CB 
                 ALA 
                 C 
                 85 
                 26.066 
                 14.957 
                 19.949 
                 1.00 
                 41.98 
                 C 
               
               
                 ATOM 
                 2300 
                 C 
                 ALA 
                 C 
                 85 
                 28.298 
                 13.972 
                 20.576 
                 1.00 
                 43.38 
                 C 
               
               
                 ATOM 
                 2301 
                 O 
                 ALA 
                 C 
                 85 
                 28.840 
                 13.859 
                 19.484 
                 1.00 
                 43.85 
                 O 
               
               
                 ATOM 
                 2302 
                 N 
                 TYR 
                 C 
                 86 
                 28.538 
                 13.138 
                 21.580 
                 1.00 
                 44.65 
                 N 
               
               
                 ATOM 
                 2303 
                 CA 
                 TYR 
                 C 
                 86 
                 29.488 
                 12.036 
                 21.454 
                 1.00 
                 46.09 
                 C 
               
               
                 ATOM 
                 2304 
                 CB 
                 TYR 
                 C 
                 86 
                 30.651 
                 12.223 
                 22.446 
                 1.00 
                 47.37 
                 C 
               
               
                 ATOM 
                 2305 
                 CG 
                 TYR 
                 C 
                 86 
                 31.336 
                 13.560 
                 22.219 
                 1.00 
                 49.85 
                 C 
               
               
                 ATOM 
                 2306 
                 CD1 
                 TYR 
                 C 
                 86 
                 32.450 
                 13.669 
                 21.367 
                 1.00 
                 52.79 
                 C 
               
               
                 ATOM 
                 2307 
                 CE1 
                 TYR 
                 C 
                 86 
                 33.072 
                 14.925 
                 21.103 
                 1.00 
                 53.92 
                 C 
               
               
                 ATOM 
                 2308 
                 CZ 
                 TYR 
                 C 
                 86 
                 32.554 
                 16.087 
                 21.694 
                 1.00 
                 53.39 
                 C 
               
               
                 ATOM 
                 2309 
                 OH 
                 TYR 
                 C 
                 86 
                 33.154 
                 17.324 
                 21.465 
                 1.00 
                 52.01 
                 O 
               
               
                 ATOM 
                 2310 
                 CE2 
                 TYR 
                 C 
                 86 
                 31.438 
                 15.995 
                 22.552 
                 1.00 
                 53.89 
                 C 
               
               
                 ATOM 
                 2311 
                 CD2 
                 TYR 
                 C 
                 86 
                 30.838 
                 14.734 
                 22.804 
                 1.00 
                 52.16 
                 C 
               
               
                 ATOM 
                 2312 
                 C 
                 TYR 
                 C 
                 86 
                 28.726 
                 10.721 
                 21.616 
                 1.00 
                 46.42 
                 C 
               
               
                 ATOM 
                 2313 
                 O 
                 TYR 
                 C 
                 86 
                 27.858 
                 10.622 
                 22.476 
                 1.00 
                 46.61 
                 O 
               
               
                 ATOM 
                 2314 
                 N 
                 PHE 
                 C 
                 87 
                 29.009 
                 9.738 
                 20.760 
                 1.00 
                 46.89 
                 N 
               
               
                 ATOM 
                 2315 
                 CA 
                 PHE 
                 C 
                 87 
                 28.226 
                 8.492 
                 20.697 
                 1.00 
                 47.55 
                 C 
               
               
                 ATOM 
                 2316 
                 CB 
                 PHE 
                 C 
                 87 
                 27.264 
                 8.519 
                 19.513 
                 1.00 
                 46.60 
                 C 
               
               
                 ATOM 
                 2317 
                 CG 
                 PHE 
                 C 
                 87 
                 27.872 
                 9.054 
                 18.263 
                 1.00 
                 45.28 
                 C 
               
               
                 ATOM 
                 2318 
                 CD1 
                 PHE 
                 C 
                 87 
                 27.886 
                 10.413 
                 18.012 
                 1.00 
                 44.33 
                 C 
               
               
                 ATOM 
                 2319 
                 CE1 
                 PHE 
                 C 
                 87 
                 28.459 
                 10.907 
                 16.867 
                 1.00 
                 43.16 
                 C 
               
               
                 ATOM 
                 2320 
                 CZ 
                 PHE 
                 C 
                 87 
                 29.027 
                 10.041 
                 15.963 
                 1.00 
                 43.21 
                 C 
               
               
                 ATOM 
                 2321 
                 CE2 
                 PHE 
                 C 
                 87 
                 29.017 
                 8.699 
                 16.203 
                 1.00 
                 42.62 
                 C 
               
               
                 ATOM 
                 2322 
                 CD2 
                 PHE 
                 C 
                 87 
                 28.445 
                 8.208 
                 17.344 
                 1.00 
                 43.83 
                 C 
               
               
                 ATOM 
                 2323 
                 C 
                 PHE 
                 C 
                 87 
                 29.105 
                 7.274 
                 20.573 
                 1.00 
                 49.03 
                 C 
               
               
                 ATOM 
                 2324 
                 O 
                 PHE 
                 C 
                 87 
                 30.146 
                 7.331 
                 19.944 
                 1.00 
                 49.13 
                 O 
               
               
                 ATOM 
                 2325 
                 N 
                 SER 
                 C 
                 88 
                 28.684 
                 6.162 
                 21.157 
                 1.00 
                 51.17 
                 N 
               
               
                 ATOM 
                 2326 
                 CA 
                 SER 
                 C 
                 88 
                 29.484 
                 4.956 
                 21.068 
                 1.00 
                 53.66 
                 C 
               
               
                 ATOM 
                 2327 
                 CB 
                 SER 
                 C 
                 88 
                 30.316 
                 4.764 
                 22.341 
                 1.00 
                 53.69 
                 C 
               
               
                 ATOM 
                 2328 
                 OG 
                 SER 
                 C 
                 88 
                 31.025 
                 3.521 
                 22.304 
                 1.00 
                 54.67 
                 O 
               
               
                 ATOM 
                 2329 
                 C 
                 SER 
                 C 
                 88 
                 28.667 
                 3.707 
                 20.792 
                 1.00 
                 55.16 
                 C 
               
               
                 ATOM 
                 2330 
                 O 
                 SER 
                 C 
                 88 
                 27.476 
                 3.658 
                 21.088 
                 1.00 
                 55.08 
                 O 
               
               
                 ATOM 
                 2331 
                 N 
                 ASP 
                 C 
                 89 
                 29.326 
                 2.710 
                 20.206 
                 1.00 
                 57.59 
                 N 
               
               
                 ATOM 
                 2332 
                 CA 
                 ASP 
                 C 
                 89 
                 28.792 
                 1.345 
                 20.138 
                 1.00 
                 60.14 
                 C 
               
               
                 ATOM 
                 2333 
                 CB 
                 ASP 
                 C 
                 89 
                 29.255 
                 0.596 
                 18.860 
                 1.00 
                 60.31 
                 C 
               
               
                 ATOM 
                 2334 
                 CG 
                 ASP 
                 C 
                 89 
                 30.771 
                 0.736 
                 18.578 
                 1.00 
                 60.98 
                 C 
               
               
                 ATOM 
                 2335 
                 OD1 
                 ASP 
                 C 
                 89 
                 31.489 
                 −0.289 
                 18.629 
                 1.00 
                 60.55 
                 O 
               
               
                 ATOM 
                 2336 
                 OD2 
                 ASP 
                 C 
                 89 
                 31.242 
                 1.864 
                 18.295 
                 1.00 
                 61.88 
                 O 
               
               
                 ATOM 
                 2337 
                 C 
                 ASP 
                 C 
                 89 
                 29.230 
                 0.615 
                 21.407 
                 1.00 
                 61.54 
                 C 
               
               
                 ATOM 
                 2338 
                 O 
                 ASP 
                 C 
                 89 
                 30.423 
                 0.368 
                 21.598 
                 1.00 
                 61.77 
                 O 
               
               
                 ATOM 
                 2339 
                 N 
                 ALA 
                 C 
                 90 
                 28.262 
                 0.298 
                 22.270 
                 1.00 
                 63.36 
                 N 
               
               
                 ATOM 
                 2340 
                 CA 
                 ALA 
                 C 
                 90 
                 28.512 
                 −0.238 
                 23.625 
                 1.00 
                 65.20 
                 C 
               
               
                 ATOM 
                 2341 
                 CB 
                 ALA 
                 C 
                 90 
                 27.406 
                 −1.231 
                 24.018 
                 1.00 
                 65.05 
                 C 
               
               
                 ATOM 
                 2342 
                 C 
                 ALA 
                 C 
                 90 
                 29.919 
                 −0.852 
                 23.843 
                 1.00 
                 66.45 
                 C 
               
               
                 ATOM 
                 2343 
                 O 
                 ALA 
                 C 
                 90 
                 30.731 
                 −0.331 
                 24.634 
                 1.00 
                 66.70 
                 O 
               
               
                 ATOM 
                 2344 
                 N 
                 MET 
                 C 
                 91 
                 30.199 
                 −1.945 
                 23.131 
                 1.00 
                 67.72 
                 N 
               
               
                 ATOM 
                 2345 
                 CA 
                 MET 
                 C 
                 91 
                 31.524 
                 −2.562 
                 23.135 
                 1.00 
                 68.99 
                 C 
               
               
                 ATOM 
                 2346 
                 CB 
                 MET 
                 C 
                 91 
                 31.458 
                 −4.008 
                 22.613 
                 1.00 
                 69.19 
                 C 
               
               
                 ATOM 
                 2347 
                 CG 
                 MET 
                 C 
                 91 
                 32.749 
                 −4.832 
                 22.774 
                 1.00 
                 70.93 
                 C 
               
               
                 ATOM 
                 2348 
                 SD 
                 MET 
                 C 
                 91 
                 33.834 
                 −4.849 
                 21.310 
                 1.00 
                 74.22 
                 S 
               
               
                 ATOM 
                 2349 
                 CE 
                 MET 
                 C 
                 91 
                 35.173 
                 −3.747 
                 21.787 
                 1.00 
                 74.42 
                 C 
               
               
                 ATOM 
                 2350 
                 C 
                 MET 
                 C 
                 91 
                 32.507 
                 −1.714 
                 22.319 
                 1.00 
                 69.40 
                 C 
               
               
                 ATOM 
                 2351 
                 O 
                 MET 
                 C 
                 91 
                 32.507 
                 −1.744 
                 21.080 
                 1.00 
                 69.57 
                 O 
               
               
                 ATOM 
                 2352 
                 N 
                 SER 
                 C 
                 92 
                 33.308 
                 −0.929 
                 23.035 
                 1.00 
                 69.79 
                 N 
               
               
                 ATOM 
                 2353 
                 CA 
                 SER 
                 C 
                 92 
                 34.469 
                 −0.223 
                 22.475 
                 1.00 
                 70.05 
                 C 
               
               
                 ATOM 
                 2354 
                 CB 
                 SER 
                 C 
                 92 
                 34.066 
                 0.939 
                 21.541 
                 1.00 
                 69.93 
                 C 
               
               
                 ATOM 
                 2355 
                 OG 
                 SER 
                 C 
                 92 
                 32.806 
                 1.491 
                 21.881 
                 1.00 
                 70.35 
                 O 
               
               
                 ATOM 
                 2356 
                 C 
                 SER 
                 C 
                 92 
                 35.356 
                 0.249 
                 23.627 
                 1.00 
                 70.02 
                 C 
               
               
                 ATOM 
                 2357 
                 O 
                 SER 
                 C 
                 92 
                 36.583 
                 0.306 
                 23.506 
                 1.00 
                 70.09 
                 O 
               
               
                 ATOM 
                 2358 
                 N 
                 ASN 
                 C 
                 93 
                 34.704 
                 0.541 
                 24.750 
                 1.00 
                 70.00 
                 N 
               
               
                 ATOM 
                 2359 
                 CA 
                 ASN 
                 C 
                 93 
                 35.333 
                 1.018 
                 25.993 
                 1.00 
                 69.95 
                 C 
               
               
                 ATOM 
                 2360 
                 CB 
                 ASN 
                 C 
                 93 
                 36.362 
                 0.031 
                 26.561 
                 1.00 
                 69.90 
                 C 
               
               
                 ATOM 
                 2361 
                 CG 
                 ASN 
                 C 
                 93 
                 36.387 
                 0.021 
                 28.090 
                 1.00 
                 69.71 
                 C 
               
               
                 ATOM 
                 2362 
                 OD1 
                 ASN 
                 C 
                 93 
                 37.241 
                 −0.629 
                 28.699 
                 1.00 
                 69.74 
                 O 
               
               
                 ATOM 
                 2363 
                 ND2 
                 ASN 
                 C 
                 93 
                 35.444 
                 0.729 
                 28.715 
                 1.00 
                 68.27 
                 N 
               
               
                 ATOM 
                 2364 
                 C 
                 ASN 
                 C 
                 93 
                 35.884 
                 2.439 
                 25.943 
                 1.00 
                 69.86 
                 C 
               
               
                 ATOM 
                 2365 
                 O 
                 ASN 
                 C 
                 93 
                 36.587 
                 2.838 
                 25.004 
                 1.00 
                 69.97 
                 O 
               
               
                 ATOM 
                 2366 
                 N 
                 TYR 
                 C 
                 94 
                 35.549 
                 3.185 
                 26.993 
                 1.00 
                 69.43 
                 N 
               
               
                 ATOM 
                 2367 
                 CA 
                 TYR 
                 C 
                 94 
                 35.704 
                 4.627 
                 27.041 
                 1.00 
                 68.88 
                 C 
               
               
                 ATOM 
                 2368 
                 CB 
                 TYR 
                 C 
                 94 
                 34.510 
                 5.236 
                 27.776 
                 1.00 
                 69.45 
                 C 
               
               
                 ATOM 
                 2369 
                 CG 
                 TYR 
                 C 
                 94 
                 33.164 
                 4.883 
                 27.172 
                 1.00 
                 70.37 
                 C 
               
               
                 ATOM 
                 2370 
                 CD1 
                 TYR 
                 C 
                 94 
                 32.364 
                 5.872 
                 26.584 
                 1.00 
                 71.10 
                 C 
               
               
                 ATOM 
                 2371 
                 CE1 
                 TYR 
                 C 
                 94 
                 31.121 
                 5.562 
                 26.038 
                 1.00 
                 71.14 
                 C 
               
               
                 ATOM 
                 2372 
                 CZ 
                 TYR 
                 C 
                 94 
                 30.669 
                 4.244 
                 26.062 
                 1.00 
                 71.31 
                 C 
               
               
                 ATOM 
                 2373 
                 OH 
                 TYR 
                 C 
                 94 
                 29.439 
                 3.939 
                 25.516 
                 1.00 
                 71.43 
                 O 
               
               
                 ATOM 
                 2374 
                 CE2 
                 TYR 
                 C 
                 94 
                 31.448 
                 3.238 
                 26.634 
                 1.00 
                 71.20 
                 C 
               
               
                 ATOM 
                 2375 
                 CD2 
                 TYR 
                 C 
                 94 
                 32.684 
                 3.563 
                 27.190 
                 1.00 
                 70.47 
                 C 
               
               
                 ATOM 
                 2376 
                 C 
                 TYR 
                 C 
                 94 
                 37.018 
                 5.019 
                 27.706 
                 1.00 
                 68.05 
                 C 
               
               
                 ATOM 
                 2377 
                 O 
                 TYR 
                 C 
                 94 
                 37.054 
                 5.864 
                 28.607 
                 1.00 
                 67.95 
                 O 
               
               
                 ATOM 
                 2378 
                 N 
                 SER 
                 C 
                 95 
                 38.092 
                 4.370 
                 27.262 
                 1.00 
                 67.01 
                 N 
               
               
                 ATOM 
                 2379 
                 CA 
                 SER 
                 C 
                 95 
                 39.454 
                 4.775 
                 27.598 
                 1.00 
                 65.81 
                 C 
               
               
                 ATOM 
                 2380 
                 CB 
                 SER 
                 C 
                 95 
                 40.366 
                 3.558 
                 27.764 
                 1.00 
                 65.66 
                 C 
               
               
                 ATOM 
                 2381 
                 OG 
                 SER 
                 C 
                 95 
                 39.725 
                 2.552 
                 28.519 
                 1.00 
                 65.34 
                 O 
               
               
                 ATOM 
                 2382 
                 C 
                 SER 
                 C 
                 95 
                 39.966 
                 5.672 
                 26.471 
                 1.00 
                 64.95 
                 C 
               
               
                 ATOM 
                 2383 
                 O 
                 SER 
                 C 
                 95 
                 40.638 
                 6.676 
                 26.716 
                 1.00 
                 65.24 
                 O 
               
               
                 ATOM 
                 2384 
                 N 
                 TYR 
                 C 
                 96 
                 39.641 
                 5.301 
                 25.234 
                 1.00 
                 63.43 
                 N 
               
               
                 ATOM 
                 2385 
                 CA 
                 TYR 
                 C 
                 96 
                 40.027 
                 6.088 
                 24.083 
                 1.00 
                 61.77 
                 C 
               
               
                 ATOM 
                 2386 
                 CB 
                 TYR 
                 C 
                 96 
                 40.629 
                 5.210 
                 22.985 
                 1.00 
                 62.04 
                 C 
               
               
                 ATOM 
                 2387 
                 CG 
                 TYR 
                 C 
                 96 
                 42.014 
                 4.706 
                 23.347 
                 1.00 
                 62.12 
                 C 
               
               
                 ATOM 
                 2388 
                 CD1 
                 TYR 
                 C 
                 96 
                 43.086 
                 5.598 
                 23.492 
                 1.00 
                 62.12 
                 C 
               
               
                 ATOM 
                 2389 
                 CE1 
                 TYR 
                 C 
                 96 
                 44.360 
                 5.147 
                 23.841 
                 1.00 
                 62.47 
                 C 
               
               
                 ATOM 
                 2390 
                 CZ 
                 TYR 
                 C 
                 96 
                 44.572 
                 3.786 
                 24.046 
                 1.00 
                 62.64 
                 C 
               
               
                 ATOM 
                 2391 
                 OH 
                 TYR 
                 C 
                 96 
                 45.834 
                 3.324 
                 24.384 
                 1.00 
                 62.52 
                 O 
               
               
                 ATOM 
                 2392 
                 CE2 
                 TYR 
                 C 
                 96 
                 43.517 
                 2.882 
                 23.907 
                 1.00 
                 62.40 
                 C 
               
               
                 ATOM 
                 2393 
                 CD2 
                 TYR 
                 C 
                 96 
                 42.249 
                 3.347 
                 23.564 
                 1.00 
                 61.75 
                 C 
               
               
                 ATOM 
                 2394 
                 C 
                 TYR 
                 C 
                 96 
                 38.817 
                 6.849 
                 23.608 
                 1.00 
                 60.49 
                 C 
               
               
                 ATOM 
                 2395 
                 O 
                 TYR 
                 C 
                 96 
                 37.695 
                 6.345 
                 23.720 
                 1.00 
                 60.66 
                 O 
               
               
                 ATOM 
                 2396 
                 N 
                 PRO 
                 C 
                 97 
                 39.038 
                 8.077 
                 23.094 
                 1.00 
                 59.03 
                 N 
               
               
                 ATOM 
                 2397 
                 CA 
                 PRO 
                 C 
                 97 
                 37.958 
                 8.995 
                 22.751 
                 1.00 
                 57.45 
                 C 
               
               
                 ATOM 
                 2398 
                 CB 
                 PRO 
                 C 
                 97 
                 38.693 
                 10.221 
                 22.199 
                 1.00 
                 57.62 
                 C 
               
               
                 ATOM 
                 2399 
                 CG 
                 PRO 
                 C 
                 97 
                 40.034 
                 9.721 
                 21.798 
                 1.00 
                 58.56 
                 C 
               
               
                 ATOM 
                 2400 
                 CD 
                 PRO 
                 C 
                 97 
                 40.359 
                 8.663 
                 22.798 
                 1.00 
                 59.07 
                 C 
               
               
                 ATOM 
                 2401 
                 C 
                 PRO 
                 C 
                 97 
                 36.994 
                 8.426 
                 21.718 
                 1.00 
                 55.87 
                 C 
               
               
                 ATOM 
                 2402 
                 O 
                 PRO 
                 C 
                 97 
                 37.393 
                 7.996 
                 20.634 
                 1.00 
                 55.50 
                 O 
               
               
                 ATOM 
                 2403 
                 N 
                 ILE 
                 C 
                 98 
                 35.723 
                 8.421 
                 22.096 
                 1.00 
                 54.16 
                 N 
               
               
                 ATOM 
                 2404 
                 CA 
                 ILE 
                 C 
                 98 
                 34.623 
                 8.020 
                 21.222 
                 1.00 
                 52.19 
                 C 
               
               
                 ATOM 
                 2405 
                 CB 
                 ILE 
                 C 
                 98 
                 33.325 
                 7.702 
                 22.058 
                 1.00 
                 52.52 
                 C 
               
               
                 ATOM 
                 2406 
                 CG1 
                 ILE 
                 C 
                 98 
                 32.930 
                 8.888 
                 22.953 
                 1.00 
                 51.84 
                 C 
               
               
                 ATOM 
                 2407 
                 CD1 
                 ILE 
                 C 
                 98 
                 31.665 
                 8.676 
                 23.761 
                 1.00 
                 51.89 
                 C 
               
               
                 ATOM 
                 2408 
                 CG2 
                 ILE 
                 C 
                 98 
                 33.536 
                 6.406 
                 22.894 
                 1.00 
                 53.12 
                 C 
               
               
                 ATOM 
                 2409 
                 C 
                 ILE 
                 C 
                 98 
                 34.371 
                 9.087 
                 20.141 
                 1.00 
                 50.11 
                 C 
               
               
                 ATOM 
                 2410 
                 O 
                 ILE 
                 C 
                 98 
                 34.661 
                 10.264 
                 20.364 
                 1.00 
                 49.77 
                 O 
               
               
                 ATOM 
                 2411 
                 N 
                 PRO 
                 C 
                 99 
                 33.874 
                 8.671 
                 18.954 
                 1.00 
                 48.00 
                 N 
               
               
                 ATOM 
                 2412 
                 CA 
                 PRO 
                 C 
                 99 
                 33.470 
                 9.652 
                 17.944 
                 1.00 
                 46.52 
                 C 
               
               
                 ATOM 
                 2413 
                 CB 
                 PRO 
                 C 
                 99 
                 32.852 
                 8.782 
                 16.836 
                 1.00 
                 46.16 
                 C 
               
               
                 ATOM 
                 2414 
                 CG 
                 PRO 
                 C 
                 99 
                 32.689 
                 7.435 
                 17.411 
                 1.00 
                 46.14 
                 C 
               
               
                 ATOM 
                 2415 
                 CD 
                 PRO 
                 C 
                 99 
                 33.698 
                 7.291 
                 18.470 
                 1.00 
                 47.41 
                 C 
               
               
                 ATOM 
                 2416 
                 C 
                 PRO 
                 C 
                 99 
                 32.465 
                 10.715 
                 18.468 
                 1.00 
                 45.21 
                 C 
               
               
                 ATOM 
                 2417 
                 O 
                 PRO 
                 C 
                 99 
                 31.867 
                 10.534 
                 19.526 
                 1.00 
                 44.67 
                 O 
               
               
                 ATOM 
                 2418 
                 N 
                 GLY 
                 C 
                 100 
                 32.312 
                 11.816 
                 17.733 
                 1.00 
                 43.96 
                 N 
               
               
                 ATOM 
                 2419 
                 CA 
                 GLY 
                 C 
                 100 
                 31.368 
                 12.871 
                 18.082 
                 1.00 
                 42.29 
                 C 
               
               
                 ATOM 
                 2420 
                 C 
                 GLY 
                 C 
                 100 
                 31.376 
                 13.977 
                 17.049 
                 1.00 
                 41.74 
                 C 
               
               
                 ATOM 
                 2421 
                 O 
                 GLY 
                 C 
                 100 
                 32.229 
                 13.994 
                 16.162 
                 1.00 
                 41.65 
                 O 
               
               
                 ATOM 
                 2422 
                 N 
                 GLU 
                 C 
                 101 
                 30.427 
                 14.900 
                 17.162 
                 1.00 
                 41.32 
                 N 
               
               
                 ATOM 
                 2423 
                 CA 
                 GLU 
                 C 
                 101 
                 30.302 
                 16.039 
                 16.238 
                 1.00 
                 41.63 
                 C 
               
               
                 ATOM 
                 2424 
                 CB 
                 GLC 
                 C 
                 101 
                 29.265 
                 15.742 
                 15.137 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 2425 
                 CG 
                 GLU 
                 C 
                 101 
                 29.525 
                 14.511 
                 14.274 
                 1.00 
                 42.85 
                 C 
               
               
                 ATOM 
                 2426 
                 CD 
                 GLU 
                 C 
                 101 
                 30.562 
                 14.728 
                 13.171 
                 1.00 
                 44.72 
                 C 
               
               
                 ATOM 
                 2427 
                 OE1 
                 GLU 
                 C 
                 101 
                 30.820 
                 15.899 
                 12.792 
                 1.00 
                 46.56 
                 O 
               
               
                 ATOM 
                 2428 
                 OE2 
                 GLU 
                 C 
                 101 
                 31.107 
                 13.715 
                 12.671 
                 1.00 
                 43.10 
                 O 
               
               
                 ATOM 
                 2429 
                 C 
                 GLU 
                 C 
                 101 
                 29.874 
                 17.319 
                 16.981 
                 1.00 
                 41.54 
                 C 
               
               
                 ATOM 
                 2430 
                 O 
                 GLU 
                 C 
                 101 
                 29.267 
                 17.249 
                 18.056 
                 1.00 
                 41.68 
                 O 
               
               
                 ATOM 
                 2431 
                 N 
                 LYS 
                 C 
                 102 
                 30.163 
                 18.483 
                 16.402 
                 1.00 
                 41.21 
                 N 
               
               
                 ATOM 
                 2432 
                 CA 
                 LYS 
                 C 
                 102 
                 29.770 
                 19.770 
                 16.988 
                 1.00 
                 40.46 
                 C 
               
               
                 ATOM 
                 2433 
                 CB 
                 LYS 
                 C 
                 102 
                 30.967 
                 20.706 
                 17.088 
                 1.00 
                 40.30 
                 C 
               
               
                 ATOM 
                 2434 
                 CG 
                 LYS 
                 C 
                 102 
                 32.213 
                 20.088 
                 17.663 
                 1.00 
                 39.49 
                 C 
               
               
                 ATOM 
                 2435 
                 CD 
                 LYS 
                 C 
                 102 
                 32.482 
                 20.613 
                 19.048 
                 1.00 
                 41.83 
                 C 
               
               
                 ATOM 
                 2436 
                 CE 
                 LYS 
                 C 
                 102 
                 33.185 
                 21.983 
                 19.030 
                 1.00 
                 42.84 
                 C 
               
               
                 ATOM 
                 2437 
                 NZ 
                 LYS 
                 C 
                 102 
                 34.685 
                 21.860 
                 19.033 
                 1.00 
                 43.61 
                 N 
               
               
                 ATOM 
                 2438 
                 C 
                 LYS 
                 C 
                 102 
                 28.754 
                 20.404 
                 16.071 
                 1.00 
                 40.70 
                 C 
               
               
                 ATOM 
                 2439 
                 O 
                 LYS 
                 C 
                 102 
                 28.812 
                 20.218 
                 14.849 
                 1.00 
                 40.87 
                 O 
               
               
                 ATOM 
                 2440 
                 N 
                 GLY 
                 C 
                 103 
                 27.818 
                 21.152 
                 16.645 
                 1.00 
                 40.80 
                 N 
               
               
                 ATOM 
                 2441 
                 CA 
                 GLY 
                 C 
                 103 
                 26.904 
                 21.976 
                 15.847 
                 1.00 
                 40.56 
                 C 
               
               
                 ATOM 
                 2442 
                 C 
                 GLY 
                 C 
                 103 
                 27.714 
                 23.051 
                 15.128 
                 1.00 
                 40.72 
                 C 
               
               
                 ATOM 
                 2443 
                 O 
                 GLY 
                 C 
                 103 
                 28.852 
                 23.346 
                 15.515 
                 1.00 
                 41.01 
                 O 
               
               
                 ATOM 
                 2444 
                 N 
                 ALA 
                 C 
                 104 
                 27.147 
                 23.618 
                 14.066 
                 1.00 
                 40.34 
                 N 
               
               
                 ATOM 
                 2445 
                 CA 
                 ALA 
                 C 
                 104 
                 27.760 
                 24.720 
                 13.340 
                 1.00 
                 39.68 
                 C 
               
               
                 ATOM 
                 2446 
                 CB 
                 ALA 
                 C 
                 104 
                 26.978 
                 24.993 
                 12.093 
                 1.00 
                 39.30 
                 C 
               
               
                 ATOM 
                 2447 
                 C 
                 ALA 
                 C 
                 104 
                 27.870 
                 25.986 
                 14.218 
                 1.00 
                 39.81 
                 C 
               
               
                 ATOM 
                 2448 
                 O 
                 ALA 
                 C 
                 104 
                 28.731 
                 26.839 
                 13.982 
                 1.00 
                 39.91 
                 O 
               
               
                 ATOM 
                 2449 
                 N 
                 GLY 
                 C 
                 105 
                 26.994 
                 26.091 
                 15.225 
                 1.00 
                 39.76 
                 N 
               
               
                 ATOM 
                 2450 
                 CA 
                 GLY 
                 C 
                 105 
                 27.052 
                 27.139 
                 16.252 
                 1.00 
                 39.33 
                 C 
               
               
                 ATOM 
                 2451 
                 C 
                 GLY 
                 C 
                 105 
                 25.873 
                 28.105 
                 16.348 
                 1.00 
                 39.20 
                 C 
               
               
                 ATOM 
                 2452 
                 O 
                 GLY 
                 C 
                 105 
                 25.136 
                 28.310 
                 15.380 
                 1.00 
                 39.37 
                 O 
               
               
                 ATOM 
                 2453 
                 N 
                 THR 
                 C 
                 106 
                 25.699 
                 28.711 
                 17.521 
                 1.00 
                 38.80 
                 N 
               
               
                 ATOM 
                 2454 
                 CA 
                 THR 
                 C 
                 106 
                 24.851 
                 29.894 
                 17.654 
                 1.00 
                 38.05 
                 C 
               
               
                 ATOM 
                 2455 
                 CB 
                 THR 
                 C 
                 106 
                 23.814 
                 29.727 
                 18.751 
                 1.00 
                 38.38 
                 C 
               
               
                 ATOM 
                 2456 
                 OG1 
                 THR 
                 C 
                 106 
                 22.999 
                 28.579 
                 18.467 
                 1.00 
                 38.76 
                 O 
               
               
                 ATOM 
                 2457 
                 CG2 
                 THR 
                 C 
                 106 
                 22.944 
                 30.990 
                 18.828 
                 1.00 
                 38.21 
                 C 
               
               
                 ATOM 
                 2458 
                 C 
                 THR 
                 C 
                 106 
                 25.658 
                 31.154 
                 17.950 
                 1.00 
                 37.36 
                 C 
               
               
                 ATOM 
                 2459 
                 O 
                 THR 
                 C 
                 106 
                 26.361 
                 31.242 
                 18.955 
                 1.00 
                 36.52 
                 O 
               
               
                 ATOM 
                 2460 
                 N 
                 VAL 
                 C 
                 107 
                 25.558 
                 32.130 
                 17.057 
                 1.00 
                 37.43 
                 N 
               
               
                 ATOM 
                 2461 
                 CA 
                 VAL 
                 C 
                 107 
                 26.119 
                 33.466 
                 17.343 
                 1.00 
                 37.35 
                 C 
               
               
                 ATOM 
                 2462 
                 CB 
                 VAL 
                 C 
                 107 
                 26.932 
                 34.118 
                 16.152 
                 1.00 
                 36.69 
                 C 
               
               
                 ATOM 
                 2463 
                 CG1 
                 VAL 
                 C 
                 107 
                 26.857 
                 33.283 
                 14.897 
                 1.00 
                 36.10 
                 C 
               
               
                 ATOM 
                 2464 
                 CG2 
                 VAL 
                 C 
                 107 
                 26.520 
                 35.538 
                 15.904 
                 1.00 
                 35.96 
                 C 
               
               
                 ATOM 
                 2465 
                 C 
                 VAL 
                 C 
                 107 
                 25.050 
                 34.350 
                 18.024 
                 1.00 
                 37.47 
                 C 
               
               
                 ATOM 
                 2466 
                 O 
                 VAL 
                 C 
                 107 
                 24.023 
                 34.712 
                 17.424 
                 1.00 
                 37.06 
                 O 
               
               
                 ATOM 
                 2467 
                 N 
                 LEU 
                 C 
                 108 
                 25.290 
                 34.607 
                 19.313 
                 1.00 
                 37.38 
                 N 
               
               
                 ATOM 
                 2468 
                 CA 
                 LEU 
                 C 
                 108 
                 24.324 
                 35.267 
                 20.170 
                 1.00 
                 37.59 
                 C 
               
               
                 ATOM 
                 2469 
                 CB 
                 LEU 
                 C 
                 108 
                 24.245 
                 34.574 
                 21.537 
                 1.00 
                 37.38 
                 C 
               
               
                 ATOM 
                 2470 
                 CG 
                 LEU 
                 C 
                 108 
                 23.406 
                 35.266 
                 22.624 
                 1.00 
                 37.81 
                 C 
               
               
                 ATOM 
                 2471 
                 CD1 
                 LEU 
                 C 
                 108 
                 21.924 
                 35.419 
                 22.243 
                 1.00 
                 37.73 
                 C 
               
               
                 ATOM 
                 2472 
                 CD2 
                 LEU 
                 C 
                 108 
                 23.539 
                 34.545 
                 23.957 
                 1.00 
                 37.81 
                 C 
               
               
                 ATOM 
                 2473 
                 C 
                 LEU 
                 C 
                 108 
                 24.675 
                 36.743 
                 20.326 
                 1.00 
                 37.73 
                 C 
               
               
                 ATOM 
                 2474 
                 O 
                 LEU 
                 C 
                 108 
                 25.790 
                 37.083 
                 20.743 
                 1.00 
                 38.29 
                 O 
               
               
                 ATOM 
                 2475 
                 N 
                 THR 
                 C 
                 109 
                 23.732 
                 37.615 
                 19.976 
                 1.00 
                 37.18 
                 N 
               
               
                 ATOM 
                 2476 
                 CA 
                 THR 
                 C 
                 109 
                 23.913 
                 39.038 
                 20.198 
                 1.00 
                 36.88 
                 C 
               
               
                 ATOM 
                 2477 
                 CB 
                 THR 
                 C 
                 109 
                 23.741 
                 39.834 
                 18.895 
                 1.00 
                 36.94 
                 C 
               
               
                 ATOM 
                 2478 
                 OG1 
                 THR 
                 C 
                 109 
                 24.714 
                 39.382 
                 17.947 
                 1.00 
                 36.86 
                 O 
               
               
                 ATOM 
                 2479 
                 CG2 
                 THR 
                 C 
                 109 
                 23.935 
                 41.315 
                 19.139 
                 1.00 
                 35.69 
                 C 
               
               
                 ATOM 
                 2480 
                 C 
                 THR 
                 C 
                 109 
                 22.941 
                 39.512 
                 21.265 
                 1.00 
                 36.68 
                 C 
               
               
                 ATOM 
                 2481 
                 O 
                 THR 
                 C 
                 109 
                 21.738 
                 39.344 
                 21.123 
                 1.00 
                 36.74 
                 O 
               
               
                 ATOM 
                 2482 
                 N 
                 VAL 
                 C 
                 110 
                 23.458 
                 40.079 
                 22.344 
                 1.00 
                 36.39 
                 N 
               
               
                 ATOM 
                 2483 
                 CA 
                 VAL 
                 C 
                 110 
                 22.571 
                 40.545 
                 23.397 
                 1.00 
                 36.75 
                 C 
               
               
                 ATOM 
                 2484 
                 CB 
                 VAL 
                 C 
                 110 
                 22.731 
                 39.744 
                 24.730 
                 1.00 
                 37.01 
                 C 
               
               
                 ATOM 
                 2485 
                 CG1 
                 VAL 
                 C 
                 110 
                 24.026 
                 38.942 
                 24.754 
                 1.00 
                 37.71 
                 C 
               
               
                 ATOM 
                 2486 
                 CG2 
                 VAL 
                 C 
                 110 
                 22.567 
                 40.628 
                 25.965 
                 1.00 
                 36.58 
                 C 
               
               
                 ATOM 
                 2487 
                 C 
                 VAL 
                 C 
                 110 
                 22.527 
                 42.067 
                 23.571 
                 1.00 
                 36.82 
                 C 
               
               
                 ATOM 
                 2488 
                 O 
                 VAL 
                 C 
                 110 
                 23.561 
                 42.727 
                 23.705 
                 1.00 
                 36.88 
                 O 
               
               
                 ATOM 
                 2489 
                 N 
                 LYS 
                 C 
                 111 
                 21.293 
                 42.581 
                 23.564 
                 1.00 
                 36.66 
                 N 
               
               
                 ATOM 
                 2490 
                 CA 
                 LYS 
                 C 
                 111 
                 20.954 
                 44.004 
                 23.539 
                 1.00 
                 36.40 
                 C 
               
               
                 ATOM 
                 2491 
                 CB 
                 LYS 
                 C 
                 111 
                 21.921 
                 44.857 
                 24.364 
                 1.00 
                 36.13 
                 C 
               
               
                 ATOM 
                 2492 
                 CG 
                 LYS 
                 C 
                 111 
                 21.539 
                 45.007 
                 25.813 
                 1.00 
                 34.53 
                 C 
               
               
                 ATOM 
                 2493 
                 CD 
                 LYS 
                 C 
                 111 
                 21.941 
                 46.406 
                 26.332 
                 1.00 
                 31.44 
                 C 
               
               
                 ATOM 
                 2494 
                 CE 
                 LYS 
                 C 
                 111 
                 20.798 
                 47.369 
                 26.236 
                 1.00 
                 28.66 
                 C 
               
               
                 ATOM 
                 2495 
                 NZ 
                 LYS 
                 C 
                 111 
                 19.648 
                 46.791 
                 26.962 
                 1.00 
                 27.06 
                 N 
               
               
                 ATOM 
                 2496 
                 C 
                 LYS 
                 C 
                 111 
                 20.864 
                 44.514 
                 22.100 
                 1.00 
                 36.68 
                 C 
               
               
                 ATOM 
                 2497 
                 O 
                 LYS 
                 C 
                 111 
                 19.774 
                 44.832 
                 21.605 
                 1.00 
                 36.91 
                 O 
               
               
                 ATOM 
                 2498 
                 N 
                 ALA 
                 D 
                 1 
                 34.772 
                 10.109 
                 45.854 
                 1.00 
                 43.36 
                 N 
               
               
                 ATOM 
                 2499 
                 CA 
                 ALA 
                 D 
                 1 
                 33.646 
                 9.989 
                 44.886 
                 1.00 
                 43.10 
                 C 
               
               
                 ATOM 
                 2500 
                 CB 
                 ALA 
                 D 
                 1 
                 34.122 
                 10.324 
                 43.477 
                 1.00 
                 42.95 
                 C 
               
               
                 ATOM 
                 2501 
                 C 
                 ALA 
                 D 
                 1 
                 33.055 
                 8.587 
                 44.935 
                 1.00 
                 43.06 
                 C 
               
               
                 ATOM 
                 2502 
                 O 
                 ALA 
                 D 
                 1 
                 33.793 
                 7.610 
                 44.856 
                 1.00 
                 42.97 
                 O 
               
               
                 ATOM 
                 2503 
                 N 
                 TRP 
                 D 
                 2 
                 31.730 
                 8.511 
                 45.084 
                 1.00 
                 43.13 
                 N 
               
               
                 ATOM 
                 2504 
                 CA 
                 TRP 
                 D 
                 2 
                 30.958 
                 7.260 
                 45.071 
                 1.00 
                 43.20 
                 C 
               
               
                 ATOM 
                 2505 
                 CB 
                 TRP 
                 D 
                 2 
                 31.000 
                 6.574 
                 46.443 
                 1.00 
                 43.77 
                 C 
               
               
                 ATOM 
                 2506 
                 CG 
                 TRP 
                 D 
                 2 
                 30.328 
                 7.378 
                 47.539 
                 1.00 
                 44.78 
                 C 
               
               
                 ATOM 
                 2507 
                 CD1 
                 TRP 
                 D 
                 2 
                 30.826 
                 8.489 
                 48.173 
                 1.00 
                 45.33 
                 C 
               
               
                 ATOM 
                 2508 
                 NE1 
                 TRP 
                 D 
                 2 
                 29.927 
                 8.949 
                 49.107 
                 1.00 
                 45.42 
                 N 
               
               
                 ATOM 
                 2509 
                 CE2 
                 TRP 
                 D 
                 2 
                 28.816 
                 8.146 
                 49.089 
                 1.00 
                 45.11 
                 C 
               
               
                 ATOM 
                 2510 
                 CD2 
                 TRP 
                 D 
                 2 
                 29.033 
                 7.138 
                 48.115 
                 1.00 
                 45.97 
                 C 
               
               
                 ATOM 
                 2511 
                 CE3 
                 TRP 
                 D 
                 2 
                 28.032 
                 6.169 
                 47.901 
                 1.00 
                 46.79 
                 C 
               
               
                 ATOM 
                 2512 
                 CZ3 
                 TRP 
                 D 
                 2 
                 26.866 
                 6.236 
                 48.668 
                 1.00 
                 45.73 
                 C 
               
               
                 ATOM 
                 2513 
                 CH2 
                 TRP 
                 D 
                 2 
                 26.684 
                 7.263 
                 49.630 
                 1.00 
                 45.13 
                 C 
               
               
                 ATOM 
                 2514 
                 CZ2 
                 TRP 
                 D 
                 2 
                 27.643 
                 8.218 
                 49.850 
                 1.00 
                 44.55 
                 C 
               
               
                 ATOM 
                 2515 
                 C 
                 TRP 
                 D 
                 2 
                 29.512 
                 7.575 
                 44.695 
                 1.00 
                 43.00 
                 C 
               
               
                 ATOM 
                 2516 
                 O 
                 TRP 
                 D 
                 2 
                 29.031 
                 8.676 
                 44.936 
                 1.00 
                 42.89 
                 O 
               
               
                 ATOM 
                 2517 
                 N 
                 VAL 
                 D 
                 3 
                 28.820 
                 6.609 
                 44.107 
                 1.00 
                 43.01 
                 N 
               
               
                 ATOM 
                 2518 
                 CA 
                 VAL 
                 D 
                 3 
                 27.434 
                 6.802 
                 43.677 
                 1.00 
                 42.86 
                 C 
               
               
                 ATOM 
                 2519 
                 CB 
                 VAL 
                 D 
                 3 
                 27.170 
                 6.184 
                 42.285 
                 1.00 
                 42.67 
                 C 
               
               
                 ATOM 
                 2520 
                 CG1 
                 VAL 
                 D 
                 3 
                 25.709 
                 6.364 
                 41.868 
                 1.00 
                 42.34 
                 C 
               
               
                 ATOM 
                 2521 
                 CG2 
                 VAL 
                 D 
                 3 
                 28.087 
                 6.780 
                 41.255 
                 1.00 
                 41.96 
                 C 
               
               
                 ATOM 
                 2522 
                 C 
                 VAL 
                 D 
                 3 
                 26.463 
                 6.196 
                 44.687 
                 1.00 
                 43.26 
                 C 
               
               
                 ATOM 
                 2523 
                 O 
                 VAL 
                 D 
                 3 
                 26.535 
                 5.004 
                 45.005 
                 1.00 
                 43.57 
                 O 
               
               
                 ATOM 
                 2524 
                 N 
                 ASP 
                 D 
                 4 
                 25.562 
                 7.033 
                 45.187 
                 1.00 
                 43.43 
                 N 
               
               
                 ATOM 
                 2525 
                 CA 
                 ASP 
                 D 
                 4 
                 24.540 
                 6.614 
                 46.132 
                 1.00 
                 43.57 
                 C 
               
               
                 ATOM 
                 2526 
                 CB 
                 ASP 
                 D 
                 4 
                 24.272 
                 7.750 
                 47.116 
                 1.00 
                 44.05 
                 C 
               
               
                 ATOM 
                 2527 
                 CG 
                 ASP 
                 D 
                 4 
                 23.139 
                 7.448 
                 48.077 
                 1.00 
                 45.86 
                 C 
               
               
                 ATOM 
                 2528 
                 OD1 
                 ASP 
                 D 
                 4 
                 22.408 
                 8.395 
                 48.442 
                 1.00 
                 49.43 
                 O 
               
               
                 ATOM 
                 2529 
                 OD2 
                 ASP 
                 D 
                 4 
                 22.971 
                 6.279 
                 48.479 
                 1.00 
                 48.18 
                 O 
               
               
                 ATOM 
                 2530 
                 C 
                 ASP 
                 D 
                 4 
                 23.274 
                 6.245 
                 45.368 
                 1.00 
                 43.18 
                 C 
               
               
                 ATOM 
                 2531 
                 O 
                 ASP 
                 D 
                 4 
                 22.517 
                 7.130 
                 44.958 
                 1.00 
                 43.45 
                 O 
               
               
                 ATOM 
                 2532 
                 N 
                 GLN 
                 D 
                 5 
                 23.051 
                 4.944 
                 45.176 
                 1.00 
                 42.32 
                 N 
               
               
                 ATOM 
                 2533 
                 CA 
                 GLN 
                 D 
                 5 
                 21.927 
                 4.460 
                 44.372 
                 1.00 
                 41.43 
                 C 
               
               
                 ATOM 
                 2534 
                 CB 
                 GLN 
                 D 
                 5 
                 22.409 
                 3.374 
                 43.385 
                 1.00 
                 41.53 
                 C 
               
               
                 ATOM 
                 2535 
                 CG 
                 GLN 
                 D 
                 5 
                 21.300 
                 2.779 
                 42.500 
                 1.00 
                 40.66 
                 C 
               
               
                 ATOM 
                 2536 
                 CD 
                 GLN 
                 D 
                 5 
                 21.731 
                 1.644 
                 41.584 
                 1.00 
                 40.39 
                 C 
               
               
                 ATOM 
                 2537 
                 OE1 
                 GLN 
                 D 
                 5 
                 20.885 
                 0.938 
                 41.081 
                 1.00 
                 40.73 
                 O 
               
               
                 ATOM 
                 2538 
                 NE2 
                 GLN 
                 D 
                 5 
                 23.029 
                 1.467 
                 41.362 
                 1.00 
                 39.34 
                 N 
               
               
                 ATOM 
                 2539 
                 C 
                 GLN 
                 D 
                 5 
                 20.789 
                 3.935 
                 45.253 
                 1.00 
                 41.27 
                 C 
               
               
                 ATOM 
                 2540 
                 O 
                 GLN 
                 D 
                 5 
                 21.027 
                 3.140 
                 46.160 
                 1.00 
                 41.45 
                 O 
               
               
                 ATOM 
                 2541 
                 N 
                 THR 
                 D 
                 6 
                 19.564 
                 4.389 
                 44.996 
                 1.00 
                 40.95 
                 N 
               
               
                 ATOM 
                 2542 
                 CA 
                 THR 
                 D 
                 6 
                 18.367 
                 3.871 
                 45.687 
                 1.00 
                 41.01 
                 C 
               
               
                 ATOM 
                 2543 
                 CB 
                 THR 
                 D 
                 6 
                 17.824 
                 4.824 
                 46.783 
                 1.00 
                 40.94 
                 C 
               
               
                 ATOM 
                 2544 
                 OG1 
                 THR 
                 D 
                 6 
                 17.629 
                 6.131 
                 46.236 
                 1.00 
                 40.98 
                 O 
               
               
                 ATOM 
                 2545 
                 CG2 
                 THR 
                 D 
                 6 
                 18.770 
                 4.899 
                 47.984 
                 1.00 
                 41.61 
                 C 
               
               
                 ATOM 
                 2546 
                 C 
                 THR 
                 D 
                 6 
                 17.236 
                 3.649 
                 44.699 
                 1.00 
                 41.11 
                 C 
               
               
                 ATOM 
                 2547 
                 O 
                 THR 
                 D 
                 6 
                 17.199 
                 4.313 
                 43.654 
                 1.00 
                 41.48 
                 O 
               
               
                 ATOM 
                 2548 
                 N 
                 PRO 
                 D 
                 7 
                 16.303 
                 2.724 
                 45.022 
                 1.00 
                 40.93 
                 N 
               
               
                 ATOM 
                 2549 
                 CA 
                 PRO 
                 D 
                 7 
                 16.351 
                 1.883 
                 46.205 
                 1.00 
                 40.58 
                 C 
               
               
                 ATOM 
                 2550 
                 CB 
                 PRO 
                 D 
                 7 
                 14.889 
                 1.449 
                 46.374 
                 1.00 
                 40.12 
                 C 
               
               
                 ATOM 
                 2551 
                 CG 
                 PRO 
                 D 
                 7 
                 14.425 
                 1.292 
                 45.019 
                 1.00 
                 40.41 
                 C 
               
               
                 ATOM 
                 2552 
                 CD 
                 PRO 
                 D 
                 7 
                 15.090 
                 2.435 
                 44.234 
                 1.00 
                 40.87 
                 C 
               
               
                 ATOM 
                 2553 
                 C 
                 PRO 
                 D 
                 7 
                 17.252 
                 0.669 
                 45.987 
                 1.00 
                 40.46 
                 C 
               
               
                 ATOM 
                 2554 
                 O 
                 PRO 
                 D 
                 7 
                 17.582 
                 0.319 
                 44.854 
                 1.00 
                 40.53 
                 O 
               
               
                 ATOM 
                 2555 
                 N 
                 ARG 
                 D 
                 8 
                 17.633 
                 0.048 
                 47.093 
                 1.00 
                 40.39 
                 N 
               
               
                 ATOM 
                 2556 
                 CA 
                 ARG 
                 D 
                 8 
                 18.525 
                 −1.089 
                 47.134 
                 1.00 
                 40.01 
                 C 
               
               
                 ATOM 
                 2557 
                 CB 
                 ARG 
                 D 
                 8 
                 18.900 
                 −1.298 
                 48.590 
                 1.00 
                 39.76 
                 C 
               
               
                 ATOM 
                 2558 
                 CG 
                 ARG 
                 D 
                 8 
                 20.053 
                 −2.176 
                 48.842 
                 1.00 
                 39.97 
                 C 
               
               
                 ATOM 
                 2559 
                 CD 
                 ARG 
                 D 
                 8 
                 20.407 
                 −2.076 
                 50.299 
                 1.00 
                 42.10 
                 C 
               
               
                 ATOM 
                 2560 
                 NE 
                 ARG 
                 D 
                 8 
                 19.339 
                 −2.586 
                 51.160 
                 1.00 
                 42.46 
                 N 
               
               
                 ATOM 
                 2561 
                 CZ 
                 ARG 
                 D 
                 8 
                 19.409 
                 −2.597 
                 52.485 
                 1.00 
                 43.23 
                 C 
               
               
                 ATOM 
                 2562 
                 NH1 
                 ARG 
                 D 
                 8 
                 20.498 
                 −2.134 
                 53.081 
                 1.00 
                 44.37 
                 N 
               
               
                 ATOM 
                 2563 
                 NH2 
                 ARG 
                 D 
                 8 
                 18.413 
                 −3.086 
                 53.215 
                 1.00 
                 43.34 
                 N 
               
               
                 ATOM 
                 2564 
                 C 
                 ARG 
                 D 
                 8 
                 17.789 
                 −2.303 
                 46.598 
                 1.00 
                 39.86 
                 C 
               
               
                 ATOM 
                 2565 
                 O 
                 ARG 
                 D 
                 8 
                 18.333 
                 −3.081 
                 45.830 
                 1.00 
                 39.97 
                 O 
               
               
                 ATOM 
                 2566 
                 N 
                 SER 
                 D 
                 9 
                 16.543 
                 −2.452 
                 47.026 
                 1.00 
                 39.86 
                 N 
               
               
                 ATOM 
                 2567 
                 CA 
                 SER 
                 D 
                 9 
                 15.663 
                 −3.511 
                 46.557 
                 1.00 
                 39.98 
                 C 
               
               
                 ATOM 
                 2568 
                 CB 
                 SER 
                 D 
                 9 
                 15.726 
                 −4.729 
                 47.481 
                 1.00 
                 39.97 
                 C 
               
               
                 ATOM 
                 2569 
                 OG 
                 SER 
                 D 
                 9 
                 14.958 
                 −4.536 
                 48.652 
                 1.00 
                 39.70 
                 O 
               
               
                 ATOM 
                 2570 
                 C 
                 SER 
                 D 
                 9 
                 14.240 
                 −2.982 
                 46.491 
                 1.00 
                 39.96 
                 C 
               
               
                 ATOM 
                 2571 
                 O 
                 SER 
                 D 
                 9 
                 13.845 
                 −2.127 
                 47.288 
                 1.00 
                 39.56 
                 O 
               
               
                 ATOM 
                 2572 
                 N 
                 VAL 
                 D 
                 10 
                 13.480 
                 −3.485 
                 45.529 
                 1.00 
                 40.04 
                 N 
               
               
                 ATOM 
                 2573 
                 CA 
                 VAL 
                 D 
                 10 
                 12.106 
                 −3.059 
                 45.352 
                 1.00 
                 40.38 
                 C 
               
               
                 ATOM 
                 2574 
                 CB 
                 VAL 
                 D 
                 10 
                 12.034 
                 −1.736 
                 44.553 
                 1.00 
                 40.44 
                 C 
               
               
                 ATOM 
                 2575 
                 CG1 
                 VAL 
                 D 
                 10 
                 12.452 
                 −1.947 
                 43.106 
                 1.00 
                 40.88 
                 C 
               
               
                 ATOM 
                 2576 
                 CG2 
                 VAL 
                 D 
                 10 
                 10.643 
                 −1.117 
                 44.642 
                 1.00 
                 40.75 
                 C 
               
               
                 ATOM 
                 2577 
                 C 
                 VAL 
                 D 
                 10 
                 11.319 
                 −4.173 
                 44.665 
                 1.00 
                 40.45 
                 C 
               
               
                 ATOM 
                 2578 
                 O 
                 VAL 
                 D 
                 10 
                 11.888 
                 −4.981 
                 43.919 
                 1.00 
                 40.68 
                 O 
               
               
                 ATOM 
                 2579 
                 N 
                 THR 
                 D 
                 11 
                 10.021 
                 −4.245 
                 44.932 
                 1.00 
                 40.08 
                 N 
               
               
                 ATOM 
                 2580 
                 CA 
                 THR 
                 D 
                 11 
                 9.202 
                 −5.202 
                 44.212 
                 1.00 
                 40.05 
                 C 
               
               
                 ATOM 
                 2581 
                 CB 
                 THR 
                 D 
                 11 
                 8.863 
                 −6.446 
                 45.065 
                 1.00 
                 39.92 
                 C 
               
               
                 ATOM 
                 2582 
                 OG1 
                 THR 
                 D 
                 11 
                 7.702 
                 −7.098 
                 44.549 
                 1.00 
                 39.40 
                 O 
               
               
                 ATOM 
                 2583 
                 CG2 
                 THR 
                 D 
                 11 
                 8.615 
                 −6.066 
                 46.497 
                 1.00 
                 41.25 
                 C 
               
               
                 ATOM 
                 2584 
                 C 
                 THR 
                 D 
                 11 
                 7.981 
                 −4.526 
                 43.622 
                 1.00 
                 40.02 
                 C 
               
               
                 ATOM 
                 2585 
                 O 
                 THR 
                 D 
                 11 
                 7.228 
                 −3.871 
                 44.327 
                 1.00 
                 40.41 
                 O 
               
               
                 ATOM 
                 2586 
                 N 
                 LYS 
                 D 
                 12 
                 7.815 
                 −4.662 
                 42.312 
                 1.00 
                 40.23 
                 N 
               
               
                 ATOM 
                 2587 
                 CA 
                 LYS 
                 D 
                 12 
                 6.727 
                 −4.003 
                 41.595 
                 1.00 
                 40.27 
                 C 
               
               
                 ATOM 
                 2588 
                 CB 
                 LYS 
                 D 
                 12 
                 7.298 
                 −3.086 
                 40.521 
                 1.00 
                 39.94 
                 C 
               
               
                 ATOM 
                 2589 
                 CG 
                 LYS 
                 D 
                 12 
                 8.109 
                 −1.918 
                 41.063 
                 1.00 
                 39.68 
                 C 
               
               
                 ATOM 
                 2590 
                 CD 
                 LYS 
                 D 
                 12 
                 7.202 
                 −0.867 
                 41.722 
                 1.00 
                 39.52 
                 C 
               
               
                 ATOM 
                 2591 
                 CE 
                 LYS 
                 D 
                 12 
                 7.858 
                 0.503 
                 41.808 
                 1.00 
                 38.17 
                 C 
               
               
                 ATOM 
                 2592 
                 NZ 
                 LYS 
                 D 
                 12 
                 7.254 
                 1.335 
                 42.866 
                 1.00 
                 36.86 
                 N 
               
               
                 ATOM 
                 2593 
                 C 
                 LYS 
                 D 
                 12 
                 5.831 
                 −5.056 
                 40.965 
                 1.00 
                 40.58 
                 C 
               
               
                 ATOM 
                 2594 
                 O 
                 LYS 
                 D 
                 12 
                 6.268 
                 −6.194 
                 40.790 
                 1.00 
                 41.22 
                 O 
               
               
                 ATOM 
                 2595 
                 N 
                 GLU 
                 D 
                 13 
                 4.587 
                 −4.696 
                 40.645 
                 1.00 
                 40.41 
                 N 
               
               
                 ATOM 
                 2596 
                 CA 
                 GLU 
                 D 
                 13 
                 3.679 
                 −5.590 
                 39.909 
                 1.00 
                 40.35 
                 C 
               
               
                 ATOM 
                 2597 
                 CB 
                 GLU 
                 D 
                 13 
                 2.225 
                 −5.341 
                 40.311 
                 1.00 
                 40.65 
                 C 
               
               
                 ATOM 
                 2598 
                 CG 
                 GLU 
                 D 
                 13 
                 1.969 
                 −5.174 
                 41.814 
                 1.00 
                 43.08 
                 C 
               
               
                 ATOM 
                 2599 
                 CD 
                 GLU 
                 D 
                 13 
                 1.647 
                 −6.484 
                 42.499 
                 1.00 
                 47.17 
                 C 
               
               
                 ATOM 
                 2600 
                 OE1 
                 GLU 
                 D 
                 13 
                 1.336 
                 −6.478 
                 43.720 
                 1.00 
                 48.20 
                 O 
               
               
                 ATOM 
                 2601 
                 OE2 
                 GLU 
                 D 
                 13 
                 1.706 
                 −7.529 
                 41.808 
                 1.00 
                 49.59 
                 O 
               
               
                 ATOM 
                 2602 
                 C 
                 GLU 
                 D 
                 13 
                 3.832 
                 −5.363 
                 38.400 
                 1.00 
                 39.74 
                 C 
               
               
                 ATOM 
                 2603 
                 O 
                 GLU 
                 D 
                 13 
                 4.165 
                 −4.257 
                 37.979 
                 1.00 
                 40.12 
                 O 
               
               
                 ATOM 
                 2604 
                 N 
                 THR 
                 D 
                 14 
                 3.605 
                 −6.407 
                 37.598 
                 1.00 
                 38.94 
                 N 
               
               
                 ATOM 
                 2605 
                 CA 
                 THR 
                 D 
                 14 
                 3.528 
                 −6.298 
                 36.137 
                 1.00 
                 38.18 
                 C 
               
               
                 ATOM 
                 2606 
                 CB 
                 THR 
                 D 
                 14 
                 2.909 
                 −7.588 
                 35.497 
                 1.00 
                 38.05 
                 C 
               
               
                 ATOM 
                 2607 
                 OG1 
                 THR 
                 D 
                 14 
                 3.918 
                 −8.583 
                 35.345 
                 1.00 
                 37.69 
                 O 
               
               
                 ATOM 
                 2608 
                 CG2 
                 THR 
                 D 
                 14 
                 2.344 
                 −7.322 
                 34.125 
                 1.00 
                 38.04 
                 C 
               
               
                 ATOM 
                 2609 
                 C 
                 THR 
                 D 
                 14 
                 2.702 
                 −5.071 
                 35.754 
                 1.00 
                 38.15 
                 C 
               
               
                 ATOM 
                 2610 
                 O 
                 THR 
                 D 
                 14 
                 1.628 
                 −4.827 
                 36.318 
                 1.00 
                 38.34 
                 O 
               
               
                 ATOM 
                 2611 
                 N 
                 GLY 
                 D 
                 15 
                 3.201 
                 −4.294 
                 34.804 
                 1.00 
                 37.78 
                 N 
               
               
                 ATOM 
                 2612 
                 CA 
                 GLY 
                 D 
                 15 
                 2.475 
                 −3.124 
                 34.362 
                 1.00 
                 38.18 
                 C 
               
               
                 ATOM 
                 2613 
                 C 
                 GLY 
                 D 
                 15 
                 2.970 
                 −1.835 
                 34.984 
                 1.00 
                 38.45 
                 C 
               
               
                 ATOM 
                 2614 
                 O 
                 GLY 
                 D 
                 15 
                 3.058 
                 −0.818 
                 34.305 
                 1.00 
                 38.92 
                 O 
               
               
                 ATOM 
                 2615 
                 N 
                 GLU 
                 D 
                 16 
                 3.302 
                 −1.866 
                 36.269 
                 1.00 
                 38.44 
                 N 
               
               
                 ATOM 
                 2616 
                 CA 
                 GLU 
                 D 
                 16 
                 3.815 
                 −0.684 
                 36.957 
                 1.00 
                 38.61 
                 C 
               
               
                 ATOM 
                 2617 
                 CB 
                 GLU 
                 D 
                 16 
                 3.957 
                 −0.971 
                 38.448 
                 1.00 
                 38.77 
                 C 
               
               
                 ATOM 
                 2618 
                 CG 
                 GLU 
                 D 
                 16 
                 2.671 
                 −1.434 
                 39.101 
                 1.00 
                 39.56 
                 C 
               
               
                 ATOM 
                 2619 
                 CD 
                 GLU 
                 D 
                 16 
                 2.848 
                 −1.834 
                 40.546 
                 1.00 
                 40.65 
                 C 
               
               
                 ATOM 
                 2620 
                 OE1 
                 GLU 
                 D 
                 16 
                 3.990 
                 −2.076 
                 40.972 
                 1.00 
                 41.80 
                 O 
               
               
                 ATOM 
                 2621 
                 OE2 
                 GLU 
                 D 
                 16 
                 1.831 
                 −1.915 
                 41.264 
                 1.00 
                 42.46 
                 O 
               
               
                 ATOM 
                 2622 
                 C 
                 GLU 
                 D 
                 16 
                 5.161 
                 −0.247 
                 36.396 
                 1.00 
                 38.77 
                 C 
               
               
                 ATOM 
                 2623 
                 O 
                 GLU 
                 D 
                 16 
                 5.758 
                 −0.944 
                 35.574 
                 1.00 
                 38.73 
                 O 
               
               
                 ATOM 
                 2624 
                 N 
                 SER 
                 D 
                 17 
                 5.638 
                 0.910 
                 36.847 
                 1.00 
                 39.08 
                 N 
               
               
                 ATOM 
                 2625 
                 CA 
                 SER 
                 D 
                 17 
                 6.974 
                 1.402 
                 36.472 
                 1.00 
                 39.29 
                 C 
               
               
                 ATOM 
                 2626 
                 CB 
                 SER 
                 D 
                 17 
                 6.871 
                 2.684 
                 35.627 
                 1.00 
                 39.33 
                 C 
               
               
                 ATOM 
                 2627 
                 OG 
                 SER 
                 D 
                 17 
                 6.001 
                 3.630 
                 36.215 
                 1.00 
                 39.01 
                 O 
               
               
                 ATOM 
                 2628 
                 C 
                 SER 
                 D 
                 17 
                 7.920 
                 1.603 
                 37.664 
                 1.00 
                 39.41 
                 C 
               
               
                 ATOM 
                 2629 
                 O 
                 SER 
                 D 
                 17 
                 7.495 
                 1.628 
                 38.822 
                 1.00 
                 39.97 
                 O 
               
               
                 ATOM 
                 2630 
                 N 
                 LEU 
                 D 
                 18 
                 9.204 
                 1.764 
                 37.373 
                 1.00 
                 39.54 
                 N 
               
               
                 ATOM 
                 2631 
                 CA 
                 LEU 
                 D 
                 18 
                 10.223 
                 1.787 
                 38.410 
                 1.00 
                 39.59 
                 C 
               
               
                 ATOM 
                 2632 
                 CB 
                 LEU 
                 D 
                 18 
                 10.987 
                 0.468 
                 38.377 
                 1.00 
                 39.57 
                 C 
               
               
                 ATOM 
                 2633 
                 CG 
                 LEU 
                 D 
                 18 
                 12.098 
                 0.062 
                 39.357 
                 1.00 
                 39.70 
                 C 
               
               
                 ATOM 
                 2634 
                 CD1 
                 LEU 
                 D 
                 18 
                 13.508 
                 0.127 
                 38.738 
                 1.00 
                 39.39 
                 C 
               
               
                 ATOM 
                 2635 
                 CD2 
                 LEU 
                 D 
                 18 
                 11.996 
                 0.804 
                 40.688 
                 1.00 
                 39.58 
                 C 
               
               
                 ATOM 
                 2636 
                 C 
                 LEU 
                 D 
                 18 
                 11.172 
                 2.963 
                 38.222 
                 1.00 
                 39.76 
                 C 
               
               
                 ATOM 
                 2637 
                 O 
                 LEU 
                 D 
                 18 
                 11.634 
                 3.225 
                 37.116 
                 1.00 
                 39.81 
                 O 
               
               
                 ATOM 
                 2638 
                 N 
                 THR 
                 D 
                 19 
                 11.450 
                 3.681 
                 39.304 
                 1.00 
                 39.94 
                 N 
               
               
                 ATOM 
                 2639 
                 CA 
                 THR 
                 D 
                 19 
                 12.433 
                 4.755 
                 39.250 
                 1.00 
                 40.07 
                 C 
               
               
                 ATOM 
                 2640 
                 CB 
                 THR 
                 D 
                 19 
                 11.777 
                 6.130 
                 39.561 
                 1.00 
                 39.79 
                 C 
               
               
                 ATOM 
                 2641 
                 OG1 
                 THR 
                 D 
                 19 
                 10.617 
                 6.287 
                 38.738 
                 1.00 
                 39.06 
                 O 
               
               
                 ATOM 
                 2642 
                 CG2 
                 THR 
                 D 
                 19 
                 12.730 
                 7.279 
                 39.253 
                 1.00 
                 39.70 
                 C 
               
               
                 ATOM 
                 2643 
                 C 
                 THR 
                 D 
                 19 
                 13.671 
                 4.441 
                 40.125 
                 1.00 
                 40.27 
                 C 
               
               
                 ATOM 
                 2644 
                 O 
                 THR 
                 D 
                 19 
                 13.560 
                 4.176 
                 41.308 
                 1.00 
                 40.53 
                 O 
               
               
                 ATOM 
                 2645 
                 N 
                 ILE 
                 D 
                 20 
                 14.842 
                 4.427 
                 39.512 
                 1.00 
                 40.71 
                 N 
               
               
                 ATOM 
                 2646 
                 CA 
                 ILE 
                 D 
                 20 
                 16.089 
                 4.283 
                 40.245 
                 1.00 
                 41.31 
                 C 
               
               
                 ATOM 
                 2647 
                 CB 
                 ILE 
                 D 
                 20 
                 17.049 
                 3.257 
                 39.606 
                 1.00 
                 41.02 
                 C 
               
               
                 ATOM 
                 2648 
                 CG1 
                 ILE 
                 D 
                 20 
                 16.387 
                 1.881 
                 39.544 
                 1.00 
                 41.44 
                 C 
               
               
                 ATOM 
                 2649 
                 CD1 
                 ILE 
                 D 
                 20 
                 17.149 
                 0.833 
                 38.810 
                 1.00 
                 40.40 
                 C 
               
               
                 ATOM 
                 2650 
                 CG2 
                 ILE 
                 D 
                 20 
                 18.309 
                 3.165 
                 40.424 
                 1.00 
                 41.51 
                 C 
               
               
                 ATOM 
                 2651 
                 C 
                 ILE 
                 D 
                 20 
                 16.757 
                 5.637 
                 40.264 
                 1.00 
                 41.93 
                 C 
               
               
                 ATOM 
                 2652 
                 O 
                 ILE 
                 D 
                 20 
                 16.885 
                 6.291 
                 39.231 
                 1.00 
                 41.92 
                 O 
               
               
                 ATOM 
                 2653 
                 N 
                 ASN 
                 D 
                 21 
                 17.181 
                 6.046 
                 41.448 
                 1.00 
                 42.92 
                 N 
               
               
                 ATOM 
                 2654 
                 CA 
                 ASN 
                 D 
                 21 
                 17.777 
                 7.347 
                 41.653 
                 1.00 
                 43.80 
                 C 
               
               
                 ATOM 
                 2655 
                 CB 
                 ASN 
                 D 
                 21 
                 17.076 
                 8.052 
                 42.802 
                 1.00 
                 44.06 
                 C 
               
               
                 ATOM 
                 2656 
                 CG 
                 ASN 
                 D 
                 21 
                 15.876 
                 8.846 
                 42.345 
                 1.00 
                 45.31 
                 C 
               
               
                 ATOM 
                 2657 
                 OD1 
                 ASN 
                 D 
                 21 
                 14.749 
                 8.618 
                 42.794 
                 1.00 
                 46.50 
                 O 
               
               
                 ATOM 
                 2658 
                 ND2 
                 ASN 
                 D 
                 21 
                 16.108 
                 9.790 
                 41.439 
                 1.00 
                 47.41 
                 N 
               
               
                 ATOM 
                 2659 
                 C 
                 ASN 
                 D 
                 21 
                 19.242 
                 7.193 
                 41.974 
                 1.00 
                 44.17 
                 C 
               
               
                 ATOM 
                 2660 
                 O 
                 ASN 
                 D 
                 21 
                 19.605 
                 6.366 
                 42.809 
                 1.00 
                 44.37 
                 O 
               
               
                 ATOM 
                 2661 
                 N 
                 CYS 
                 D 
                 22 
                 20.077 
                 7.977 
                 41.299 
                 1.00 
                 44.32 
                 N 
               
               
                 ATOM 
                 2662 
                 CA 
                 CYS 
                 D 
                 22 
                 21.512 
                 7.971 
                 41.546 
                 1.00 
                 44.68 
                 C 
               
               
                 ATOM 
                 2663 
                 CB 
                 CYS 
                 D 
                 22 
                 22.230 
                 7.277 
                 40.411 
                 1.00 
                 44.52 
                 C 
               
               
                 ATOM 
                 2664 
                 SG 
                 CYS 
                 D 
                 22 
                 21.830 
                 5.539 
                 40.404 
                 1.00 
                 47.27 
                 S 
               
               
                 ATOM 
                 2665 
                 C 
                 CYS 
                 D 
                 22 
                 22.081 
                 9.369 
                 41.775 
                 1.00 
                 44.46 
                 C 
               
               
                 ATOM 
                 2666 
                 O 
                 CYS 
                 D 
                 22 
                 21.656 
                 10.338 
                 41.146 
                 1.00 
                 45.03 
                 O 
               
               
                 ATOM 
                 2667 
                 N 
                 ALA 
                 D 
                 23 
                 23.031 
                 9.484 
                 42.690 
                 1.00 
                 43.59 
                 N 
               
               
                 ATOM 
                 2668 
                 CA 
                 ALA 
                 D 
                 23 
                 23.610 
                 10.769 
                 42.961 
                 1.00 
                 43.17 
                 C 
               
               
                 ATOM 
                 2669 
                 CB 
                 ALA 
                 D 
                 23 
                 22.952 
                 11.383 
                 44.181 
                 1.00 
                 43.11 
                 C 
               
               
                 ATOM 
                 2670 
                 C 
                 ALA 
                 D 
                 23 
                 25.104 
                 10.613 
                 43.162 
                 1.00 
                 42.94 
                 C 
               
               
                 ATOM 
                 2671 
                 O 
                 ALA 
                 D 
                 23 
                 25.533 
                 9.852 
                 44.016 
                 1.00 
                 43.43 
                 O 
               
               
                 ATOM 
                 2672 
                 N 
                 LEU 
                 D 
                 24 
                 25.893 
                 11.319 
                 42.366 
                 1.00 
                 42.39 
                 N 
               
               
                 ATOM 
                 2673 
                 CA 
                 LEU 
                 D 
                 24 
                 27.329 
                 11.290 
                 42.510 
                 1.00 
                 42.25 
                 C 
               
               
                 ATOM 
                 2674 
                 CB 
                 LEU 
                 D 
                 24 
                 28.014 
                 11.786 
                 41.226 
                 1.00 
                 41.99 
                 C 
               
               
                 ATOM 
                 2675 
                 CG 
                 LEU 
                 D 
                 24 
                 29.546 
                 11.743 
                 41.100 
                 1.00 
                 41.36 
                 C 
               
               
                 ATOM 
                 2676 
                 CD1 
                 LEU 
                 D 
                 24 
                 29.985 
                 12.221 
                 39.726 
                 1.00 
                 39.92 
                 C 
               
               
                 ATOM 
                 2677 
                 CD2 
                 LEU 
                 D 
                 24 
                 30.137 
                 10.363 
                 41.416 
                 1.00 
                 40.07 
                 C 
               
               
                 ATOM 
                 2678 
                 C 
                 LEU 
                 D 
                 24 
                 27.694 
                 12.139 
                 43.726 
                 1.00 
                 42.66 
                 C 
               
               
                 ATOM 
                 2679 
                 O 
                 LEU 
                 D 
                 24 
                 27.288 
                 13.293 
                 43.825 
                 1.00 
                 42.82 
                 O 
               
               
                 ATOM 
                 2680 
                 N 
                 LYS 
                 D 
                 25 
                 28.459 
                 11.549 
                 44.643 
                 1.00 
                 43.03 
                 N 
               
               
                 ATOM 
                 2681 
                 CA 
                 LYS 
                 D 
                 25 
                 28.717 
                 12.120 
                 45.961 
                 1.00 
                 43.39 
                 C 
               
               
                 ATOM 
                 2682 
                 CB 
                 LYS 
                 D 
                 25 
                 28.177 
                 11.174 
                 47.035 
                 1.00 
                 43.45 
                 C 
               
               
                 ATOM 
                 2683 
                 CG 
                 LYS 
                 D 
                 25 
                 26.648 
                 11.033 
                 47.048 
                 1.00 
                 45.23 
                 C 
               
               
                 ATOM 
                 2684 
                 CD 
                 LYS 
                 D 
                 25 
                 26.001 
                 11.935 
                 48.110 
                 1.00 
                 48.02 
                 C 
               
               
                 ATOM 
                 2685 
                 CE 
                 LYS 
                 D 
                 25 
                 24.522 
                 12.163 
                 47.822 
                 1.00 
                 49.24 
                 C 
               
               
                 ATOM 
                 2686 
                 NZ 
                 LYS 
                 D 
                 25 
                 24.301 
                 13.275 
                 46.839 
                 1.00 
                 49.27 
                 N 
               
               
                 ATOM 
                 2687 
                 C 
                 LYS 
                 D 
                 25 
                 30.211 
                 12.354 
                 46.178 
                 1.00 
                 43.55 
                 C 
               
               
                 ATOM 
                 2688 
                 O 
                 LYS 
                 D 
                 25 
                 31.033 
                 11.601 
                 45.656 
                 1.00 
                 43.60 
                 O 
               
               
                 ATOM 
                 2689 
                 N 
                 ASN 
                 D 
                 26 
                 30.549 
                 13.387 
                 46.961 
                 1.00 
                 43.74 
                 N 
               
               
                 ATOM 
                 2690 
                 CA 
                 ASN 
                 D 
                 26 
                 31.936 
                 13.792 
                 47.222 
                 1.00 
                 43.66 
                 C 
               
               
                 ATOM 
                 2691 
                 CB 
                 ASN 
                 D 
                 26 
                 32.611 
                 12.840 
                 48.205 
                 1.00 
                 44.13 
                 C 
               
               
                 ATOM 
                 2692 
                 CG 
                 ASN 
                 D 
                 26 
                 31.987 
                 12.885 
                 49.585 
                 1.00 
                 45.64 
                 C 
               
               
                 ATOM 
                 2693 
                 OD1 
                 ASN 
                 D 
                 26 
                 31.277 
                 11.955 
                 49.994 
                 1.00 
                 46.22 
                 O 
               
               
                 ATOM 
                 2694 
                 ND2 
                 ASN 
                 D 
                 26 
                 32.248 
                 13.975 
                 50.318 
                 1.00 
                 47.54 
                 N 
               
               
                 ATOM 
                 2695 
                 C 
                 ASN 
                 D 
                 26 
                 32.743 
                 13.883 
                 45.941 
                 1.00 
                 43.44 
                 C 
               
               
                 ATOM 
                 2696 
                 O 
                 ASN 
                 D 
                 26 
                 33.828 
                 13.314 
                 45.828 
                 1.00 
                 43.10 
                 O 
               
               
                 ATOM 
                 2697 
                 N 
                 ALA 
                 D 
                 27 
                 32.181 
                 14.601 
                 44.975 
                 1.00 
                 43.45 
                 N 
               
               
                 ATOM 
                 2698 
                 CA 
                 ALA 
                 D 
                 27 
                 32.735 
                 14.706 
                 43.637 
                 1.00 
                 43.52 
                 C 
               
               
                 ATOM 
                 2699 
                 CB 
                 ALA 
                 D 
                 27 
                 31.751 
                 14.115 
                 42.613 
                 1.00 
                 43.25 
                 C 
               
               
                 ATOM 
                 2700 
                 C 
                 ALA 
                 D 
                 27 
                 33.016 
                 16.171 
                 43.334 
                 1.00 
                 43.60 
                 C 
               
               
                 ATOM 
                 2701 
                 O 
                 ALA 
                 D 
                 27 
                 32.096 
                 16.926 
                 43.022 
                 1.00 
                 44.03 
                 O 
               
               
                 ATOM 
                 2702 
                 N 
                 ALA 
                 D 
                 28 
                 34.281 
                 16.576 
                 43.429 
                 1.00 
                 43.66 
                 N 
               
               
                 ATOM 
                 2703 
                 CA 
                 ALA 
                 D 
                 28 
                 34.687 
                 17.981 
                 43.175 
                 1.00 
                 43.69 
                 C 
               
               
                 ATOM 
                 2704 
                 CB 
                 ALA 
                 D 
                 28 
                 35.955 
                 18.348 
                 44.014 
                 1.00 
                 43.65 
                 C 
               
               
                 ATOM 
                 2705 
                 C 
                 ALA 
                 D 
                 28 
                 34.909 
                 18.282 
                 41.678 
                 1.00 
                 43.33 
                 C 
               
               
                 ATOM 
                 2706 
                 O 
                 ALA 
                 D 
                 28 
                 35.829 
                 19.028 
                 41.310 
                 1.00 
                 43.35 
                 O 
               
               
                 ATOM 
                 2707 
                 N 
                 ASP 
                 D 
                 29 
                 34.044 
                 17.709 
                 40.837 
                 1.00 
                 42.76 
                 N 
               
               
                 ATOM 
                 2708 
                 CA 
                 ASP 
                 D 
                 29 
                 34.268 
                 17.592 
                 39.389 
                 1.00 
                 42.30 
                 C 
               
               
                 ATOM 
                 2709 
                 CB 
                 ASP 
                 D 
                 29 
                 35.440 
                 16.633 
                 39.099 
                 1.00 
                 42.53 
                 C 
               
               
                 ATOM 
                 2710 
                 CG 
                 ASP 
                 D 
                 29 
                 35.551 
                 15.492 
                 40.124 
                 1.00 
                 43.66 
                 C 
               
               
                 ATOM 
                 2711 
                 OD1 
                 ASP 
                 D 
                 29 
                 34.729 
                 14.549 
                 40.059 
                 1.00 
                 43.69 
                 O 
               
               
                 ATOM 
                 2712 
                 OD2 
                 ASP 
                 D 
                 29 
                 36.465 
                 15.537 
                 40.993 
                 1.00 
                 44.75 
                 O 
               
               
                 ATOM 
                 2713 
                 C 
                 ASP 
                 D 
                 29 
                 32.979 
                 17.162 
                 38.661 
                 1.00 
                 41.65 
                 C 
               
               
                 ATOM 
                 2714 
                 O 
                 ASP 
                 D 
                 29 
                 32.044 
                 16.666 
                 39.294 
                 1.00 
                 41.73 
                 O 
               
               
                 ATOM 
                 2715 
                 N 
                 ASP 
                 D 
                 30 
                 32.942 
                 17.338 
                 37.337 
                 1.00 
                 40.69 
                 N 
               
               
                 ATOM 
                 2716 
                 CA 
                 ASP 
                 D 
                 30 
                 31.681 
                 17.393 
                 36.577 
                 1.00 
                 39.53 
                 C 
               
               
                 ATOM 
                 2717 
                 CB 
                 ASP 
                 D 
                 30 
                 31.845 
                 18.356 
                 35.405 
                 1.00 
                 39.73 
                 C 
               
               
                 ATOM 
                 2718 
                 CG 
                 ASP 
                 D 
                 30 
                 31.748 
                 19.795 
                 35.824 
                 1.00 
                 39.85 
                 C 
               
               
                 ATOM 
                 2719 
                 OD1 
                 ASP 
                 D 
                 30 
                 30.886 
                 20.105 
                 36.669 
                 1.00 
                 41.59 
                 O 
               
               
                 ATOM 
                 2720 
                 OD2 
                 ASP 
                 D 
                 30 
                 32.519 
                 20.618 
                 35.302 
                 1.00 
                 39.35 
                 O 
               
               
                 ATOM 
                 2721 
                 C 
                 ASP 
                 D 
                 30 
                 31.146 
                 16.090 
                 36.022 
                 1.00 
                 38.75 
                 C 
               
               
                 ATOM 
                 2722 
                 O 
                 ASP 
                 D 
                 30 
                 31.856 
                 15.384 
                 35.318 
                 1.00 
                 38.85 
                 O 
               
               
                 ATOM 
                 2723 
                 N 
                 LEU 
                 D 
                 31 
                 29.876 
                 15.803 
                 36.293 
                 1.00 
                 37.73 
                 N 
               
               
                 ATOM 
                 2724 
                 CA 
                 LEU 
                 D 
                 31 
                 29.184 
                 14.694 
                 35.646 
                 1.00 
                 36.84 
                 C 
               
               
                 ATOM 
                 2725 
                 CB 
                 LEU 
                 D 
                 31 
                 27.740 
                 14.595 
                 36.132 
                 1.00 
                 36.24 
                 C 
               
               
                 ATOM 
                 2726 
                 CG 
                 LEU 
                 D 
                 31 
                 27.011 
                 13.284 
                 35.847 
                 1.00 
                 33.49 
                 C 
               
               
                 ATOM 
                 2727 
                 CD1 
                 LEU 
                 D 
                 31 
                 27.607 
                 12.166 
                 36.663 
                 1.00 
                 31.25 
                 C 
               
               
                 ATOM 
                 2728 
                 CD2 
                 LEU 
                 D 
                 31 
                 25.556 
                 13.427 
                 36.163 
                 1.00 
                 30.41 
                 C 
               
               
                 ATOM 
                 2729 
                 C 
                 LEU 
                 D 
                 31 
                 29.209 
                 14.870 
                 34.133 
                 1.00 
                 37.41 
                 C 
               
               
                 ATOM 
                 2730 
                 O 
                 LEU 
                 D 
                 31 
                 28.792 
                 15.918 
                 33.607 
                 1.00 
                 37.39 
                 O 
               
               
                 ATOM 
                 2731 
                 N 
                 GLU 
                 D 
                 32 
                 29.713 
                 13.849 
                 33.441 
                 1.00 
                 37.95 
                 N 
               
               
                 ATOM 
                 2732 
                 CA 
                 GLU 
                 D 
                 32 
                 29.931 
                 13.924 
                 31.995 
                 1.00 
                 38.71 
                 C 
               
               
                 ATOM 
                 2733 
                 CB 
                 GLU 
                 D 
                 32 
                 31.416 
                 13.801 
                 31.645 
                 1.00 
                 39.12 
                 C 
               
               
                 ATOM 
                 2734 
                 CG 
                 GLU 
                 D 
                 32 
                 32.193 
                 15.115 
                 31.740 
                 1.00 
                 41.10 
                 C 
               
               
                 ATOM 
                 2735 
                 CD 
                 GLU 
                 D 
                 32 
                 31.764 
                 16.157 
                 30.685 
                 1.00 
                 44.44 
                 C 
               
               
                 ATOM 
                 2736 
                 OE1 
                 GLU 
                 D 
                 32 
                 32.662 
                 16.820 
                 30.113 
                 1.00 
                 45.38 
                 O 
               
               
                 ATOM 
                 2737 
                 OE2 
                 GLU 
                 D 
                 32 
                 30.539 
                 16.313 
                 30.421 
                 1.00 
                 45.39 
                 O 
               
               
                 ATOM 
                 2738 
                 C 
                 GLU 
                 D 
                 32 
                 29.149 
                 12.895 
                 31.241 
                 1.00 
                 38.85 
                 C 
               
               
                 ATOM 
                 2739 
                 O 
                 GLU 
                 D 
                 32 
                 28.616 
                 13.177 
                 30.188 
                 1.00 
                 39.30 
                 O 
               
               
                 ATOM 
                 2740 
                 N 
                 ARG 
                 D 
                 33 
                 29.058 
                 11.702 
                 31.808 
                 1.00 
                 39.42 
                 N 
               
               
                 ATOM 
                 2741 
                 CA 
                 ARG 
                 D 
                 33 
                 28.430 
                 10.574 
                 31.160 
                 1.00 
                 39.72 
                 C 
               
               
                 ATOM 
                 2742 
                 CB 
                 ARG 
                 D 
                 33 
                 29.499 
                 9.789 
                 30.410 
                 1.00 
                 39.85 
                 C 
               
               
                 ATOM 
                 2743 
                 CG 
                 ARG 
                 D 
                 33 
                 28.985 
                 8.742 
                 29.472 
                 1.00 
                 41.45 
                 C 
               
               
                 ATOM 
                 2744 
                 CD 
                 ARG 
                 D 
                 33 
                 30.062 
                 8.322 
                 28.491 
                 1.00 
                 43.89 
                 C 
               
               
                 ATOM 
                 2745 
                 NE 
                 ARG 
                 D 
                 33 
                 31.197 
                 7.689 
                 29.152 
                 1.00 
                 47.25 
                 N 
               
               
                 ATOM 
                 2746 
                 CZ 
                 ARG 
                 D 
                 33 
                 31.193 
                 6.455 
                 29.661 
                 1.00 
                 49.38 
                 C 
               
               
                 ATOM 
                 2747 
                 NH1 
                 ARG 
                 D 
                 33 
                 32.292 
                 5.974 
                 30.243 
                 1.00 
                 49.45 
                 N 
               
               
                 ATOM 
                 2748 
                 NH2 
                 ARG 
                 D 
                 33 
                 30.099 
                 5.694 
                 29.593 
                 1.00 
                 50.00 
                 N 
               
               
                 ATOM 
                 2749 
                 C 
                 ARG 
                 D 
                 33 
                 27.774 
                 9.727 
                 32.243 
                 1.00 
                 39.94 
                 C 
               
               
                 ATOM 
                 2750 
                 O 
                 ARG 
                 D 
                 33 
                 28.273 
                 9.661 
                 33.356 
                 1.00 
                 39.64 
                 O 
               
               
                 ATOM 
                 2751 
                 N 
                 THR 
                 D 
                 34 
                 26.638 
                 9.112 
                 31.915 
                 1.00 
                 40.75 
                 N 
               
               
                 ATOM 
                 2752 
                 CA 
                 THR 
                 D 
                 34 
                 25.871 
                 8.276 
                 32.835 
                 1.00 
                 41.14 
                 C 
               
               
                 ATOM 
                 2753 
                 CB 
                 THR 
                 D 
                 34 
                 24.679 
                 9.027 
                 33.461 
                 1.00 
                 40.95 
                 C 
               
               
                 ATOM 
                 2754 
                 OG1 
                 THR 
                 D 
                 34 
                 24.020 
                 9.814 
                 32.468 
                 1.00 
                 41.22 
                 O 
               
               
                 ATOM 
                 2755 
                 CG2 
                 THR 
                 D 
                 34 
                 25.134 
                 9.920 
                 34.570 
                 1.00 
                 41.33 
                 C 
               
               
                 ATOM 
                 2756 
                 C 
                 THR 
                 D 
                 34 
                 25.310 
                 7.031 
                 32.141 
                 1.00 
                 41.81 
                 C 
               
               
                 ATOM 
                 2757 
                 O 
                 THR 
                 D 
                 34 
                 24.571 
                 7.142 
                 31.161 
                 1.00 
                 42.34 
                 O 
               
               
                 ATOM 
                 2758 
                 N 
                 ASP 
                 D 
                 35 
                 25.639 
                 5.850 
                 32.671 
                 1.00 
                 42.29 
                 N 
               
               
                 ATOM 
                 2759 
                 CA 
                 ASP 
                 D 
                 35 
                 25.209 
                 4.573 
                 32.092 
                 1.00 
                 42.11 
                 C 
               
               
                 ATOM 
                 2760 
                 CB 
                 ASP 
                 D 
                 35 
                 26.425 
                 3.829 
                 31.537 
                 1.00 
                 42.03 
                 C 
               
               
                 ATOM 
                 2761 
                 CG 
                 ASP 
                 D 
                 35 
                 26.968 
                 4.499 
                 30.278 
                 1.00 
                 43.56 
                 C 
               
               
                 ATOM 
                 2762 
                 OD1 
                 ASP 
                 D 
                 35 
                 27.842 
                 3.941 
                 29.560 
                 1.00 
                 46.61 
                 O 
               
               
                 ATOM 
                 2763 
                 OD2 
                 ASP 
                 D 
                 35 
                 26.498 
                 5.615 
                 29.983 
                 1.00 
                 44.89 
                 O 
               
               
                 ATOM 
                 2764 
                 C 
                 ASP 
                 D 
                 35 
                 24.354 
                 3.722 
                 33.035 
                 1.00 
                 41.77 
                 C 
               
               
                 ATOM 
                 2765 
                 O 
                 ASP 
                 D 
                 35 
                 24.261 
                 4.011 
                 34.230 
                 1.00 
                 41.58 
                 O 
               
               
                 ATOM 
                 2766 
                 N 
                 TRP 
                 D 
                 36 
                 23.696 
                 2.711 
                 32.472 
                 1.00 
                 41.34 
                 N 
               
               
                 ATOM 
                 2767 
                 CA 
                 TRP 
                 D 
                 36 
                 22.739 
                 1.884 
                 33.202 
                 1.00 
                 41.40 
                 C 
               
               
                 ATOM 
                 2768 
                 CB 
                 TRP 
                 D 
                 36 
                 21.307 
                 2.381 
                 32.986 
                 1.00 
                 40.76 
                 C 
               
               
                 ATOM 
                 2769 
                 CG 
                 TRP 
                 D 
                 36 
                 21.035 
                 3.735 
                 33.560 
                 1.00 
                 39.98 
                 C 
               
               
                 ATOM 
                 2770 
                 CD1 
                 TRP 
                 D 
                 36 
                 21.121 
                 4.928 
                 32.914 
                 1.00 
                 39.38 
                 C 
               
               
                 ATOM 
                 2771 
                 NE1 
                 TRP 
                 D 
                 36 
                 20.809 
                 5.962 
                 33.768 
                 1.00 
                 39.12 
                 N 
               
               
                 ATOM 
                 2772 
                 CE2 
                 TRP 
                 D 
                 36 
                 20.510 
                 5.439 
                 34.996 
                 1.00 
                 39.10 
                 C 
               
               
                 ATOM 
                 2773 
                 CD2 
                 TRP 
                 D 
                 36 
                 20.639 
                 4.035 
                 34.901 
                 1.00 
                 39.48 
                 C 
               
               
                 ATOM 
                 2774 
                 CE3 
                 TRP 
                 D 
                 36 
                 20.366 
                 3.252 
                 36.030 
                 1.00 
                 40.06 
                 C 
               
               
                 ATOM 
                 2775 
                 CZ3 
                 TRP 
                 D 
                 36 
                 19.991 
                 3.894 
                 37.212 
                 1.00 
                 40.06 
                 C 
               
               
                 ATOM 
                 2776 
                 CH2 
                 TRP 
                 D 
                 36 
                 19.874 
                 5.295 
                 37.269 
                 1.00 
                 40.13 
                 C 
               
               
                 ATOM 
                 2777 
                 CZ2 
                 TRP 
                 D 
                 36 
                 20.125 
                 6.080 
                 36.173 
                 1.00 
                 39.66 
                 C 
               
               
                 ATOM 
                 2778 
                 C 
                 TRP 
                 D 
                 36 
                 22.849 
                 0.462 
                 32.690 
                 1.00 
                 41.89 
                 C 
               
               
                 ATOM 
                 2779 
                 O 
                 TRP 
                 D 
                 36 
                 22.709 
                 0.233 
                 31.494 
                 1.00 
                 41.74 
                 O 
               
               
                 ATOM 
                 2780 
                 N 
                 TYR 
                 D 
                 37 
                 23.125 
                 −0.482 
                 33.591 
                 1.00 
                 42.42 
                 N 
               
               
                 ATOM 
                 2781 
                 CA 
                 TYR 
                 D 
                 37 
                 23.262 
                 −1.892 
                 33.219 
                 1.00 
                 42.74 
                 C 
               
               
                 ATOM 
                 2782 
                 CB 
                 TYR 
                 D 
                 37 
                 24.695 
                 −2.390 
                 33.386 
                 1.00 
                 43.39 
                 C 
               
               
                 ATOM 
                 2783 
                 CG 
                 TYR 
                 D 
                 37 
                 25.702 
                 −1.467 
                 32.789 
                 1.00 
                 44.09 
                 C 
               
               
                 ATOM 
                 2784 
                 CD1 
                 TYR 
                 D 
                 37 
                 26.041 
                 −0.301 
                 33.448 
                 1.00 
                 47.02 
                 C 
               
               
                 ATOM 
                 2785 
                 CE1 
                 TYR 
                 D 
                 37 
                 26.962 
                 0.583 
                 32.913 
                 1.00 
                 47.92 
                 C 
               
               
                 ATOM 
                 2786 
                 CZ 
                 TYR 
                 D 
                 37 
                 27.550 
                 0.293 
                 31.705 
                 1.00 
                 45.40 
                 C 
               
               
                 ATOM 
                 2787 
                 OH 
                 TYR 
                 D 
                 37 
                 28.443 
                 1.214 
                 31.238 
                 1.00 
                 46.33 
                 O 
               
               
                 ATOM 
                 2788 
                 CE2 
                 TYR 
                 D 
                 37 
                 27.242 
                 −0.871 
                 31.016 
                 1.00 
                 43.86 
                 C 
               
               
                 ATOM 
                 2789 
                 CD2 
                 TYR 
                 D 
                 37 
                 26.314 
                 −1.746 
                 31.569 
                 1.00 
                 44.21 
                 C 
               
               
                 ATOM 
                 2790 
                 C 
                 TYR 
                 D 
                 37 
                 22.333 
                 −2.758 
                 34.028 
                 1.00 
                 42.45 
                 C 
               
               
                 ATOM 
                 2791 
                 O 
                 TYR 
                 D 
                 37 
                 22.056 
                 −2.467 
                 35.184 
                 1.00 
                 42.79 
                 O 
               
               
                 ATOM 
                 2792 
                 N 
                 ARG 
                 D 
                 38 
                 21.846 
                 −3.817 
                 33.399 
                 1.00 
                 42.06 
                 N 
               
               
                 ATOM 
                 2793 
                 CA 
                 ARG 
                 D 
                 38 
                 20.942 
                 −4.754 
                 34.029 
                 1.00 
                 41.73 
                 C 
               
               
                 ATOM 
                 2794 
                 CB 
                 ARG 
                 D 
                 38 
                 19.524 
                 −4.627 
                 33.446 
                 1.00 
                 41.95 
                 C 
               
               
                 ATOM 
                 2795 
                 CG 
                 ARG 
                 D 
                 38 
                 19.491 
                 −4.486 
                 31.905 
                 1.00 
                 43.17 
                 C 
               
               
                 ATOM 
                 2796 
                 CD 
                 ARG 
                 D 
                 38 
                 18.362 
                 −5.245 
                 31.218 
                 1.00 
                 45.32 
                 C 
               
               
                 ATOM 
                 2797 
                 NE 
                 ARG 
                 D 
                 38 
                 17.039 
                 −4.888 
                 31.732 
                 1.00 
                 48.41 
                 N 
               
               
                 ATOM 
                 2798 
                 CZ 
                 ARG 
                 D 
                 38 
                 15.878 
                 −5.170 
                 31.133 
                 1.00 
                 48.65 
                 C 
               
               
                 ATOM 
                 2799 
                 NH1 
                 ARG 
                 D 
                 38 
                 15.851 
                 −5.819 
                 29.974 
                 1.00 
                 48.23 
                 N 
               
               
                 ATOM 
                 2800 
                 NH2 
                 ARG 
                 D 
                 38 
                 14.736 
                 −4.786 
                 31.697 
                 1.00 
                 48.73 
                 N 
               
               
                 ATOM 
                 2801 
                 C 
                 ARG 
                 D 
                 38 
                 21.486 
                 −6.137 
                 33.744 
                 1.00 
                 41.23 
                 C 
               
               
                 ATOM 
                 2802 
                 O 
                 ARG 
                 D 
                 38 
                 21.930 
                 −6.399 
                 32.625 
                 1.00 
                 40.92 
                 O 
               
               
                 ATOM 
                 2803 
                 N 
                 THR 
                 D 
                 39 
                 21.494 
                 −6.983 
                 34.776 
                 1.00 
                 40.78 
                 N 
               
               
                 ATOM 
                 2804 
                 CA 
                 THR 
                 D 
                 39 
                 21.560 
                 −8.433 
                 34.640 
                 1.00 
                 40.44 
                 C 
               
               
                 ATOM 
                 2805 
                 CB 
                 THR 
                 D 
                 39 
                 22.682 
                 −9.065 
                 35.492 
                 1.00 
                 40.56 
                 C 
               
               
                 ATOM 
                 2806 
                 OG1 
                 THR 
                 D 
                 39 
                 23.930 
                 −8.409 
                 35.236 
                 1.00 
                 40.48 
                 O 
               
               
                 ATOM 
                 2807 
                 CG2 
                 THR 
                 D 
                 39 
                 22.824 
                 −10.534 
                 35.161 
                 1.00 
                 40.93 
                 C 
               
               
                 ATOM 
                 2808 
                 C 
                 THR 
                 D 
                 39 
                 20.201 
                 −8.971 
                 35.094 
                 1.00 
                 39.94 
                 C 
               
               
                 ATOM 
                 2809 
                 O 
                 THR 
                 D 
                 39 
                 19.828 
                 −8.841 
                 36.243 
                 1.00 
                 39.94 
                 O 
               
               
                 ATOM 
                 2810 
                 N 
                 THR 
                 D 
                 40 
                 19.466 
                 −9.575 
                 34.178 
                 1.00 
                 40.03 
                 N 
               
               
                 ATOM 
                 2811 
                 CA 
                 THR 
                 D 
                 40 
                 18.077 
                 −9.928 
                 34.414 
                 1.00 
                 39.98 
                 C 
               
               
                 ATOM 
                 2812 
                 CB 
                 THR 
                 D 
                 40 
                 17.135 
                 −9.038 
                 33.601 
                 1.00 
                 40.00 
                 C 
               
               
                 ATOM 
                 2813 
                 OG1 
                 THR 
                 D 
                 40 
                 17.394 
                 −9.208 
                 32.198 
                 1.00 
                 39.47 
                 O 
               
               
                 ATOM 
                 2814 
                 CG2 
                 THR 
                 D 
                 40 
                 17.323 
                 −7.590 
                 33.990 
                 1.00 
                 40.09 
                 C 
               
               
                 ATOM 
                 2815 
                 C 
                 THR 
                 D 
                 40 
                 17.780 
                 −11.357 
                 34.040 
                 1.00 
                 40.30 
                 C 
               
               
                 ATOM 
                 2816 
                 O 
                 THR 
                 D 
                 40 
                 18.631 
                 −12.051 
                 33.494 
                 1.00 
                 40.34 
                 O 
               
               
                 ATOM 
                 2817 
                 N 
                 LEU 
                 D 
                 41 
                 16.557 
                 −11.788 
                 34.341 
                 1.00 
                 41.15 
                 N 
               
               
                 ATOM 
                 2818 
                 CA 
                 LEU 
                 D 
                 41 
                 16.086 
                 −13.107 
                 33.976 
                 1.00 
                 42.05 
                 C 
               
               
                 ATOM 
                 2819 
                 CB 
                 LEU 
                 D 
                 41 
                 14.669 
                 −13.308 
                 34.496 
                 1.00 
                 41.61 
                 C 
               
               
                 ATOM 
                 2820 
                 CG 
                 LEU 
                 D 
                 41 
                 14.465 
                 −13.519 
                 36.001 
                 1.00 
                 41.14 
                 C 
               
               
                 ATOM 
                 2821 
                 CD1 
                 LEU 
                 D 
                 41 
                 12.964 
                 −13.520 
                 36.401 
                 1.00 
                 37.89 
                 C 
               
               
                 ATOM 
                 2822 
                 CD2 
                 LEU 
                 D 
                 41 
                 15.160 
                 −14.796 
                 36.463 
                 1.00 
                 40.23 
                 C 
               
               
                 ATOM 
                 2823 
                 C 
                 LEU 
                 D 
                 41 
                 16.127 
                 −13.290 
                 32.459 
                 1.00 
                 43.36 
                 C 
               
               
                 ATOM 
                 2824 
                 O 
                 LEU 
                 D 
                 41 
                 16.391 
                 −14.387 
                 31.969 
                 1.00 
                 43.43 
                 O 
               
               
                 ATOM 
                 2825 
                 N 
                 GLY 
                 D 
                 42 
                 15.891 
                 −12.198 
                 31.729 
                 1.00 
                 44.83 
                 N 
               
               
                 ATOM 
                 2826 
                 CA 
                 GLY 
                 D 
                 42 
                 15.787 
                 −12.219 
                 30.271 
                 1.00 
                 46.70 
                 C 
               
               
                 ATOM 
                 2827 
                 C 
                 GLY 
                 D 
                 42 
                 17.086 
                 −12.250 
                 29.483 
                 1.00 
                 48.04 
                 C 
               
               
                 ATOM 
                 2828 
                 O 
                 GLY 
                 D 
                 42 
                 17.183 
                 −12.965 
                 28.491 
                 1.00 
                 48.50 
                 O 
               
               
                 ATOM 
                 2829 
                 N 
                 SER 
                 D 
                 43 
                 18.054 
                 −11.433 
                 29.897 
                 1.00 
                 49.46 
                 N 
               
               
                 ATOM 
                 2830 
                 CA 
                 SER 
                 D 
                 43 
                 19.426 
                 −11.415 
                 29.360 
                 1.00 
                 50.33 
                 C 
               
               
                 ATOM 
                 2831 
                 CB 
                 SER 
                 D 
                 43 
                 20.173 
                 −10.173 
                 29.896 
                 1.00 
                 51.06 
                 C 
               
               
                 ATOM 
                 2832 
                 OG 
                 SER 
                 D 
                 43 
                 20.572 
                 −10.313 
                 31.275 
                 1.00 
                 50.27 
                 O 
               
               
                 ATOM 
                 2833 
                 C 
                 SER 
                 D 
                 43 
                 20.176 
                 −12.646 
                 29.828 
                 1.00 
                 50.79 
                 C 
               
               
                 ATOM 
                 2834 
                 O 
                 SER 
                 D 
                 43 
                 19.790 
                 −13.264 
                 30.819 
                 1.00 
                 50.86 
                 O 
               
               
                 ATOM 
                 2835 
                 N 
                 THR 
                 D 
                 44 
                 21.262 
                 −12.985 
                 29.149 
                 1.00 
                 51.44 
                 N 
               
               
                 ATOM 
                 2836 
                 CA 
                 THR 
                 D 
                 44 
                 22.135 
                 −14.060 
                 29.625 
                 1.00 
                 52.24 
                 C 
               
               
                 ATOM 
                 2837 
                 CB 
                 THR 
                 D 
                 44 
                 22.661 
                 −14.911 
                 28.462 
                 1.00 
                 52.50 
                 C 
               
               
                 ATOM 
                 2838 
                 OG1 
                 THR 
                 D 
                 44 
                 21.557 
                 −15.301 
                 27.637 
                 1.00 
                 53.69 
                 O 
               
               
                 ATOM 
                 2839 
                 CG2 
                 THR 
                 D 
                 44 
                 23.363 
                 −16.167 
                 28.971 
                 1.00 
                 52.93 
                 C 
               
               
                 ATOM 
                 2840 
                 C 
                 THR 
                 D 
                 44 
                 23.284 
                 −13.459 
                 30.431 
                 1.00 
                 52.40 
                 C 
               
               
                 ATOM 
                 2841 
                 O 
                 THR 
                 D 
                 44 
                 23.462 
                 −13.767 
                 31.617 
                 1.00 
                 52.64 
                 O 
               
               
                 ATOM 
                 2842 
                 N 
                 ASN 
                 D 
                 45 
                 24.050 
                 −12.589 
                 29.781 
                 1.00 
                 52.56 
                 N 
               
               
                 ATOM 
                 2843 
                 CA 
                 ASN 
                 D 
                 45 
                 25.082 
                 −11.803 
                 30.456 
                 1.00 
                 52.43 
                 C 
               
               
                 ATOM 
                 2844 
                 CB 
                 ASN 
                 D 
                 45 
                 26.345 
                 −11.710 
                 29.582 
                 1.00 
                 52.75 
                 C 
               
               
                 ATOM 
                 2845 
                 CG 
                 ASN 
                 D 
                 45 
                 27.157 
                 −13.001 
                 29.571 
                 1.00 
                 53.08 
                 C 
               
               
                 ATOM 
                 2846 
                 OD1 
                 ASN 
                 D 
                 45 
                 27.717 
                 −13.380 
                 28.538 
                 1.00 
                 54.49 
                 O 
               
               
                 ATOM 
                 2847 
                 ND2 
                 ASN 
                 D 
                 45 
                 27.247 
                 −13.667 
                 30.723 
                 1.00 
                 52.75 
                 N 
               
               
                 ATOM 
                 2848 
                 C 
                 ASN 
                 D 
                 45 
                 24.558 
                 −10.406 
                 30.782 
                 1.00 
                 51.79 
                 C 
               
               
                 ATOM 
                 2849 
                 O 
                 ASN 
                 D 
                 45 
                 23.413 
                 −10.080 
                 30.457 
                 1.00 
                 51.44 
                 O 
               
               
                 ATOM 
                 2850 
                 N 
                 GLU 
                 D 
                 46 
                 25.403 
                 −9.596 
                 31.422 
                 1.00 
                 51.23 
                 N 
               
               
                 ATOM 
                 2851 
                 CA 
                 GLU 
                 D 
                 46 
                 25.113 
                 −8.184 
                 31.685 
                 1.00 
                 50.85 
                 C 
               
               
                 ATOM 
                 2852 
                 CB 
                 GLU 
                 D 
                 46 
                 26.312 
                 −7.517 
                 32.370 
                 1.00 
                 51.14 
                 C 
               
               
                 ATOM 
                 2853 
                 CG 
                 GLU 
                 D 
                 46 
                 26.299 
                 −5.989 
                 32.412 
                 1.00 
                 53.38 
                 C 
               
               
                 ATOM 
                 2854 
                 CD 
                 GLU 
                 D 
                 46 
                 27.037 
                 −5.420 
                 33.640 
                 1.00 
                 57.60 
                 C 
               
               
                 ATOM 
                 2855 
                 OE1 
                 GLU 
                 D 
                 46 
                 26.496 
                 −5.533 
                 34.777 
                 1.00 
                 58.34 
                 O 
               
               
                 ATOM 
                 2856 
                 OE2 
                 GLU 
                 D 
                 46 
                 28.148 
                 −4.847 
                 33.465 
                 1.00 
                 58.29 
                 O 
               
               
                 ATOM 
                 2857 
                 C 
                 GLU 
                 D 
                 46 
                 24.796 
                 −7.485 
                 30.376 
                 1.00 
                 50.00 
                 C 
               
               
                 ATOM 
                 2858 
                 O 
                 GLU 
                 D 
                 46 
                 25.308 
                 −7.888 
                 29.321 
                 1.00 
                 50.44 
                 O 
               
               
                 ATOM 
                 2859 
                 N 
                 GLN 
                 D 
                 47 
                 23.941 
                 −6.464 
                 30.433 
                 1.00 
                 48.59 
                 N 
               
               
                 ATOM 
                 2860 
                 CA 
                 GLN 
                 D 
                 47 
                 23.627 
                 −5.672 
                 29.242 
                 1.00 
                 47.33 
                 C 
               
               
                 ATOM 
                 2861 
                 CB 
                 GLN 
                 D 
                 47 
                 22.468 
                 −6.295 
                 28.442 
                 1.00 
                 47.28 
                 C 
               
               
                 ATOM 
                 2862 
                 CG 
                 GLN 
                 D 
                 47 
                 21.113 
                 −6.289 
                 29.144 
                 1.00 
                 48.85 
                 C 
               
               
                 ATOM 
                 2863 
                 CD 
                 GLN 
                 D 
                 47 
                 19.949 
                 −6.605 
                 28.208 
                 1.00 
                 48.87 
                 C 
               
               
                 ATOM 
                 2864 
                 OE1 
                 GLN 
                 D 
                 47 
                 20.006 
                 −6.316 
                 27.011 
                 1.00 
                 50.60 
                 O 
               
               
                 ATOM 
                 2865 
                 NE2 
                 GLN 
                 D 
                 47 
                 18.884 
                 −7.200 
                 28.755 
                 1.00 
                 49.96 
                 N 
               
               
                 ATOM 
                 2866 
                 C 
                 GLN 
                 D 
                 47 
                 23.384 
                 −4.190 
                 29.540 
                 1.00 
                 45.66 
                 C 
               
               
                 ATOM 
                 2867 
                 O 
                 GLN 
                 D 
                 47 
                 22.830 
                 −3.834 
                 30.581 
                 1.00 
                 45.01 
                 O 
               
               
                 ATOM 
                 2868 
                 N 
                 LYS 
                 D 
                 48 
                 23.817 
                 −3.340 
                 28.611 
                 1.00 
                 44.18 
                 N 
               
               
                 ATOM 
                 2869 
                 CA 
                 LYS 
                 D 
                 48 
                 23.660 
                 −1.897 
                 28.723 
                 1.00 
                 42.86 
                 C 
               
               
                 ATOM 
                 2870 
                 CB 
                 LYS 
                 D 
                 48 
                 24.693 
                 −1.174 
                 27.859 
                 1.00 
                 43.14 
                 C 
               
               
                 ATOM 
                 2871 
                 CG 
                 LYS 
                 D 
                 48 
                 24.906 
                 0.292 
                 28.233 
                 1.00 
                 44.48 
                 C 
               
               
                 ATOM 
                 2872 
                 CD 
                 LYS 
                 D 
                 48 
                 25.770 
                 1.001 
                 27.209 
                 1.00 
                 46.74 
                 C 
               
               
                 ATOM 
                 2873 
                 CE 
                 LYS 
                 D 
                 48 
                 25.329 
                 2.458 
                 27.073 
                 1.00 
                 48.04 
                 C 
               
               
                 ATOM 
                 2874 
                 NZ 
                 LYS 
                 D 
                 48 
                 25.345 
                 2.926 
                 25.633 
                 1.00 
                 49.15 
                 N 
               
               
                 ATOM 
                 2875 
                 C 
                 LYS 
                 D 
                 48 
                 22.258 
                 −1.496 
                 28.311 
                 1.00 
                 41.75 
                 C 
               
               
                 ATOM 
                 2876 
                 O 
                 LYS 
                 D 
                 48 
                 21.802 
                 −1.823 
                 27.217 
                 1.00 
                 41.56 
                 O 
               
               
                 ATOM 
                 2877 
                 N 
                 ILE 
                 D 
                 49 
                 21.562 
                 −0.811 
                 29.206 
                 1.00 
                 40.59 
                 N 
               
               
                 ATOM 
                 2878 
                 CA 
                 ILE 
                 D 
                 49 
                 20.252 
                 −0.283 
                 28.889 
                 1.00 
                 39.63 
                 C 
               
               
                 ATOM 
                 2879 
                 CB 
                 ILE 
                 D 
                 49 
                 19.520 
                 0.215 
                 30.119 
                 1.00 
                 39.09 
                 C 
               
               
                 ATOM 
                 2880 
                 CG1 
                 ILE 
                 D 
                 49 
                 19.200 
                 −0.969 
                 31.043 
                 1.00 
                 38.06 
                 C 
               
               
                 ATOM 
                 2881 
                 CD1 
                 ILE 
                 D 
                 49 
                 18.812 
                 −0.625 
                 32.475 
                 1.00 
                 34.62 
                 C 
               
               
                 ATOM 
                 2882 
                 CG2 
                 ILE 
                 D 
                 49 
                 18.277 
                 0.944 
                 29.668 
                 1.00 
                 38.69 
                 C 
               
               
                 ATOM 
                 2883 
                 C 
                 ILE 
                 D 
                 49 
                 20.412 
                 0.859 
                 27.889 
                 1.00 
                 39.78 
                 C 
               
               
                 ATOM 
                 2884 
                 O 
                 ILE 
                 D 
                 49 
                 21.253 
                 1.747 
                 28.064 
                 1.00 
                 40.00 
                 O 
               
               
                 ATOM 
                 2885 
                 N 
                 SER 
                 D 
                 50 
                 19.629 
                 0.801 
                 26.819 
                 1.00 
                 39.45 
                 N 
               
               
                 ATOM 
                 2886 
                 CA 
                 SER 
                 D 
                 50 
                 19.691 
                 1.788 
                 25.771 
                 1.00 
                 39.01 
                 C 
               
               
                 ATOM 
                 2887 
                 CB 
                 SER 
                 D 
                 50 
                 19.518 
                 1.088 
                 24.433 
                 1.00 
                 39.12 
                 C 
               
               
                 ATOM 
                 2888 
                 OG 
                 SER 
                 D 
                 50 
                 20.086 
                 1.839 
                 23.372 
                 1.00 
                 40.32 
                 O 
               
               
                 ATOM 
                 2889 
                 C 
                 SER 
                 D 
                 50 
                 18.545 
                 2.751 
                 26.011 
                 1.00 
                 38.51 
                 C 
               
               
                 ATOM 
                 2890 
                 O 
                 SER 
                 D 
                 50 
                 17.384 
                 2.349 
                 25.909 
                 1.00 
                 39.42 
                 O 
               
               
                 ATOM 
                 2891 
                 N 
                 ILE 
                 D 
                 51 
                 18.853 
                 4.004 
                 26.340 
                 1.00 
                 37.35 
                 N 
               
               
                 ATOM 
                 2892 
                 CA 
                 ILE 
                 D 
                 51 
                 17.814 
                 4.982 
                 26.670 
                 1.00 
                 36.74 
                 C 
               
               
                 ATOM 
                 2893 
                 CB 
                 ILE 
                 D 
                 51 
                 18.406 
                 6.284 
                 27.263 
                 1.00 
                 36.75 
                 C 
               
               
                 ATOM 
                 2894 
                 CG1 
                 ILE 
                 D 
                 51 
                 19.193 
                 5.982 
                 28.542 
                 1.00 
                 34.81 
                 C 
               
               
                 ATOM 
                 2895 
                 CD1 
                 ILE 
                 D 
                 51 
                 18.418 
                 5.319 
                 29.576 
                 1.00 
                 32.25 
                 C 
               
               
                 ATOM 
                 2896 
                 CG2 
                 ILE 
                 D 
                 51 
                 17.315 
                 7.328 
                 27.527 
                 1.00 
                 36.15 
                 C 
               
               
                 ATOM 
                 2897 
                 C 
                 ILE 
                 D 
                 51 
                 16.914 
                 5.303 
                 25.475 
                 1.00 
                 36.75 
                 C 
               
               
                 ATOM 
                 2898 
                 O 
                 ILE 
                 D 
                 51 
                 17.390 
                 5.558 
                 24.373 
                 1.00 
                 36.49 
                 O 
               
               
                 ATOM 
                 2899 
                 N 
                 GLY 
                 D 
                 52 
                 15.609 
                 5.287 
                 25.718 
                 1.00 
                 36.69 
                 N 
               
               
                 ATOM 
                 2900 
                 CA 
                 GLY 
                 D 
                 52 
                 14.612 
                 5.423 
                 24.670 
                 1.00 
                 36.76 
                 C 
               
               
                 ATOM 
                 2901 
                 C 
                 GLY 
                 D 
                 52 
                 13.431 
                 4.548 
                 25.008 
                 1.00 
                 37.07 
                 C 
               
               
                 ATOM 
                 2902 
                 O 
                 GLY 
                 D 
                 52 
                 13.513 
                 3.681 
                 25.896 
                 1.00 
                 36.81 
                 O 
               
               
                 ATOM 
                 2903 
                 N 
                 GLY 
                 D 
                 53 
                 12.323 
                 4.777 
                 24.313 
                 1.00 
                 37.51 
                 N 
               
               
                 ATOM 
                 2904 
                 CA 
                 GLY 
                 D 
                 53 
                 11.138 
                 3.932 
                 24.472 
                 1.00 
                 38.10 
                 C 
               
               
                 ATOM 
                 2905 
                 C 
                 GLY 
                 D 
                 53 
                 10.635 
                 3.891 
                 25.902 
                 1.00 
                 38.54 
                 C 
               
               
                 ATOM 
                 2906 
                 O 
                 GLY 
                 D 
                 53 
                 10.205 
                 4.914 
                 26.438 
                 1.00 
                 38.60 
                 O 
               
               
                 ATOM 
                 2907 
                 N 
                 ARG 
                 D 
                 54 
                 10.703 
                 2.718 
                 26.530 
                 1.00 
                 38.89 
                 N 
               
               
                 ATOM 
                 2908 
                 CA 
                 ARG 
                 D 
                 54 
                 10.225 
                 2.570 
                 27.904 
                 1.00 
                 39.33 
                 C 
               
               
                 ATOM 
                 2909 
                 CB 
                 ARG 
                 D 
                 54 
                 9.540 
                 1.219 
                 28.116 
                 1.00 
                 38.67 
                 C 
               
               
                 ATOM 
                 2910 
                 CG 
                 ARG 
                 D 
                 54 
                 10.409 
                 0.023 
                 27.897 
                 1.00 
                 38.93 
                 C 
               
               
                 ATOM 
                 2911 
                 CD 
                 ARG 
                 D 
                 54 
                 9.664 
                 −1.276 
                 28.255 
                 1.00 
                 39.46 
                 C 
               
               
                 ATOM 
                 2912 
                 NE 
                 ARG 
                 D 
                 54 
                 10.631 
                 −2.322 
                 28.599 
                 1.00 
                 39.95 
                 N 
               
               
                 ATOM 
                 2913 
                 CZ 
                 ARG 
                 D 
                 54 
                 10.716 
                 −2.956 
                 29.769 
                 1.00 
                 39.82 
                 C 
               
               
                 ATOM 
                 2914 
                 NH1 
                 ARG 
                 D 
                 54 
                 9.870 
                 −2.722 
                 30.766 
                 1.00 
                 40.34 
                 N 
               
               
                 ATOM 
                 2915 
                 NH2 
                 ARG 
                 D 
                 54 
                 11.658 
                 −3.860 
                 29.935 
                 1.00 
                 40.00 
                 N 
               
               
                 ATOM 
                 2916 
                 C 
                 ARG 
                 D 
                 54 
                 11.296 
                 2.863 
                 28.973 
                 1.00 
                 40.11 
                 C 
               
               
                 ATOM 
                 2917 
                 O 
                 ARG 
                 D 
                 54 
                 11.017 
                 2.779 
                 30.177 
                 1.00 
                 40.31 
                 O 
               
               
                 ATOM 
                 2918 
                 N 
                 TYR 
                 D 
                 55 
                 12.501 
                 3.236 
                 28.536 
                 1.00 
                 40.47 
                 N 
               
               
                 ATOM 
                 2919 
                 CA 
                 TYR 
                 D 
                 55 
                 13.535 
                 3.637 
                 29.467 
                 1.00 
                 41.02 
                 C 
               
               
                 ATOM 
                 2920 
                 CB 
                 TYR 
                 D 
                 55 
                 14.841 
                 2.917 
                 29.181 
                 1.00 
                 41.30 
                 C 
               
               
                 ATOM 
                 2921 
                 CG 
                 TYR 
                 D 
                 55 
                 14.767 
                 1.417 
                 29.167 
                 1.00 
                 41.64 
                 C 
               
               
                 ATOM 
                 2922 
                 CD1 
                 TYR 
                 D 
                 55 
                 15.056 
                 0.676 
                 30.308 
                 1.00 
                 41.45 
                 C 
               
               
                 ATOM 
                 2923 
                 CE1 
                 TYR 
                 D 
                 55 
                 15.006 
                 −0.716 
                 30.285 
                 1.00 
                 41.62 
                 C 
               
               
                 ATOM 
                 2924 
                 CZ 
                 TYR 
                 D 
                 55 
                 14.665 
                 −1.364 
                 29.103 
                 1.00 
                 42.18 
                 C 
               
               
                 ATOM 
                 2925 
                 OH 
                 TYR 
                 D 
                 55 
                 14.611 
                 −2.741 
                 29.054 
                 1.00 
                 42.97 
                 O 
               
               
                 ATOM 
                 2926 
                 CE2 
                 TYR 
                 D 
                 55 
                 14.376 
                 −0.646 
                 27.965 
                 1.00 
                 40.93 
                 C 
               
               
                 ATOM 
                 2927 
                 CD2 
                 TYR 
                 D 
                 55 
                 14.437 
                 0.733 
                 27.999 
                 1.00 
                 41.27 
                 C 
               
               
                 ATOM 
                 2928 
                 C 
                 TYR 
                 D 
                 55 
                 13.753 
                 5.128 
                 29.311 
                 1.00 
                 41.65 
                 C 
               
               
                 ATOM 
                 2929 
                 O 
                 TYR 
                 D 
                 55 
                 14.221 
                 5.585 
                 28.259 
                 1.00 
                 42.12 
                 O 
               
               
                 ATOM 
                 2930 
                 N 
                 VAL 
                 D 
                 56 
                 13.413 
                 5.902 
                 30.338 
                 1.00 
                 41.86 
                 N 
               
               
                 ATOM 
                 2931 
                 CA 
                 VAL 
                 D 
                 56 
                 13.590 
                 7.350 
                 30.237 
                 1.00 
                 42.12 
                 C 
               
               
                 ATOM 
                 2932 
                 CB 
                 VAL 
                 D 
                 56 
                 12.245 
                 8.166 
                 30.156 
                 1.00 
                 41.91 
                 C 
               
               
                 ATOM 
                 2933 
                 CG1 
                 VAL 
                 D 
                 56 
                 11.098 
                 7.449 
                 30.817 
                 1.00 
                 42.53 
                 C 
               
               
                 ATOM 
                 2934 
                 CG2 
                 VAL 
                 D 
                 56 
                 12.407 
                 9.551 
                 30.750 
                 1.00 
                 42.26 
                 C 
               
               
                 ATOM 
                 2935 
                 C 
                 VAL 
                 D 
                 56 
                 14.521 
                 7.827 
                 31.335 
                 1.00 
                 42.34 
                 C 
               
               
                 ATOM 
                 2936 
                 O 
                 VAL 
                 D 
                 56 
                 14.225 
                 7.655 
                 32.532 
                 1.00 
                 42.74 
                 O 
               
               
                 ATOM 
                 2937 
                 N 
                 GLU 
                 D 
                 57 
                 15.656 
                 8.391 
                 30.899 
                 1.00 
                 42.10 
                 N 
               
               
                 ATOM 
                 2938 
                 CA 
                 GLU 
                 D 
                 57 
                 16.706 
                 8.880 
                 31.786 
                 1.00 
                 41.85 
                 C 
               
               
                 ATOM 
                 2939 
                 CB 
                 GLU 
                 D 
                 57 
                 18.105 
                 8.616 
                 31.218 
                 1.00 
                 41.42 
                 C 
               
               
                 ATOM 
                 2940 
                 CG 
                 GLU 
                 D 
                 57 
                 19.172 
                 8.651 
                 32.301 
                 1.00 
                 41.99 
                 C 
               
               
                 ATOM 
                 2941 
                 CD 
                 GLU 
                 D 
                 57 
                 20.576 
                 8.851 
                 31.778 
                 1.00 
                 44.29 
                 C 
               
               
                 ATOM 
                 2942 
                 OE1 
                 GLU 
                 D 
                 57 
                 20.726 
                 9.397 
                 30.666 
                 1.00 
                 44.38 
                 O 
               
               
                 ATOM 
                 2943 
                 OE2 
                 GLU 
                 D 
                 57 
                 21.540 
                 8.478 
                 32.494 
                 1.00 
                 45.27 
                 O 
               
               
                 ATOM 
                 2944 
                 C 
                 GLU 
                 D 
                 57 
                 16.539 
                 10.365 
                 32.055 
                 1.00 
                 41.91 
                 C 
               
               
                 ATOM 
                 2945 
                 O 
                 GLU 
                 D 
                 57 
                 16.238 
                 11.144 
                 31.147 
                 1.00 
                 42.23 
                 O 
               
               
                 ATOM 
                 2946 
                 N 
                 THR 
                 D 
                 58 
                 16.725 
                 10.743 
                 33.315 
                 1.00 
                 41.83 
                 N 
               
               
                 ATOM 
                 2947 
                 CA 
                 THR 
                 D 
                 58 
                 16.747 
                 12.142 
                 33.726 
                 1.00 
                 41.66 
                 C 
               
               
                 ATOM 
                 2948 
                 CB 
                 THR 
                 D 
                 58 
                 15.622 
                 12.454 
                 34.708 
                 1.00 
                 41.70 
                 C 
               
               
                 ATOM 
                 2949 
                 OG1 
                 THR 
                 D 
                 58 
                 14.383 
                 12.354 
                 34.006 
                 1.00 
                 42.93 
                 O 
               
               
                 ATOM 
                 2950 
                 CG2 
                 THR 
                 D 
                 58 
                 15.756 
                 13.871 
                 35.282 
                 1.00 
                 41.32 
                 C 
               
               
                 ATOM 
                 2951 
                 C 
                 THR 
                 D 
                 58 
                 18.086 
                 12.473 
                 34.355 
                 1.00 
                 41.29 
                 C 
               
               
                 ATOM 
                 2952 
                 O 
                 THR 
                 D 
                 58 
                 18.552 
                 11.779 
                 35.263 
                 1.00 
                 41.34 
                 O 
               
               
                 ATOM 
                 2953 
                 N 
                 VAL 
                 D 
                 59 
                 18.705 
                 13.533 
                 33.851 
                 1.00 
                 40.74 
                 N 
               
               
                 ATOM 
                 2954 
                 CA 
                 VAL 
                 D 
                 59 
                 19.994 
                 13.939 
                 34.347 
                 1.00 
                 40.11 
                 C 
               
               
                 ATOM 
                 2955 
                 CB 
                 VAL 
                 D 
                 59 
                 21.116 
                 13.635 
                 33.336 
                 1.00 
                 40.28 
                 C 
               
               
                 ATOM 
                 2956 
                 CG1 
                 VAL 
                 D 
                 59 
                 22.440 
                 14.177 
                 33.838 
                 1.00 
                 41.06 
                 C 
               
               
                 ATOM 
                 2957 
                 CG2 
                 VAL 
                 D 
                 59 
                 21.237 
                 12.132 
                 33.094 
                 1.00 
                 40.21 
                 C 
               
               
                 ATOM 
                 2958 
                 C 
                 VAL 
                 D 
                 59 
                 19.979 
                 15.409 
                 34.728 
                 1.00 
                 39.52 
                 C 
               
               
                 ATOM 
                 2959 
                 O 
                 VAL 
                 D 
                 59 
                 19.682 
                 16.284 
                 33.904 
                 1.00 
                 39.63 
                 O 
               
               
                 ATOM 
                 2960 
                 N 
                 ASN 
                 D 
                 60 
                 20.266 
                 15.642 
                 36.005 
                 1.00 
                 38.53 
                 N 
               
               
                 ATOM 
                 2961 
                 CA 
                 ASN 
                 D 
                 60 
                 20.559 
                 16.944 
                 36.555 
                 1.00 
                 37.66 
                 C 
               
               
                 ATOM 
                 2962 
                 CB 
                 ASN 
                 D 
                 60 
                 19.751 
                 17.135 
                 37.841 
                 1.00 
                 37.63 
                 C 
               
               
                 ATOM 
                 2963 
                 CG 
                 ASN 
                 D 
                 60 
                 19.879 
                 18.540 
                 38.439 
                 1.00 
                 39.15 
                 C 
               
               
                 ATOM 
                 2964 
                 OD1 
                 ASN 
                 D 
                 60 
                 20.786 
                 19.322 
                 38.112 
                 1.00 
                 39.45 
                 O 
               
               
                 ATOM 
                 2965 
                 ND2 
                 ASN 
                 D 
                 60 
                 18.965 
                 18.856 
                 39.347 
                 1.00 
                 41.24 
                 N 
               
               
                 ATOM 
                 2966 
                 C 
                 ASN 
                 D 
                 60 
                 22.066 
                 16.991 
                 36.835 
                 1.00 
                 37.07 
                 C 
               
               
                 ATOM 
                 2967 
                 O 
                 ASN 
                 D 
                 60 
                 22.523 
                 16.526 
                 37.895 
                 1.00 
                 37.14 
                 O 
               
               
                 ATOM 
                 2968 
                 N 
                 LYS 
                 D 
                 61 
                 22.833 
                 17.522 
                 35.877 
                 1.00 
                 36.02 
                 N 
               
               
                 ATOM 
                 2969 
                 CA 
                 LYS 
                 D 
                 61 
                 24.284 
                 17.681 
                 36.029 
                 1.00 
                 35.34 
                 C 
               
               
                 ATOM 
                 2970 
                 CB 
                 LYS 
                 D 
                 61 
                 24.936 
                 18.076 
                 34.708 
                 1.00 
                 35.26 
                 C 
               
               
                 ATOM 
                 2971 
                 CG 
                 LYS 
                 D 
                 61 
                 25.277 
                 16.898 
                 33.825 
                 1.00 
                 35.03 
                 C 
               
               
                 ATOM 
                 2972 
                 CD 
                 LYS 
                 D 
                 61 
                 25.896 
                 17.347 
                 32.532 
                 1.00 
                 34.29 
                 C 
               
               
                 ATOM 
                 2973 
                 CE 
                 LYS 
                 D 
                 61 
                 25.631 
                 16.329 
                 31.473 
                 1.00 
                 34.80 
                 C 
               
               
                 ATOM 
                 2974 
                 NZ 
                 LYS 
                 D 
                 61 
                 26.224 
                 16.730 
                 30.180 
                 1.00 
                 36.67 
                 N 
               
               
                 ATOM 
                 2975 
                 C 
                 LYS 
                 D 
                 61 
                 24.681 
                 18.683 
                 37.112 
                 1.00 
                 35.17 
                 C 
               
               
                 ATOM 
                 2976 
                 O 
                 LYS 
                 D 
                 61 
                 25.735 
                 18.538 
                 37.727 
                 1.00 
                 34.89 
                 O 
               
               
                 ATOM 
                 2977 
                 N 
                 GLY 
                 D 
                 62 
                 23.841 
                 19.692 
                 37.330 
                 1.00 
                 35.04 
                 N 
               
               
                 ATOM 
                 2978 
                 CA 
                 GLY 
                 D 
                 62 
                 24.057 
                 20.680 
                 38.374 
                 1.00 
                 35.15 
                 C 
               
               
                 ATOM 
                 2979 
                 C 
                 GLY 
                 D 
                 62 
                 24.137 
                 20.076 
                 39.763 
                 1.00 
                 35.56 
                 C 
               
               
                 ATOM 
                 2980 
                 O 
                 GLY 
                 D 
                 62 
                 24.998 
                 20.443 
                 40.553 
                 1.00 
                 35.83 
                 O 
               
               
                 ATOM 
                 2981 
                 N 
                 SER 
                 D 
                 63 
                 23.240 
                 19.153 
                 40.073 
                 1.00 
                 35.78 
                 N 
               
               
                 ATOM 
                 2982 
                 CA 
                 SER 
                 D 
                 63 
                 23.276 
                 18.484 
                 41.369 
                 1.00 
                 36.29 
                 C 
               
               
                 ATOM 
                 2983 
                 CB 
                 SER 
                 D 
                 63 
                 21.865 
                 18.429 
                 41.969 
                 1.00 
                 36.47 
                 C 
               
               
                 ATOM 
                 2984 
                 OG 
                 SER 
                 D 
                 63 
                 21.008 
                 17.558 
                 41.243 
                 1.00 
                 36.43 
                 O 
               
               
                 ATOM 
                 2985 
                 C 
                 SER 
                 D 
                 63 
                 23.919 
                 17.080 
                 41.311 
                 1.00 
                 36.71 
                 C 
               
               
                 ATOM 
                 2986 
                 O 
                 SER 
                 D 
                 63 
                 23.928 
                 16.350 
                 42.300 
                 1.00 
                 36.84 
                 O 
               
               
                 ATOM 
                 2987 
                 N 
                 LYS 
                 D 
                 64 
                 24.440 
                 16.710 
                 40.140 
                 1.00 
                 37.00 
                 N 
               
               
                 ATOM 
                 2988 
                 CA 
                 LYS 
                 D 
                 64 
                 25.120 
                 15.441 
                 39.923 
                 1.00 
                 36.80 
                 C 
               
               
                 ATOM 
                 2989 
                 CB 
                 LYS 
                 D 
                 64 
                 26.417 
                 15.374 
                 40.727 
                 1.00 
                 36.46 
                 C 
               
               
                 ATOM 
                 2990 
                 CG 
                 LYS 
                 D 
                 64 
                 27.422 
                 16.390 
                 40.240 
                 1.00 
                 36.86 
                 C 
               
               
                 ATOM 
                 2991 
                 CD 
                 LYS 
                 D 
                 64 
                 28.631 
                 16.570 
                 41.140 
                 1.00 
                 37.76 
                 C 
               
               
                 ATOM 
                 2992 
                 CE 
                 LYS 
                 D 
                 64 
                 29.298 
                 17.884 
                 40.778 
                 1.00 
                 38.56 
                 C 
               
               
                 ATOM 
                 2993 
                 NZ 
                 LYS 
                 D 
                 64 
                 30.669 
                 18.028 
                 41.305 
                 1.00 
                 39.73 
                 N 
               
               
                 ATOM 
                 2994 
                 C 
                 LYS 
                 D 
                 64 
                 24.221 
                 14.261 
                 40.206 
                 1.00 
                 37.38 
                 C 
               
               
                 ATOM 
                 2995 
                 O 
                 LYS 
                 D 
                 64 
                 24.690 
                 13.185 
                 40.558 
                 1.00 
                 37.70 
                 O 
               
               
                 ATOM 
                 2996 
                 N 
                 SER 
                 D 
                 65 
                 22.921 
                 14.451 
                 40.037 
                 1.00 
                 37.84 
                 N 
               
               
                 ATOM 
                 2997 
                 CA 
                 SER 
                 D 
                 65 
                 21.999 
                 13.328 
                 40.174 
                 1.00 
                 38.63 
                 C 
               
               
                 ATOM 
                 2998 
                 CB 
                 SER 
                 D 
                 65 
                 20.867 
                 13.671 
                 41.136 
                 1.00 
                 38.71 
                 C 
               
               
                 ATOM 
                 2999 
                 OG 
                 SER 
                 D 
                 65 
                 20.203 
                 14.855 
                 40.734 
                 1.00 
                 39.23 
                 O 
               
               
                 ATOM 
                 3000 
                 C 
                 SER 
                 D 
                 65 
                 21.435 
                 12.895 
                 38.821 
                 1.00 
                 39.05 
                 C 
               
               
                 ATOM 
                 3001 
                 O 
                 SER 
                 D 
                 65 
                 21.436 
                 13.658 
                 37.864 
                 1.00 
                 39.10 
                 O 
               
               
                 ATOM 
                 3002 
                 N 
                 PHE 
                 D 
                 66 
                 20.971 
                 11.657 
                 38.754 
                 1.00 
                 39.85 
                 N 
               
               
                 ATOM 
                 3003 
                 CA 
                 PHE 
                 D 
                 66 
                 20.360 
                 11.089 
                 37.548 
                 1.00 
                 41.06 
                 C 
               
               
                 ATOM 
                 3004 
                 CB 
                 PHE 
                 D 
                 66 
                 21.412 
                 10.655 
                 36.503 
                 1.00 
                 41.00 
                 C 
               
               
                 ATOM 
                 3005 
                 CG 
                 PHE 
                 D 
                 66 
                 22.515 
                 9.791 
                 37.048 
                 1.00 
                 41.25 
                 C 
               
               
                 ATOM 
                 3006 
                 CD1 
                 PHE 
                 D 
                 66 
                 22.626 
                 8.465 
                 36.655 
                 1.00 
                 42.36 
                 C 
               
               
                 ATOM 
                 3007 
                 CE1 
                 PHE 
                 D 
                 66 
                 23.663 
                 7.659 
                 37.153 
                 1.00 
                 43.09 
                 C 
               
               
                 ATOM 
                 3008 
                 CZ 
                 PHE 
                 D 
                 66 
                 24.609 
                 8.184 
                 38.060 
                 1.00 
                 42.16 
                 C 
               
               
                 ATOM 
                 3009 
                 CE2 
                 PHE 
                 D 
                 66 
                 24.506 
                 9.495 
                 38.458 
                 1.00 
                 41.78 
                 C 
               
               
                 ATOM 
                 3010 
                 CD2 
                 PHE 
                 D 
                 66 
                 23.465 
                 10.303 
                 37.939 
                 1.00 
                 42.07 
                 C 
               
               
                 ATOM 
                 3011 
                 C 
                 PHE 
                 D 
                 66 
                 19.460 
                 9.917 
                 37.913 
                 1.00 
                 41.66 
                 C 
               
               
                 ATOM 
                 3012 
                 O 
                 PHE 
                 D 
                 66 
                 19.774 
                 9.158 
                 38.838 
                 1.00 
                 42.19 
                 O 
               
               
                 ATOM 
                 3013 
                 N 
                 SER 
                 D 
                 67 
                 18.351 
                 9.760 
                 37.201 
                 1.00 
                 41.87 
                 N 
               
               
                 ATOM 
                 3014 
                 CA 
                 SER 
                 D 
                 67 
                 17.450 
                 8.665 
                 37.497 
                 1.00 
                 42.54 
                 C 
               
               
                 ATOM 
                 3015 
                 CB 
                 SER 
                 D 
                 67 
                 16.204 
                 9.199 
                 38.191 
                 1.00 
                 42.49 
                 C 
               
               
                 ATOM 
                 3016 
                 OG 
                 SER 
                 D 
                 67 
                 15.374 
                 9.911 
                 37.288 
                 1.00 
                 44.07 
                 O 
               
               
                 ATOM 
                 3017 
                 C 
                 SER 
                 D 
                 67 
                 17.064 
                 7.866 
                 36.257 
                 1.00 
                 42.81 
                 C 
               
               
                 ATOM 
                 3018 
                 O 
                 SER 
                 D 
                 67 
                 17.043 
                 8.393 
                 35.153 
                 1.00 
                 43.06 
                 O 
               
               
                 ATOM 
                 3019 
                 N 
                 LEU 
                 D 
                 68 
                 16.750 
                 6.591 
                 36.430 
                 1.00 
                 43.18 
                 N 
               
               
                 ATOM 
                 3020 
                 CA 
                 LEU 
                 D 
                 68 
                 16.133 
                 5.850 
                 35.341 
                 1.00 
                 43.39 
                 C 
               
               
                 ATOM 
                 3021 
                 CB 
                 LEU 
                 D 
                 68 
                 16.901 
                 4.558 
                 35.088 
                 1.00 
                 43.37 
                 C 
               
               
                 ATOM 
                 3022 
                 CG 
                 LEU 
                 D 
                 68 
                 16.498 
                 3.717 
                 33.876 
                 1.00 
                 43.64 
                 C 
               
               
                 ATOM 
                 3023 
                 CD1 
                 LEU 
                 D 
                 68 
                 17.017 
                 4.352 
                 32.605 
                 1.00 
                 41.74 
                 C 
               
               
                 ATOM 
                 3024 
                 CD2 
                 LEU 
                 D 
                 68 
                 17.029 
                 2.290 
                 34.025 
                 1.00 
                 43.05 
                 C 
               
               
                 ATOM 
                 3025 
                 C 
                 LEU 
                 D 
                 68 
                 14.698 
                 5.525 
                 35.718 
                 1.00 
                 43.63 
                 C 
               
               
                 ATOM 
                 3026 
                 O 
                 LEU 
                 D 
                 68 
                 14.450 
                 5.025 
                 36.813 
                 1.00 
                 43.33 
                 O 
               
               
                 ATOM 
                 3027 
                 N 
                 ARG 
                 D 
                 69 
                 13.750 
                 5.842 
                 34.833 
                 1.00 
                 44.30 
                 N 
               
               
                 ATOM 
                 3028 
                 CA 
                 ARG 
                 D 
                 69 
                 12.365 
                 5.310 
                 34.934 
                 1.00 
                 44.40 
                 C 
               
               
                 ATOM 
                 3029 
                 CB 
                 ARG 
                 D 
                 69 
                 11.340 
                 6.429 
                 34.790 
                 1.00 
                 44.69 
                 C 
               
               
                 ATOM 
                 3030 
                 CG 
                 ARG 
                 D 
                 69 
                 9.877 
                 6.025 
                 34.925 
                 1.00 
                 46.02 
                 C 
               
               
                 ATOM 
                 3031 
                 CD 
                 ARG 
                 D 
                 69 
                 9.059 
                 7.243 
                 35.313 
                 1.00 
                 49.63 
                 C 
               
               
                 ATOM 
                 3032 
                 NE 
                 ARG 
                 D 
                 69 
                 7.640 
                 7.148 
                 34.949 
                 1.00 
                 54.97 
                 N 
               
               
                 ATOM 
                 3033 
                 CZ 
                 ARG 
                 D 
                 69 
                 6.625 
                 6.943 
                 35.805 
                 1.00 
                 56.63 
                 C 
               
               
                 ATOM 
                 3034 
                 NH1 
                 ARG 
                 D 
                 69 
                 5.374 
                 6.895 
                 35.352 
                 1.00 
                 56.12 
                 N 
               
               
                 ATOM 
                 3035 
                 NH2 
                 ARG 
                 D 
                 69 
                 6.842 
                 6.782 
                 37.112 
                 1.00 
                 57.83 
                 N 
               
               
                 ATOM 
                 3036 
                 C 
                 ARG 
                 D 
                 69 
                 12.135 
                 4.234 
                 33.869 
                 1.00 
                 44.07 
                 C 
               
               
                 ATOM 
                 3037 
                 O 
                 ARG 
                 D 
                 69 
                 12.376 
                 4.469 
                 32.672 
                 1.00 
                 44.43 
                 O 
               
               
                 ATOM 
                 3038 
                 N 
                 ILE 
                 D 
                 70 
                 11.704 
                 3.056 
                 34.307 
                 1.00 
                 43.70 
                 N 
               
               
                 ATOM 
                 3039 
                 CA 
                 ILE 
                 D 
                 70 
                 11.388 
                 1.938 
                 33.396 
                 1.00 
                 43.53 
                 C 
               
               
                 ATOM 
                 3040 
                 CB 
                 ILE 
                 D 
                 70 
                 12.112 
                 0.620 
                 33.790 
                 1.00 
                 43.04 
                 C 
               
               
                 ATOM 
                 3041 
                 CG1 
                 ILE 
                 D 
                 70 
                 13.468 
                 0.916 
                 34.429 
                 1.00 
                 42.40 
                 C 
               
               
                 ATOM 
                 3042 
                 CD1 
                 ILE 
                 D 
                 70 
                 14.198 
                 −0.309 
                 34.860 
                 1.00 
                 41.81 
                 C 
               
               
                 ATOM 
                 3043 
                 CG2 
                 ILE 
                 D 
                 70 
                 12.273 
                 −0.268 
                 32.582 
                 1.00 
                 42.18 
                 C 
               
               
                 ATOM 
                 3044 
                 C 
                 ILE 
                 D 
                 70 
                 9.878 
                 1.693 
                 33.352 
                 1.00 
                 43.87 
                 C 
               
               
                 ATOM 
                 3045 
                 O 
                 ILE 
                 D 
                 70 
                 9.278 
                 1.301 
                 34.343 
                 1.00 
                 44.08 
                 O 
               
               
                 ATOM 
                 3046 
                 N 
                 ARG 
                 D 
                 71 
                 9.268 
                 1.947 
                 32.205 
                 1.00 
                 44.38 
                 N 
               
               
                 ATOM 
                 3047 
                 CA 
                 ARG 
                 D 
                 71 
                 7.823 
                 1.787 
                 32.037 
                 1.00 
                 44.93 
                 C 
               
               
                 ATOM 
                 3048 
                 CB 
                 ARG 
                 D 
                 71 
                 7.364 
                 2.627 
                 30.851 
                 1.00 
                 45.25 
                 C 
               
               
                 ATOM 
                 3049 
                 CG 
                 ARG 
                 D 
                 71 
                 7.092 
                 4.069 
                 31.159 
                 1.00 
                 47.04 
                 C 
               
               
                 ATOM 
                 3050 
                 CD 
                 ARG 
                 D 
                 71 
                 5.746 
                 4.407 
                 30.570 
                 1.00 
                 51.66 
                 C 
               
               
                 ATOM 
                 3051 
                 NE 
                 ARG 
                 D 
                 71 
                 5.701 
                 4.424 
                 29.099 
                 1.00 
                 55.58 
                 N 
               
               
                 ATOM 
                 3052 
                 CZ 
                 ARG 
                 D 
                 71 
                 4.705 
                 3.918 
                 28.359 
                 1.00 
                 57.76 
                 C 
               
               
                 ATOM 
                 3053 
                 NH1 
                 ARG 
                 D 
                 71 
                 3.666 
                 3.300 
                 28.933 
                 1.00 
                 57.56 
                 N 
               
               
                 ATOM 
                 3054 
                 NH2 
                 ARG 
                 D 
                 71 
                 4.749 
                 4.010 
                 27.029 
                 1.00 
                 58.57 
                 N 
               
               
                 ATOM 
                 3055 
                 C 
                 ARG 
                 D 
                 71 
                 7.423 
                 0.337 
                 31.789 
                 1.00 
                 44.65 
                 C 
               
               
                 ATOM 
                 3056 
                 O 
                 ARG 
                 D 
                 71 
                 8.277 
                 −0.498 
                 31.542 
                 1.00 
                 45.26 
                 O 
               
               
                 ATOM 
                 3057 
                 N 
                 ASP 
                 D 
                 72 
                 6.128 
                 0.054 
                 31.863 
                 1.00 
                 44.46 
                 N 
               
               
                 ATOM 
                 3058 
                 CA 
                 ASP 
                 D 
                 72 
                 5.533 
                 −1.215 
                 31.422 
                 1.00 
                 44.72 
                 C 
               
               
                 ATOM 
                 3059 
                 CB 
                 ASP 
                 D 
                 72 
                 5.390 
                 −1.223 
                 29.901 
                 1.00 
                 45.19 
                 C 
               
               
                 ATOM 
                 3060 
                 CG 
                 ASP 
                 D 
                 72 
                 4.368 
                 −0.194 
                 29.403 
                 1.00 
                 48.24 
                 C 
               
               
                 ATOM 
                 3061 
                 OD1 
                 ASP 
                 D 
                 72 
                 4.666 
                 0.561 
                 28.434 
                 1.00 
                 50.91 
                 O 
               
               
                 ATOM 
                 3062 
                 OD2 
                 ASP 
                 D 
                 72 
                 3.258 
                 −0.133 
                 29.989 
                 1.00 
                 50.87 
                 O 
               
               
                 ATOM 
                 3063 
                 C 
                 ASP 
                 D 
                 72 
                 6.250 
                 −2.472 
                 31.887 
                 1.00 
                 44.13 
                 C 
               
               
                 ATOM 
                 3064 
                 O 
                 ASP 
                 D 
                 72 
                 6.593 
                 −3.322 
                 31.066 
                 1.00 
                 44.33 
                 O 
               
               
                 ATOM 
                 3065 
                 N 
                 LEU 
                 D 
                 73 
                 6.459 
                 −2.588 
                 33.201 
                 1.00 
                 43.44 
                 N 
               
               
                 ATOM 
                 3066 
                 CA 
                 LEU 
                 D 
                 73 
                 7.242 
                 −3.683 
                 33.799 
                 1.00 
                 42.68 
                 C 
               
               
                 ATOM 
                 3067 
                 CB 
                 LEU 
                 D 
                 73 
                 7.412 
                 −3.464 
                 35.296 
                 1.00 
                 42.53 
                 C 
               
               
                 ATOM 
                 3068 
                 CG 
                 LEU 
                 D 
                 73 
                 8.521 
                 −2.493 
                 35.707 
                 1.00 
                 41.94 
                 C 
               
               
                 ATOM 
                 3069 
                 CD1 
                 LEU 
                 D 
                 73 
                 8.482 
                 −2.245 
                 37.198 
                 1.00 
                 40.56 
                 C 
               
               
                 ATOM 
                 3070 
                 CD2 
                 LEU 
                 D 
                 73 
                 9.864 
                 −3.036 
                 35.297 
                 1.00 
                 40.62 
                 C 
               
               
                 ATOM 
                 3071 
                 C 
                 LEU 
                 D 
                 73 
                 6.699 
                 −5.082 
                 33.556 
                 1.00 
                 42.39 
                 C 
               
               
                 ATOM 
                 3072 
                 O 
                 LEU 
                 D 
                 73 
                 5.500 
                 −5.278 
                 33.396 
                 1.00 
                 42.53 
                 O 
               
               
                 ATOM 
                 3073 
                 N 
                 ARG 
                 D 
                 74 
                 7.610 
                 −6.044 
                 33.521 
                 1.00 
                 42.33 
                 N 
               
               
                 ATOM 
                 3074 
                 CA 
                 ARG 
                 D 
                 74 
                 7.276 
                 −7.445 
                 33.280 
                 1.00 
                 42.60 
                 C 
               
               
                 ATOM 
                 3075 
                 CB 
                 ARG 
                 D 
                 74 
                 7.176 
                 −7.727 
                 31.777 
                 1.00 
                 42.97 
                 C 
               
               
                 ATOM 
                 3076 
                 CG 
                 ARG 
                 D 
                 74 
                 8.472 
                 −7.524 
                 31.014 
                 1.00 
                 45.79 
                 C 
               
               
                 ATOM 
                 3077 
                 CD 
                 ARG 
                 D 
                 74 
                 8.253 
                 −7.753 
                 29.528 
                 1.00 
                 50.87 
                 C 
               
               
                 ATOM 
                 3078 
                 NE 
                 ARG 
                 D 
                 74 
                 9.227 
                 −7.043 
                 28.690 
                 1.00 
                 54.09 
                 N 
               
               
                 ATOM 
                 3079 
                 CZ 
                 ARG 
                 D 
                 74 
                 9.095 
                 −5.784 
                 28.264 
                 1.00 
                 55.43 
                 C 
               
               
                 ATOM 
                 3080 
                 NH1 
                 ARG 
                 D 
                 74 
                 8.034 
                 −5.050 
                 28.605 
                 1.00 
                 55.13 
                 N 
               
               
                 ATOM 
                 3081 
                 NH2 
                 ARG 
                 D 
                 74 
                 10.038 
                 −5.251 
                 27.493 
                 1.00 
                 56.35 
                 N 
               
               
                 ATOM 
                 3082 
                 C 
                 ARG 
                 D 
                 74 
                 8.301 
                 −8.378 
                 33.935 
                 1.00 
                 42.04 
                 C 
               
               
                 ATOM 
                 3083 
                 O 
                 ARG 
                 D 
                 74 
                 9.455 
                 −7.974 
                 34.172 
                 1.00 
                 41.78 
                 O 
               
               
                 ATOM 
                 3084 
                 N 
                 VAL 
                 D 
                 75 
                 7.881 
                 −9.619 
                 34.204 
                 1.00 
                 41.25 
                 N 
               
               
                 ATOM 
                 3085 
                 CA 
                 VAL 
                 D 
                 75 
                 8.697 
                 −10.608 
                 34.943 
                 1.00 
                 40.84 
                 C 
               
               
                 ATOM 
                 3086 
                 CB 
                 VAL 
                 D 
                 75 
                 8.015 
                 −12.017 
                 34.960 
                 1.00 
                 40.73 
                 C 
               
               
                 ATOM 
                 3087 
                 CG1 
                 VAL 
                 D 
                 75 
                 8.891 
                 −13.070 
                 35.649 
                 1.00 
                 41.36 
                 C 
               
               
                 ATOM 
                 3088 
                 CG2 
                 VAL 
                 D 
                 75 
                 6.686 
                 −11.937 
                 35.672 
                 1.00 
                 40.25 
                 C 
               
               
                 ATOM 
                 3089 
                 C 
                 VAL 
                 D 
                 75 
                 10.190 
                 −10.658 
                 34.529 
                 1.00 
                 40.38 
                 C 
               
               
                 ATOM 
                 3090 
                 O 
                 VAL 
                 D 
                 75 
                 11.079 
                 −10.478 
                 35.365 
                 1.00 
                 39.84 
                 O 
               
               
                 ATOM 
                 3091 
                 N 
                 GLU 
                 D 
                 76 
                 10.423 
                 −10.882 
                 33.236 
                 1.00 
                 40.29 
                 N 
               
               
                 ATOM 
                 3092 
                 CA 
                 GLU 
                 D 
                 76 
                 11.719 
                 −10.705 
                 32.549 
                 1.00 
                 40.14 
                 C 
               
               
                 ATOM 
                 3093 
                 CB 
                 GLU 
                 D 
                 76 
                 11.477 
                 −10.467 
                 31.046 
                 1.00 
                 41.10 
                 C 
               
               
                 ATOM 
                 3094 
                 CG 
                 GLU 
                 D 
                 76 
                 10.730 
                 −11.599 
                 30.304 
                 1.00 
                 45.43 
                 C 
               
               
                 ATOM 
                 3095 
                 CD 
                 GLU 
                 D 
                 76 
                 11.612 
                 −12.855 
                 30.054 
                 1.00 
                 50.46 
                 C 
               
               
                 ATOM 
                 3096 
                 OE1 
                 GLU 
                 D 
                 76 
                 11.360 
                 −13.603 
                 29.063 
                 1.00 
                 51.40 
                 O 
               
               
                 ATOM 
                 3097 
                 OE2 
                 GLU 
                 D 
                 76 
                 12.559 
                 −13.087 
                 30.851 
                 1.00 
                 52.29 
                 O 
               
               
                 ATOM 
                 3098 
                 C 
                 GLU 
                 D 
                 76 
                 12.602 
                 −9.568 
                 33.052 
                 1.00 
                 38.84 
                 C 
               
               
                 ATOM 
                 3099 
                 O 
                 GLU 
                 D 
                 76 
                 13.825 
                 −9.670 
                 32.995 
                 1.00 
                 38.75 
                 O 
               
               
                 ATOM 
                 3100 
                 N 
                 ASP 
                 D 
                 77 
                 11.995 
                 −8.475 
                 33.503 
                 1.00 
                 37.42 
                 N 
               
               
                 ATOM 
                 3101 
                 CA 
                 ASP 
                 D 
                 77 
                 12.781 
                 −7.340 
                 33.974 
                 1.00 
                 36.19 
                 C 
               
               
                 ATOM 
                 3102 
                 CB 
                 ASP 
                 D 
                 77 
                 11.960 
                 −6.041 
                 34.024 
                 1.00 
                 36.54 
                 C 
               
               
                 ATOM 
                 3103 
                 CG 
                 ASP 
                 D 
                 77 
                 11.370 
                 −5.644 
                 32.675 
                 1.00 
                 37.48 
                 C 
               
               
                 ATOM 
                 3104 
                 OD1 
                 ASP 
                 D 
                 77 
                 12.078 
                 −5.751 
                 31.648 
                 1.00 
                 37.44 
                 O 
               
               
                 ATOM 
                 3105 
                 OD2 
                 ASP 
                 D 
                 77 
                 10.192 
                 −5.205 
                 32.656 
                 1.00 
                 38.17 
                 O 
               
               
                 ATOM 
                 3106 
                 C 
                 ASP 
                 D 
                 77 
                 13.424 
                 −7.582 
                 35.330 
                 1.00 
                 35.12 
                 C 
               
               
                 ATOM 
                 3107 
                 O 
                 ASP 
                 D 
                 77 
                 14.403 
                 −6.903 
                 35.649 
                 1.00 
                 35.09 
                 O 
               
               
                 ATOM 
                 3108 
                 N 
                 SER 
                 D 
                 78 
                 12.882 
                 −8.525 
                 36.118 
                 1.00 
                 33.83 
                 N 
               
               
                 ATOM 
                 3109 
                 CA 
                 SER 
                 D 
                 78 
                 13.417 
                 −8.869 
                 37.458 
                 1.00 
                 33.11 
                 C 
               
               
                 ATOM 
                 3110 
                 CB 
                 SER 
                 D 
                 78 
                 12.750 
                 −10.123 
                 38.039 
                 1.00 
                 33.10 
                 C 
               
               
                 ATOM 
                 3111 
                 OG 
                 SER 
                 D 
                 78 
                 11.349 
                 −9.982 
                 38.232 
                 1.00 
                 34.27 
                 O 
               
               
                 ATOM 
                 3112 
                 C 
                 SER 
                 D 
                 78 
                 14.918 
                 −9.101 
                 37.418 
                 1.00 
                 32.47 
                 C 
               
               
                 ATOM 
                 3113 
                 O 
                 SER 
                 D 
                 78 
                 15.403 
                 −9.818 
                 36.552 
                 1.00 
                 32.51 
                 O 
               
               
                 ATOM 
                 3114 
                 N 
                 GLY 
                 D 
                 79 
                 15.663 
                 −8.499 
                 38.339 
                 1.00 
                 32.25 
                 N 
               
               
                 ATOM 
                 3115 
                 CA 
                 GLY 
                 D 
                 79 
                 17.132 
                 −8.599 
                 38.302 
                 1.00 
                 31.92 
                 C 
               
               
                 ATOM 
                 3116 
                 C 
                 GLY 
                 D 
                 79 
                 17.871 
                 −7.446 
                 38.939 
                 1.00 
                 31.96 
                 C 
               
               
                 ATOM 
                 3117 
                 O 
                 GLY 
                 D 
                 79 
                 17.330 
                 −6.760 
                 39.809 
                 1.00 
                 31.58 
                 O 
               
               
                 ATOM 
                 3118 
                 N 
                 THR 
                 D 
                 80 
                 19.104 
                 −7.229 
                 38.479 
                 1.00 
                 32.63 
                 N 
               
               
                 ATOM 
                 3119 
                 CA 
                 THR 
                 D 
                 80 
                 20.058 
                 −6.318 
                 39.129 
                 1.00 
                 33.50 
                 C 
               
               
                 ATOM 
                 3120 
                 CB 
                 THR 
                 D 
                 80 
                 21.328 
                 −7.039 
                 39.539 
                 1.00 
                 33.20 
                 C 
               
               
                 ATOM 
                 3121 
                 OG1 
                 THR 
                 D 
                 80 
                 20.986 
                 −8.131 
                 40.393 
                 1.00 
                 34.33 
                 O 
               
               
                 ATOM 
                 3122 
                 CG2 
                 THR 
                 D 
                 80 
                 22.228 
                 −6.116 
                 40.289 
                 1.00 
                 33.40 
                 C 
               
               
                 ATOM 
                 3123 
                 C 
                 THR 
                 D 
                 80 
                 20.442 
                 −5.192 
                 38.197 
                 1.00 
                 34.18 
                 C 
               
               
                 ATOM 
                 3124 
                 O 
                 THR 
                 D 
                 80 
                 20.919 
                 −5.434 
                 37.087 
                 1.00 
                 33.90 
                 O 
               
               
                 ATOM 
                 3125 
                 N 
                 TYR 
                 D 
                 81 
                 20.210 
                 −3.965 
                 38.668 
                 1.00 
                 35.19 
                 N 
               
               
                 ATOM 
                 3126 
                 CA 
                 TYR 
                 D 
                 81 
                 20.462 
                 −2.735 
                 37.913 
                 1.00 
                 35.91 
                 C 
               
               
                 ATOM 
                 3127 
                 CB 
                 TYR 
                 D 
                 81 
                 19.195 
                 −1.912 
                 37.803 
                 1.00 
                 35.33 
                 C 
               
               
                 ATOM 
                 3128 
                 CG 
                 TYR 
                 D 
                 81 
                 18.114 
                 −2.593 
                 37.010 
                 1.00 
                 34.85 
                 C 
               
               
                 ATOM 
                 3129 
                 CD1 
                 TYR 
                 D 
                 81 
                 17.492 
                 −3.747 
                 37.488 
                 1.00 
                 35.35 
                 C 
               
               
                 ATOM 
                 3130 
                 CE1 
                 TYR 
                 D 
                 81 
                 16.506 
                 −4.389 
                 36.753 
                 1.00 
                 35.81 
                 C 
               
               
                 ATOM 
                 3131 
                 CZ 
                 TYR 
                 D 
                 81 
                 16.132 
                 −3.866 
                 35.535 
                 1.00 
                 35.53 
                 C 
               
               
                 ATOM 
                 3132 
                 OH 
                 TYR 
                 D 
                 81 
                 15.167 
                 −4.496 
                 34.808 
                 1.00 
                 35.83 
                 O 
               
               
                 ATOM 
                 3133 
                 CE2 
                 TYR 
                 D 
                 81 
                 16.733 
                 −2.724 
                 35.044 
                 1.00 
                 35.04 
                 C 
               
               
                 ATOM 
                 3134 
                 CD2 
                 TYR 
                 D 
                 81 
                 17.707 
                 −2.091 
                 35.787 
                 1.00 
                 33.32 
                 C 
               
               
                 ATOM 
                 3135 
                 C 
                 TYR 
                 D 
                 81 
                 21.536 
                 −1.939 
                 38.647 
                 1.00 
                 37.21 
                 C 
               
               
                 ATOM 
                 3136 
                 O 
                 TYR 
                 D 
                 81 
                 21.466 
                 −1.770 
                 39.868 
                 1.00 
                 37.81 
                 O 
               
               
                 ATOM 
                 3137 
                 N 
                 LYS 
                 D 
                 82 
                 22.553 
                 −1.501 
                 37.913 
                 1.00 
                 37.74 
                 N 
               
               
                 ATOM 
                 3138 
                 CA 
                 LYS 
                 D 
                 82 
                 23.568 
                 −0.638 
                 38.456 
                 1.00 
                 38.35 
                 C 
               
               
                 ATOM 
                 3139 
                 CB 
                 LYS 
                 D 
                 82 
                 24.934 
                 −1.323 
                 38.424 
                 1.00 
                 38.34 
                 C 
               
               
                 ATOM 
                 3140 
                 CG 
                 LYS 
                 D 
                 82 
                 25.392 
                 −1.989 
                 39.709 
                 1.00 
                 37.40 
                 C 
               
               
                 ATOM 
                 3141 
                 CD 
                 LYS 
                 D 
                 82 
                 25.142 
                 −3.457 
                 39.649 
                 1.00 
                 36.64 
                 C 
               
               
                 ATOM 
                 3142 
                 CE 
                 LYS 
                 D 
                 82 
                 26.282 
                 −4.240 
                 40.237 
                 1.00 
                 34.73 
                 C 
               
               
                 ATOM 
                 3143 
                 NZ 
                 LYS 
                 D 
                 82 
                 26.197 
                 −4.327 
                 41.696 
                 1.00 
                 35.21 
                 N 
               
               
                 ATOM 
                 3144 
                 C 
                 LYS 
                 D 
                 82 
                 23.595 
                 0.578 
                 37.557 
                 1.00 
                 39.27 
                 C 
               
               
                 ATOM 
                 3145 
                 O 
                 LYS 
                 D 
                 82 
                 23.505 
                 0.452 
                 36.339 
                 1.00 
                 39.29 
                 O 
               
               
                 ATOM 
                 3146 
                 N 
                 CYS 
                 D 
                 83 
                 23.701 
                 1.753 
                 38.161 
                 1.00 
                 40.62 
                 N 
               
               
                 ATOM 
                 3147 
                 CA 
                 CYS 
                 D 
                 83 
                 23.967 
                 2.977 
                 37.427 
                 1.00 
                 42.31 
                 C 
               
               
                 ATOM 
                 3148 
                 CB 
                 CYS 
                 D 
                 83 
                 23.147 
                 4.119 
                 38.004 
                 1.00 
                 42.45 
                 C 
               
               
                 ATOM 
                 3149 
                 SG 
                 CYS 
                 D 
                 83 
                 23.539 
                 4.543 
                 39.737 
                 1.00 
                 47.14 
                 S 
               
               
                 ATOM 
                 3150 
                 C 
                 CYS 
                 D 
                 83 
                 25.454 
                 3.320 
                 37.525 
                 1.00 
                 42.64 
                 C 
               
               
                 ATOM 
                 3151 
                 O 
                 CYS 
                 D 
                 83 
                 26.065 
                 3.098 
                 38.561 
                 1.00 
                 43.32 
                 O 
               
               
                 ATOM 
                 3152 
                 N 
                 GLY 
                 D 
                 84 
                 26.019 
                 3.871 
                 36.450 
                 1.00 
                 43.26 
                 N 
               
               
                 ATOM 
                 3153 
                 CA 
                 GLY 
                 D 
                 84 
                 27.425 
                 4.309 
                 36.406 
                 1.00 
                 42.90 
                 C 
               
               
                 ATOM 
                 3154 
                 C 
                 GLY 
                 D 
                 84 
                 27.562 
                 5.762 
                 35.971 
                 1.00 
                 42.52 
                 C 
               
               
                 ATOM 
                 3155 
                 O 
                 GLY 
                 D 
                 84 
                 26.877 
                 6.201 
                 35.065 
                 1.00 
                 41.68 
                 O 
               
               
                 ATOM 
                 3156 
                 N 
                 ALA 
                 D 
                 85 
                 28.464 
                 6.488 
                 36.633 
                 1.00 
                 42.86 
                 N 
               
               
                 ATOM 
                 3157 
                 CA 
                 ALA 
                 D 
                 85 
                 28.713 
                 7.918 
                 36.403 
                 1.00 
                 43.03 
                 C 
               
               
                 ATOM 
                 3158 
                 CB 
                 ALA 
                 D 
                 85 
                 28.307 
                 8.728 
                 37.624 
                 1.00 
                 42.74 
                 C 
               
               
                 ATOM 
                 3159 
                 C 
                 ALA 
                 D 
                 85 
                 30.183 
                 8.120 
                 36.126 
                 1.00 
                 43.30 
                 C 
               
               
                 ATOM 
                 3160 
                 O 
                 ALA 
                 D 
                 85 
                 31.014 
                 7.609 
                 36.860 
                 1.00 
                 43.69 
                 O 
               
               
                 ATOM 
                 3161 
                 N 
                 TYR 
                 D 
                 86 
                 30.510 
                 8.847 
                 35.065 
                 1.00 
                 43.66 
                 N 
               
               
                 ATOM 
                 3162 
                 CA 
                 TYR 
                 D 
                 86 
                 31.899 
                 9.105 
                 34.716 
                 1.00 
                 44.36 
                 C 
               
               
                 ATOM 
                 3163 
                 CB 
                 TYR 
                 D 
                 86 
                 32.219 
                 8.530 
                 33.340 
                 1.00 
                 44.95 
                 C 
               
               
                 ATOM 
                 3164 
                 CG 
                 TYR 
                 D 
                 86 
                 31.761 
                 7.096 
                 33.251 
                 1.00 
                 46.16 
                 C 
               
               
                 ATOM 
                 3165 
                 CD1 
                 TYR 
                 D 
                 86 
                 30.403 
                 6.796 
                 33.028 
                 1.00 
                 47.23 
                 C 
               
               
                 ATOM 
                 3166 
                 CE1 
                 TYR 
                 D 
                 86 
                 29.940 
                 5.482 
                 32.973 
                 1.00 
                 47.72 
                 C 
               
               
                 ATOM 
                 3167 
                 CZ 
                 TYR 
                 D 
                 86 
                 30.837 
                 4.423 
                 33.142 
                 1.00 
                 48.22 
                 C 
               
               
                 ATOM 
                 3168 
                 OH 
                 TYR 
                 D 
                 86 
                 30.343 
                 3.123 
                 33.084 
                 1.00 
                 47.41 
                 O 
               
               
                 ATOM 
                 3169 
                 CE2 
                 TYR 
                 D 
                 86 
                 32.210 
                 4.688 
                 33.366 
                 1.00 
                 48.08 
                 C 
               
               
                 ATOM 
                 3170 
                 CD2 
                 TYR 
                 D 
                 86 
                 32.657 
                 6.033 
                 33.432 
                 1.00 
                 46.88 
                 C 
               
               
                 ATOM 
                 3171 
                 C 
                 TYR 
                 D 
                 86 
                 32.105 
                 10.602 
                 34.795 
                 1.00 
                 44.66 
                 C 
               
               
                 ATOM 
                 3172 
                 O 
                 TYR 
                 D 
                 86 
                 31.162 
                 11.360 
                 34.575 
                 1.00 
                 44.79 
                 O 
               
               
                 ATOM 
                 3173 
                 N 
                 PHE 
                 D 
                 87 
                 33.307 
                 11.041 
                 35.162 
                 1.00 
                 44.81 
                 N 
               
               
                 ATOM 
                 3174 
                 CA 
                 PHE 
                 D 
                 87 
                 33.464 
                 12.442 
                 35.542 
                 1.00 
                 45.11 
                 C 
               
               
                 ATOM 
                 3175 
                 CB 
                 PHE 
                 D 
                 87 
                 33.095 
                 12.677 
                 37.019 
                 1.00 
                 45.03 
                 C 
               
               
                 ATOM 
                 3176 
                 CG 
                 PHE 
                 D 
                 87 
                 33.602 
                 11.621 
                 37.964 
                 1.00 
                 45.21 
                 C 
               
               
                 ATOM 
                 3177 
                 CD1 
                 PHE 
                 D 
                 87 
                 34.890 
                 11.693 
                 38.486 
                 1.00 
                 45.51 
                 C 
               
               
                 ATOM 
                 3178 
                 CE1 
                 PHE 
                 D 
                 87 
                 35.358 
                 10.728 
                 39.372 
                 1.00 
                 45.00 
                 C 
               
               
                 ATOM 
                 3179 
                 CZ 
                 PHE 
                 D 
                 87 
                 34.536 
                 9.690 
                 39.747 
                 1.00 
                 45.07 
                 C 
               
               
                 ATOM 
                 3180 
                 CE2 
                 PHE 
                 D 
                 87 
                 33.246 
                 9.611 
                 39.238 
                 1.00 
                 44.96 
                 C 
               
               
                 ATOM 
                 3181 
                 CD2 
                 PHE 
                 D 
                 87 
                 32.784 
                 10.576 
                 38.357 
                 1.00 
                 44.46 
                 C 
               
               
                 ATOM 
                 3182 
                 C 
                 PHE 
                 D 
                 87 
                 34.782 
                 13.115 
                 35.188 
                 1.00 
                 45.34 
                 C 
               
               
                 ATOM 
                 3183 
                 O 
                 PHE 
                 D 
                 87 
                 35.762 
                 12.444 
                 34.866 
                 1.00 
                 45.54 
                 O 
               
               
                 ATOM 
                 3184 
                 N 
                 SER 
                 D 
                 88 
                 34.756 
                 14.451 
                 35.255 
                 1.00 
                 45.64 
                 N 
               
               
                 ATOM 
                 3185 
                 CA 
                 SER 
                 D 
                 88 
                 35.821 
                 15.349 
                 34.811 
                 1.00 
                 45.97 
                 C 
               
               
                 ATOM 
                 3186 
                 CB 
                 SER 
                 D 
                 88 
                 35.297 
                 16.247 
                 33.694 
                 1.00 
                 46.20 
                 C 
               
               
                 ATOM 
                 3187 
                 OG 
                 SER 
                 D 
                 88 
                 35.337 
                 15.595 
                 32.433 
                 1.00 
                 47.34 
                 O 
               
               
                 ATOM 
                 3188 
                 C 
                 SER 
                 D 
                 88 
                 36.310 
                 16.234 
                 35.951 
                 1.00 
                 45.99 
                 C 
               
               
                 ATOM 
                 3189 
                 O 
                 SER 
                 D 
                 88 
                 37.402 
                 16.800 
                 35.897 
                 1.00 
                 46.11 
                 O 
               
               
                 ATOM 
                 3190 
                 N 
                 PRO 
                 D 
                 99 
                 37.620 
                 8.378 
                 34.147 
                 1.00 
                 41.32 
                 N 
               
               
                 ATOM 
                 3191 
                 CA 
                 PRO 
                 D 
                 99 
                 37.333 
                 7.914 
                 35.515 
                 1.00 
                 41.01 
                 C 
               
               
                 ATOM 
                 3192 
                 CB 
                 PRO 
                 D 
                 99 
                 37.997 
                 8.983 
                 36.403 
                 1.00 
                 41.21 
                 C 
               
               
                 ATOM 
                 3193 
                 CG 
                 PRO 
                 D 
                 99 
                 38.437 
                 10.142 
                 35.447 
                 1.00 
                 41.32 
                 C 
               
               
                 ATOM 
                 3194 
                 CD 
                 PRO 
                 D 
                 99 
                 37.888 
                 9.829 
                 34.076 
                 1.00 
                 41.24 
                 C 
               
               
                 ATOM 
                 3195 
                 C 
                 PRO 
                 D 
                 99 
                 35.827 
                 7.848 
                 35.777 
                 1.00 
                 40.76 
                 C 
               
               
                 ATOM 
                 3196 
                 O 
                 PRO 
                 D 
                 99 
                 35.075 
                 8.620 
                 35.183 
                 1.00 
                 40.78 
                 O 
               
               
                 ATOM 
                 3197 
                 N 
                 GLY 
                 D 
                 100 
                 35.390 
                 6.940 
                 36.652 
                 1.00 
                 40.55 
                 N 
               
               
                 ATOM 
                 3198 
                 CA 
                 GLY 
                 D 
                 100 
                 33.944 
                 6.725 
                 36.897 
                 1.00 
                 39.88 
                 C 
               
               
                 ATOM 
                 3199 
                 C 
                 GLY 
                 D 
                 100 
                 33.600 
                 5.794 
                 38.049 
                 1.00 
                 39.22 
                 C 
               
               
                 ATOM 
                 3200 
                 O 
                 GLY 
                 D 
                 100 
                 34.461 
                 5.086 
                 38.544 
                 1.00 
                 39.19 
                 O 
               
               
                 ATOM 
                 3201 
                 N 
                 GLU 
                 D 
                 101 
                 32.337 
                 5.793 
                 38.470 
                 1.00 
                 38.90 
                 N 
               
               
                 ATOM 
                 3202 
                 CA 
                 GLU 
                 D 
                 101 
                 31.895 
                 5.043 
                 39.662 
                 1.00 
                 38.56 
                 C 
               
               
                 ATOM 
                 3203 
                 CB 
                 GLU 
                 D 
                 101 
                 31.795 
                 5.959 
                 40.905 
                 1.00 
                 38.61 
                 C 
               
               
                 ATOM 
                 3204 
                 CG 
                 GLU 
                 D 
                 101 
                 33.089 
                 6.543 
                 41.423 
                 1.00 
                 39.35 
                 C 
               
               
                 ATOM 
                 3205 
                 CD 
                 GLU 
                 D 
                 101 
                 34.049 
                 5.477 
                 41.957 
                 1.00 
                 42.48 
                 C 
               
               
                 ATOM 
                 3206 
                 OE1 
                 GLU 
                 D 
                 101 
                 35.275 
                 5.773 
                 42.085 
                 1.00 
                 41.06 
                 O 
               
               
                 ATOM 
                 3207 
                 OE2 
                 GLU 
                 D 
                 101 
                 33.573 
                 4.341 
                 42.244 
                 1.00 
                 43.54 
                 O 
               
               
                 ATOM 
                 3208 
                 C 
                 GLU 
                 D 
                 101 
                 30.543 
                 4.392 
                 39.440 
                 1.00 
                 38.05 
                 C 
               
               
                 ATOM 
                 3209 
                 O 
                 GLU 
                 D 
                 101 
                 29.660 
                 4.997 
                 38.864 
                 1.00 
                 37.16 
                 O 
               
               
                 ATOM 
                 3210 
                 N 
                 LYS 
                 D 
                 102 
                 30.373 
                 3.170 
                 39.926 
                 1.00 
                 38.57 
                 N 
               
               
                 ATOM 
                 3211 
                 CA 
                 LYS 
                 D 
                 102 
                 29.047 
                 2.525 
                 39.897 
                 1.00 
                 39.26 
                 C 
               
               
                 ATOM 
                 3212 
                 CB 
                 LYS 
                 D 
                 102 
                 29.134 
                 1.086 
                 39.354 
                 1.00 
                 39.72 
                 C 
               
               
                 ATOM 
                 3213 
                 CG 
                 LYS 
                 D 
                 102 
                 29.719 
                 0.974 
                 37.951 
                 1.00 
                 42.83 
                 C 
               
               
                 ATOM 
                 3214 
                 CD 
                 LYS 
                 D 
                 102 
                 28.973 
                 −0.064 
                 37.104 
                 1.00 
                 47.99 
                 C 
               
               
                 ATOM 
                 3215 
                 CE 
                 LYS 
                 D 
                 102 
                 29.772 
                 −1.371 
                 36.971 
                 1.00 
                 51.61 
                 C 
               
               
                 ATOM 
                 3216 
                 NZ 
                 LYS 
                 D 
                 102 
                 29.020 
                 −2.452 
                 36.233 
                 1.00 
                 53.94 
                 N 
               
               
                 ATOM 
                 3217 
                 C 
                 LYS 
                 D 
                 102 
                 28.308 
                 2.529 
                 41.252 
                 1.00 
                 38.60 
                 C 
               
               
                 ATOM 
                 3218 
                 O 
                 LYS 
                 D 
                 102 
                 28.917 
                 2.359 
                 42.306 
                 1.00 
                 38.71 
                 O 
               
               
                 ATOM 
                 3219 
                 N 
                 GLY 
                 D 
                 103 
                 26.992 
                 2.723 
                 41.207 
                 1.00 
                 38.22 
                 N 
               
               
                 ATOM 
                 3220 
                 CA 
                 GLY 
                 D 
                 103 
                 26.136 
                 2.526 
                 42.382 
                 1.00 
                 38.12 
                 C 
               
               
                 ATOM 
                 3221 
                 C 
                 GLY 
                 D 
                 103 
                 26.009 
                 1.054 
                 42.739 
                 1.00 
                 37.72 
                 C 
               
               
                 ATOM 
                 3222 
                 O 
                 GLY 
                 D 
                 103 
                 26.248 
                 0.185 
                 41.891 
                 1.00 
                 38.11 
                 O 
               
               
                 ATOM 
                 3223 
                 N 
                 ALA 
                 D 
                 104 
                 25.641 
                 0.759 
                 43.984 
                 1.00 
                 37.10 
                 N 
               
               
                 ATOM 
                 3224 
                 CA 
                 ALA 
                 D 
                 104 
                 25.685 
                 −0.624 
                 44.471 
                 1.00 
                 36.84 
                 C 
               
               
                 ATOM 
                 3225 
                 CB 
                 ALA 
                 D 
                 104 
                 25.466 
                 −0.683 
                 45.965 
                 1.00 
                 36.58 
                 C 
               
               
                 ATOM 
                 3226 
                 C 
                 ALA 
                 D 
                 104 
                 24.693 
                 −1.513 
                 43.722 
                 1.00 
                 36.89 
                 C 
               
               
                 ATOM 
                 3227 
                 O 
                 ALA 
                 D 
                 104 
                 24.991 
                 −2.652 
                 43.389 
                 1.00 
                 37.36 
                 O 
               
               
                 ATOM 
                 3228 
                 N 
                 GLY 
                 D 
                 105 
                 23.519 
                 −0.972 
                 43.432 
                 1.00 
                 36.98 
                 N 
               
               
                 ATOM 
                 3229 
                 CA 
                 GLY 
                 D 
                 105 
                 22.539 
                 −1.667 
                 42.623 
                 1.00 
                 36.50 
                 C 
               
               
                 ATOM 
                 3230 
                 C 
                 GLY 
                 D 
                 105 
                 21.135 
                 −1.498 
                 43.141 
                 1.00 
                 36.28 
                 C 
               
               
                 ATOM 
                 3231 
                 O 
                 GLY 
                 D 
                 105 
                 20.917 
                 −0.997 
                 44.244 
                 1.00 
                 36.50 
                 O 
               
               
                 ATOM 
                 3232 
                 N 
                 THR 
                 D 
                 106 
                 20.186 
                 −1.911 
                 42.314 
                 1.00 
                 36.08 
                 N 
               
               
                 ATOM 
                 3233 
                 CA 
                 THR 
                 D 
                 106 
                 18.810 
                 −2.125 
                 42.713 
                 1.00 
                 36.15 
                 C 
               
               
                 ATOM 
                 3234 
                 CB 
                 THR 
                 D 
                 106 
                 17.874 
                 −1.220 
                 41.895 
                 1.00 
                 36.33 
                 C 
               
               
                 ATOM 
                 3235 
                 OG1 
                 THR 
                 D 
                 106 
                 18.229 
                 0.156 
                 42.089 
                 1.00 
                 36.72 
                 O 
               
               
                 ATOM 
                 3236 
                 CG2 
                 THR 
                 D 
                 106 
                 16.445 
                 −1.409 
                 42.311 
                 1.00 
                 37.11 
                 C 
               
               
                 ATOM 
                 3237 
                 C 
                 THR 
                 D 
                 106 
                 18.515 
                 −3.595 
                 42.386 
                 1.00 
                 36.03 
                 C 
               
               
                 ATOM 
                 3238 
                 O 
                 THR 
                 D 
                 106 
                 18.806 
                 −4.034 
                 41.267 
                 1.00 
                 36.46 
                 O 
               
               
                 ATOM 
                 3239 
                 N 
                 VAL 
                 D 
                 107 
                 17.995 
                 −4.382 
                 43.338 
                 1.00 
                 35.53 
                 N 
               
               
                 ATOM 
                 3240 
                 CA 
                 VAL 
                 D 
                 107 
                 17.420 
                 −5.678 
                 42.927 
                 1.00 
                 34.79 
                 C 
               
               
                 ATOM 
                 3241 
                 CB 
                 VAL 
                 D 
                 107 
                 18.049 
                 −6.952 
                 43.597 
                 1.00 
                 34.54 
                 C 
               
               
                 ATOM 
                 3242 
                 CG1 
                 VAL 
                 D 
                 107 
                 17.254 
                 −7.451 
                 44.711 
                 1.00 
                 35.41 
                 C 
               
               
                 ATOM 
                 3243 
                 CG2 
                 VAL 
                 D 
                 107 
                 19.488 
                 −6.698 
                 44.027 
                 1.00 
                 35.64 
                 C 
               
               
                 ATOM 
                 3244 
                 C 
                 VAL 
                 D 
                 107 
                 15.882 
                 −5.626 
                 42.821 
                 1.00 
                 34.18 
                 C 
               
               
                 ATOM 
                 3245 
                 O 
                 VAL 
                 D 
                 107 
                 15.153 
                 −5.489 
                 43.816 
                 1.00 
                 33.80 
                 O 
               
               
                 ATOM 
                 3246 
                 N 
                 LEU 
                 D 
                 108 
                 15.427 
                 −5.672 
                 41.572 
                 1.00 
                 33.40 
                 N 
               
               
                 ATOM 
                 3247 
                 CA 
                 LEU 
                 D 
                 108 
                 14.026 
                 −5.543 
                 41.235 
                 1.00 
                 33.01 
                 C 
               
               
                 ATOM 
                 3248 
                 CB 
                 LEU 
                 D 
                 108 
                 13.892 
                 −4.831 
                 39.896 
                 1.00 
                 33.00 
                 C 
               
               
                 ATOM 
                 3249 
                 CG 
                 LEU 
                 D 
                 108 
                 12.566 
                 −4.235 
                 39.374 
                 1.00 
                 33.86 
                 C 
               
               
                 ATOM 
                 3250 
                 CD1 
                 LEU 
                 D 
                 108 
                 11.301 
                 −4.627 
                 40.135 
                 1.00 
                 34.10 
                 C 
               
               
                 ATOM 
                 3251 
                 CD2 
                 LEU 
                 D 
                 108 
                 12.415 
                 −4.524 
                 37.875 
                 1.00 
                 32.03 
                 C 
               
               
                 ATOM 
                 3252 
                 C 
                 LEU 
                 D 
                 108 
                 13.417 
                 −6.919 
                 41.091 
                 1.00 
                 32.57 
                 C 
               
               
                 ATOM 
                 3253 
                 O 
                 LEU 
                 D 
                 108 
                 14.015 
                 −7.807 
                 40.508 
                 1.00 
                 32.64 
                 O 
               
               
                 ATOM 
                 3254 
                 N 
                 THR 
                 D 
                 109 
                 12.217 
                 −7.098 
                 41.605 
                 1.00 
                 32.14 
                 N 
               
               
                 ATOM 
                 3255 
                 CA 
                 THR 
                 D 
                 109 
                 11.490 
                 −8.306 
                 41.295 
                 1.00 
                 31.94 
                 C 
               
               
                 ATOM 
                 3256 
                 CB 
                 THR 
                 D 
                 109 
                 11.619 
                 −9.413 
                 42.407 
                 1.00 
                 31.81 
                 C 
               
               
                 ATOM 
                 3257 
                 OG1 
                 THR 
                 D 
                 109 
                 10.369 
                 −10.076 
                 42.596 
                 1.00 
                 32.13 
                 O 
               
               
                 ATOM 
                 3258 
                 CG2 
                 THR 
                 D 
                 109 
                 12.071 
                 −8.856 
                 43.724 
                 1.00 
                 31.42 
                 C 
               
               
                 ATOM 
                 3259 
                 C 
                 THR 
                 D 
                 109 
                 10.069 
                 −7.932 
                 40.901 
                 1.00 
                 31.92 
                 C 
               
               
                 ATOM 
                 3260 
                 O 
                 THR 
                 D 
                 109 
                 9.408 
                 −7.153 
                 41.587 
                 1.00 
                 31.68 
                 O 
               
               
                 ATOM 
                 3261 
                 N 
                 VAL 
                 D 
                 110 
                 9.635 
                 −8.446 
                 39.751 
                 1.00 
                 31.95 
                 N 
               
               
                 ATOM 
                 3262 
                 CA 
                 VAL 
                 D 
                 110 
                 8.332 
                 −8.099 
                 39.186 
                 1.00 
                 31.54 
                 C 
               
               
                 ATOM 
                 3263 
                 CB 
                 VAL 
                 D 
                 110 
                 8.383 
                 −7.936 
                 37.656 
                 1.00 
                 31.65 
                 C 
               
               
                 ATOM 
                 3264 
                 CG1 
                 VAL 
                 D 
                 110 
                 7.082 
                 −7.284 
                 37.146 
                 1.00 
                 30.75 
                 C 
               
               
                 ATOM 
                 3265 
                 CG2 
                 VAL 
                 D 
                 110 
                 9.628 
                 −7.129 
                 37.216 
                 1.00 
                 30.44 
                 C 
               
               
                 ATOM 
                 3266 
                 C 
                 VAL 
                 D 
                 110 
                 7.340 
                 −9.184 
                 39.512 
                 1.00 
                 31.88 
                 C 
               
               
                 ATOM 
                 3267 
                 O 
                 VAL 
                 D 
                 110 
                 7.635 
                 −10.367 
                 39.325 
                 1.00 
                 32.39 
                 O 
               
               
                 ATOM 
                 3268 
                 N 
                 LYS 
                 D 
                 111 
                 6.160 
                 −8.771 
                 39.977 
                 1.00 
                 31.88 
                 N 
               
               
                 ATOM 
                 3269 
                 CA 
                 LYS 
                 D 
                 111 
                 5.113 
                 −9.670 
                 40.445 
                 1.00 
                 31.62 
                 C 
               
               
                 ATOM 
                 3270 
                 CB 
                 LYS 
                 D 
                 111 
                 4.924 
                 −10.844 
                 39.488 
                 1.00 
                 31.59 
                 C 
               
               
                 ATOM 
                 3271 
                 CG 
                 LYS 
                 D 
                 111 
                 4.107 
                 −10.551 
                 38.264 
                 1.00 
                 30.11 
                 C 
               
               
                 ATOM 
                 3272 
                 CD 
                 LYS 
                 D 
                 111 
                 3.470 
                 −11.863 
                 37.787 
                 1.00 
                 27.97 
                 C 
               
               
                 ATOM 
                 3273 
                 CE 
                 LYS 
                 D 
                 111 
                 2.016 
                 −11.633 
                 37.521 
                 1.00 
                 26.09 
                 C 
               
               
                 ATOM 
                 3274 
                 NZ 
                 LYS 
                 D 
                 111 
                 1.418 
                 −11.163 
                 38.781 
                 1.00 
                 24.52 
                 N 
               
               
                 ATOM 
                 3275 
                 C 
                 LYS 
                 D 
                 111 
                 5.422 
                 −10.184 
                 41.856 
                 1.00 
                 31.99 
                 C 
               
               
                 ATOM 
                 3276 
                 O 
                 LYS 
                 D 
                 111 
                 4.582 
                 −10.094 
                 42.774 
                 1.00 
                 32.43 
                 O 
               
               
                 ATOM 
                 3277 
                 O 
                 HOH 
                 W 
                 1 
                 20.434 
                 11.911 
                 29.836 
                 1.00 
                 28.88 
                 O 
               
               
                 ATOM 
                 3278 
                 O 
                 HOH 
                 W 
                 2 
                 51.173 
                 8.997 
                 9.730 
                 1.00 
                 44.36 
                 O 
               
               
                 ATOM 
                 3279 
                 O 
                 HOH 
                 W 
                 3 
                 47.689 
                 11.742 
                 13.593 
                 1.00 
                 27.86 
                 O 
               
               
                 ATOM 
                 3280 
                 O 
                 HOH 
                 W 
                 4 
                 11.612 
                 −6.756 
                 46.515 
                 1.00 
                 30.22 
                 O 
               
               
                 ATOM 
                 3281 
                 O 
                 HOH 
                 W 
                 5 
                 50.210 
                 12.148 
                 9.875 
                 1.00 
                 31.20 
                 O 
               
               
                 ATOM 
                 3282 
                 O 
                 HOH 
                 W 
                 6 
                 49.395 
                 14.702 
                 4.881 
                 1.00 
                 23.52 
                 O 
               
               
                 ATOM 
                 3283 
                 O 
                 HOH 
                 W 
                 7 
                 32.057 
                 7.039 
                 10.045 
                 1.00 
                 27.86 
                 O 
               
               
                 ATOM 
                 3284 
                 O 
                 HOH 
                 W 
                 8 
                 13.846 
                 −7.318 
                 45.160 
                 1.00 
                 37.92 
                 O 
               
               
                 ATOM 
                 3285 
                 O 
                 HOH 
                 W 
                 9 
                 45.367 
                 −5.972 
                 1.806 
                 1.00 
                 56.96 
                 O 
               
               
                 ATOM 
                 3286 
                 O 
                 HOH 
                 W 
                 10 
                 50.323 
                 2.945 
                 4.830 
                 1.00 
                 31.28 
                 O 
               
               
                 ATOM 
                 3287 
                 O 
                 HOH 
                 W 
                 11 
                 50.653 
                 13.787 
                 7.807 
                 1.00 
                 31.34 
                 O 
               
               
                 ATOM 
                 3288 
                 O 
                 HOH 
                 W 
                 12 
                 55.639 
                 7.497 
                 18.084 
                 1.00 
                 28.59 
                 O 
               
               
                 ATOM 
                 3289 
                 O 
                 HOH 
                 W 
                 13 
                 50.800 
                 −9.586 
                 17.024 
                 1.00 
                 31.78 
                 O 
               
               
                 ATOM 
                 3290 
                 O 
                 HOH 
                 W 
                 14 
                 30.173 
                 21.846 
                 12.570 
                 1.00 
                 47.23 
                 O 
               
               
                 ATOM 
                 3291 
                 O 
                 HOH 
                 W 
                 15 
                 22.770 
                 −0.220 
                 48.758 
                 1.00 
                 43.83 
                 O 
               
               
                 ATOM 
                 3292 
                 O 
                 HOH 
                 W 
                 16 
                 14.574 
                 24.569 
                 28.773 
                 1.00 
                 50.25 
                 O 
               
               
                 ATOM 
                 3293 
                 O 
                 HOH 
                 W 
                 17 
                 17.273 
                 23.275 
                 28.770 
                 1.00 
                 32.25 
                 O 
               
               
                 ATOM 
                 3294 
                 O 
                 HOH 
                 W 
                 18 
                 15.628 
                 9.857 
                 28.519 
                 1.00 
                 31.38 
                 O 
               
               
                 ATOM 
                 3295 
                 O 
                 HOH 
                 W 
                 19 
                 47.486 
                 29.840 
                 6.150 
                 1.00 
                 53.53 
                 O 
               
               
                 ATOM 
                 3296 
                 O 
                 HOH 
                 W 
                 20 
                 64.546 
                 22.854 
                 17.164 
                 1.00 
                 47.54 
                 O 
               
               
                 ATOM 
                 3297 
                 O 
                 HOH 
                 W 
                 21 
                 13.831 
                 9.756 
                 34.661 
                 1.00 
                 48.11 
                 O 
               
               
                 ATOM 
                 3298 
                 O 
                 HOH 
                 W 
                 22 
                 53.874 
                 4.595 
                 9.539 
                 1.00 
                 29.77 
                 O 
               
               
                 ATOM 
                 3299 
                 O 
                 HOH 
                 W 
                 23 
                 17.826 
                 11.221 
                 28.000 
                 1.00 
                 37.97 
                 O 
               
               
                 ATOM 
                 3300 
                 O 
                 HOH 
                 W 
                 24 
                 21.478 
                 16.649 
                 31.244 
                 1.00 
                 29.30 
                 O 
               
               
                 ATOM 
                 3301 
                 O 
                 HOH 
                 W 
                 25 
                 61.648 
                 23.163 
                 −6.346 
                 1.00 
                 41.07 
                 O 
               
               
                 ATOM 
                 3302 
                 O 
                 HOH 
                 W 
                 26 
                 17.685 
                 −4.024 
                 28.143 
                 1.00 
                 45.65 
                 O 
               
               
                 ATOM 
                 3303 
                 O 
                 HOH 
                 W 
                 27 
                 18.676 
                 48.553 
                 28.572 
                 1.00 
                 49.95 
                 O 
               
               
                 ATOM 
                 3304 
                 O 
                 HOH 
                 W 
                 28 
                 28.883 
                 35.475 
                 31.748 
                 1.00 
                 65.90 
                 O 
               
               
                 ATOM 
                 3305 
                 O 
                 HOH 
                 W 
                 29 
                 26.495 
                 13.768 
                 28.887 
                 1.00 
                 28.89 
                 O 
               
               
                 ATOM 
                 3306 
                 O 
                 HOH 
                 W 
                 30 
                 20.570 
                 7.084 
                 21.442 
                 1.00 
                 45.88 
                 O 
               
               
                 ATOM 
                 3307 
                 O 
                 HOH 
                 W 
                 31 
                 25.634 
                 10.403 
                 29.395 
                 1.00 
                 35.32 
                 O 
               
               
                 ATOM 
                 3308 
                 O 
                 HOH 
                 W 
                 32 
                 62.535 
                 39.022 
                 −0.570 
                 1.00 
                 46.92 
                 O 
               
               
                 ATOM 
                 3309 
                 O 
                 HOH 
                 W 
                 33 
                 67.283 
                 26.093 
                 −4.127 
                 1.00 
                 33.73 
                 O 
               
               
                 ATOM 
                 3310 
                 O 
                 HOH 
                 W 
                 34 
                 27.566 
                 41.774 
                 33.161 
                 1.00 
                 68.26 
                 O 
               
               
                 ATOM 
                 3311 
                 O 
                 HOH 
                 W 
                 35 
                 24.143 
                 13.706 
                 28.178 
                 1.00 
                 29.46 
                 O 
               
               
                 ATOM 
                 3312 
                 O 
                 HOH 
                 W 
                 36 
                 30.372 
                 26.293 
                 12.250 
                 1.00 
                 72.48 
                 O 
               
               
                 ATOM 
                 3313 
                 O 
                 HOH 
                 W 
                 37 
                 45.656 
                 20.943 
                 8.052 
                 1.00 
                 33.27 
                 O 
               
               
                 ATOM 
                 3314 
                 O 
                 HOH 
                 W 
                 38 
                 48.649 
                 7.010 
                 15.549 
                 1.00 
                 53.94 
                 O 
               
               
                 ATOM 
                 3315 
                 O 
                 HOH 
                 W 
                 39 
                 31.570 
                 18.599 
                 13.713 
                 1.00 
                 41.28 
                 O 
               
               
                 ATOM 
                 3316 
                 O 
                 HOH 
                 W 
                 40 
                 53.663 
                 7.208 
                 10.450 
                 1.00 
                 34.57 
                 O 
               
               
                 ATOM 
                 3317 
                 O 
                 HOH 
                 W 
                 41 
                 38.580 
                 12.260 
                 2.002 
                 1.00 
                 37.67 
                 O 
               
               
                 ATOM 
                 3318 
                 O 
                 HOH 
                 W 
                 42 
                 68.611 
                 36.093 
                 1.637 
                 1.00 
                 58.68 
                 O 
               
               
                 ATOM 
                 3319 
                 O 
                 HOH 
                 W 
                 43 
                 66.806 
                 32.948 
                 6.043 
                 1.00 
                 28.02 
                 O 
               
               
                 ATOM 
                 3320 
                 O 
                 HOH 
                 W 
                 44 
                 50.597 
                 16.056 
                 2.995 
                 1.00 
                 20.92 
                 O 
               
               
                 ATOM 
                 3321 
                 O 
                 HOH 
                 W 
                 45 
                 32.402 
                 18.632 
                 9.245 
                 1.00 
                 57.58 
                 O 
               
               
                 ATOM 
                 3322 
                 O 
                 HOH 
                 W 
                 46 
                 17.826 
                 −1.585 
                 26.168 
                 1.00 
                 33.42 
                 O 
               
               
                 ATOM 
                 3323 
                 O 
                 HOH 
                 W 
                 47 
                 27.978 
                 18.431 
                 13.061 
                 1.00 
                 32.36 
                 O 
               
               
                 ATOM 
                 3324 
                 O 
                 HOH 
                 W 
                 48 
                 31.130 
                 23.731 
                 14.541 
                 1.00 
                 49.15 
                 O 
               
               
                 ATOM 
                 3325 
                 O 
                 HOH 
                 W 
                 49 
                 42.973 
                 18.176 
                 6.181 
                 1.00 
                 33.87 
                 O 
               
               
                 ATOM 
                 3326 
                 O 
                 HOH 
                 W 
                 50 
                 32.854 
                 1.573 
                 13.656 
                 1.00 
                 69.40 
                 O 
               
               
                 ATOM 
                 3327 
                 O 
                 HOH 
                 W 
                 51 
                 61.024 
                 21.580 
                 −8.223 
                 1.00 
                 33.81 
                 O 
               
               
                 ATOM 
                 3328 
                 O 
                 HOH 
                 W 
                 52 
                 21.853 
                 18.003 
                 33.363 
                 1.00 
                 35.88 
                 O 
               
               
                 ATOM 
                 3329 
                 O 
                 HOH 
                 W 
                 53 
                 28.214 
                 18.749 
                 29.985 
                 1.00 
                 36.72 
                 O 
               
               
                 ATOM 
                 3330 
                 O 
                 HOH 
                 W 
                 54 
                 47.190 
                 27.455 
                 4.981 
                 1.00 
                 33.48 
                 O 
               
               
                 ATOM 
                 3331 
                 O 
                 HOH 
                 W 
                 55 
                 48.698 
                 14.899 
                 12.805 
                 1.00 
                 36.47 
                 O 
               
               
                 ATOM 
                 3332 
                 O 
                 HOH 
                 W 
                 56 
                 22.007 
                 13.901 
                 29.964 
                 1.00 
                 43.41 
                 O 
               
               
                 ATOM 
                 3333 
                 O 
                 HOH 
                 W 
                 57 
                 22.817 
                 3.633 
                 29.513 
                 1.00 
                 56.91 
                 O 
               
               
                 ATOM 
                 3334 
                 O 
                 HOH 
                 W 
                 58 
                 58.369 
                 24.559 
                 −5.982 
                 1.00 
                 20.15 
                 O 
               
               
                 ATOM 
                 3335 
                 O 
                 HOH 
                 W 
                 59 
                 24.791 
                 22.275 
                 12.738 
                 1.00 
                 29.00 
                 O 
               
               
                 ATOM 
                 3336 
                 O 
                 HOH 
                 W 
                 60 
                 32.506 
                 39.375 
                 33.303 
                 1.00 
                 38.43 
                 O 
               
               
                 ATOM 
                 3337 
                 O 
                 HOH 
                 W 
                 61 
                 53.833 
                 40.967 
                 1.428 
                 1.00 
                 45.08 
                 O 
               
               
                 ATOM 
                 3338 
                 O 
                 HOH 
                 W 
                 62 
                 57.058 
                 27.269 
                 −9.143 
                 1.00 
                 40.00 
                 O 
               
               
                 ATOM 
                 3339 
                 O 
                 HOH 
                 W 
                 63 
                 69.526 
                 32.652 
                 5.064 
                 1.00 
                 33.59 
                 O 
               
               
                 ATOM 
                 3340 
                 O 
                 HOH 
                 W 
                 64 
                 26.026 
                 46.491 
                 29.214 
                 1.00 
                 49.43 
                 O 
               
               
                 ATOM 
                 3341 
                 O 
                 HOH 
                 W 
                 65 
                 7.535 
                 −12.277 
                 43.624 
                 1.00 
                 38.83 
                 O 
               
               
                 ATOM 
                 3342 
                 O 
                 HOH 
                 W 
                 66 
                 57.673 
                 36.036 
                 −4.990 
                 1.00 
                 58.18 
                 O 
               
               
                 ATOM 
                 3343 
                 O 
                 HOH 
                 W 
                 67 
                 25.219 
                 2.698 
                 45.646 
                 1.00 
                 63.61 
                 O 
               
               
                 ATOM 
                 3344 
                 O 
                 HOH 
                 W 
                 68 
                 15.224 
                 15.226 
                 16.533 
                 1.00 
                 44.99 
                 O 
               
               
                 ATOM 
                 3345 
                 O 
                 HOH 
                 W 
                 69 
                 14.303 
                 30.312 
                 26.773 
                 1.00 
                 55.43 
                 O 
               
               
                 ATOM 
                 3346 
                 O 
                 HOH 
                 W 
                 70 
                 27.473 
                 17.640 
                 8.014 
                 1.00 
                 44.24 
                 O 
               
               
                 ATOM 
                 3347 
                 O 
                 HOH 
                 W 
                 71 
                 33.541 
                 14.753 
                 28.074 
                 1.00 
                 57.64 
                 O 
               
               
                 ATOM 
                 3348 
                 O 
                 HOH 
                 W 
                 72 
                 24.106 
                 −5.245 
                 36.422 
                 1.00 
                 35.69 
                 O 
               
               
                 ATOM 
                 3349 
                 O 
                 HOH 
                 W 
                 73 
                 19.945 
                 −3.453 
                 25.718 
                 1.00 
                 62.43 
                 O 
               
               
                 ATOM 
                 3350 
                 O 
                 HOH 
                 W 
                 74 
                 27.055 
                 43.217 
                 29.667 
                 1.00 
                 36.48 
                 O 
               
               
                 ATOM 
                 3351 
                 O 
                 HOH 
                 W 
                 75 
                 61.808 
                 21.334 
                 21.511 
                 1.00 
                 41.05 
                 O 
               
               
                 ATOM 
                 3352 
                 O 
                 HOH 
                 W 
                 76 
                 28.392 
                 −1.577 
                 41.924 
                 1.00 
                 40.31 
                 O 
               
               
                 ATOM 
                 3353 
                 O 
                 HOH 
                 W 
                 77 
                 41.700 
                 24.432 
                 10.528 
                 1.00 
                 50.92 
                 O 
               
               
                 ATOM 
                 3354 
                 O 
                 HOH 
                 W 
                 78 
                 56.356 
                 17.804 
                 −2.343 
                 1.00 
                 37.41 
                 O 
               
               
                 ATOM 
                 3355 
                 O 
                 HOH 
                 W 
                 79 
                 36.787 
                 28.401 
                 12.252 
                 1.00 
                 59.49 
                 O 
               
               
                 ATOM 
                 3356 
                 O 
                 HOH 
                 W 
                 80 
                 47.719 
                 11.922 
                 11.398 
                 1.00 
                 44.13 
                 O 
               
               
                 ATOM 
                 3357 
                 O 
                 HOH 
                 W 
                 81 
                 4.122 
                 −2.877 
                 44.501 
                 1.00 
                 47.12 
                 O 
               
               
                 ATOM 
                 3358 
                 O 
                 HOH 
                 W 
                 82 
                 52.740 
                 31.000 
                 −8.756 
                 1.00 
                 43.99 
                 O 
               
               
                 ATOM 
                 3359 
                 O 
                 HOH 
                 W 
                 83 
                 7.919 
                 −11.057 
                 46.234 
                 1.00 
                 41.46 
                 O 
               
               
                 ATOM 
                 3360 
                 O 
                 HOH 
                 W 
                 84 
                 32.706 
                 34.935 
                 19.255 
                 1.00 
                 42.71 
                 O 
               
               
                 ATOM 
                 3361 
                 O 
                 HOH 
                 W 
                 85 
                 59.882 
                 27.603 
                 19.759 
                 1.00 
                 61.63 
                 O 
               
               
                 ATOM 
                 3362 
                 O 
                 HOH 
                 W 
                 86 
                 32.168 
                 6.815 
                 13.604 
                 1.00 
                 49.25 
                 O 
               
               
                 ATOM 
                 3363 
                 O 
                 HOH 
                 W 
                 87 
                 59.729 
                 2.501 
                 13.133 
                 1.00 
                 38.27 
                 O 
               
               
                 ATOM 
                 3364 
                 O 
                 HOH 
                 W 
                 88 
                 56.064 
                 4.299 
                 10.903 
                 1.00 
                 35.41 
                 O 
               
               
                 ATOM 
                 3365 
                 O 
                 HOH 
                 W 
                 89 
                 30.138 
                 −2.702 
                 33.252 
                 1.00 
                 47.19 
                 O 
               
               
                 ATOM 
                 3366 
                 O 
                 HOH 
                 W 
                 90 
                 38.708 
                 21.593 
                 5.409 
                 1.00 
                 46.41 
                 O 
               
               
                 ATOM 
                 3367 
                 O 
                 HOH 
                 W 
                 91 
                 28.192 
                 17.922 
                 37.236 
                 1.00 
                 50.27 
                 O 
               
               
                 ATOM 
                 3368 
                 O 
                 HOH 
                 W 
                 92 
                 29.568 
                 3.973 
                 44.497 
                 1.00 
                 56.59 
                 O 
               
               
                 ATOM 
                 3369 
                 O 
                 HOH 
                 W 
                 93 
                 34.862 
                 20.140 
                 13.615 
                 1.00 
                 58.79 
                 O 
               
               
                 ATOM 
                 3370 
                 O 
                 HOH 
                 W 
                 94 
                 68.056 
                 37.171 
                 −4.566 
                 1.00 
                 46.07 
                 O 
               
               
                 ATOM 
                 3371 
                 O 
                 HOH 
                 W 
                 95 
                 20.067 
                 −18.415 
                 28.488 
                 1.00 
                 39.57 
                 O 
               
               
                 ATOM 
                 3372 
                 O 
                 HOH 
                 W 
                 96 
                 64.699 
                 22.658 
                 1.365 
                 1.00 
                 35.36 
                 O 
               
               
                 ATOM 
                 3373 
                 O 
                 HOH 
                 W 
                 97 
                 66.830 
                 20.070 
                 6.461 
                 1.00 
                 40.73 
                 O 
               
               
                 ATOM 
                 3374 
                 O 
                 HOH 
                 W 
                 98 
                 21.629 
                 21.137 
                 36.271 
                 1.00 
                 45.67 
                 O 
               
               
                 ATOM 
                 3375 
                 O 
                 HOH 
                 W 
                 99 
                 35.422 
                 2.703 
                 41.956 
                 1.00 
                 52.70 
                 O 
               
               
                 ATOM 
                 3376 
                 O 
                 HOH 
                 W 
                 100 
                 24.037 
                 1.650 
                 19.799 
                 1.00 
                 58.56 
                 O 
               
               
                 ATOM 
                 3377 
                 O 
                 HOH 
                 W 
                 101 
                 61.498 
                 2.982 
                 15.930 
                 1.00 
                 55.15 
                 O 
               
               
                 ATOM 
                 3378 
                 O 
                 HOH 
                 W 
                 102 
                 35.953 
                 15.608 
                 4.118 
                 1.00 
                 25.75 
                 O 
               
               
                 ATOM 
                 3379 
                 O 
                 HOH 
                 W 
                 103 
                 25.517 
                 31.363 
                 12.480 
                 1.00 
                 39.04 
                 O 
               
               
                 ATOM 
                 3380 
                 O 
                 HOH 
                 W 
                 104 
                 16.726 
                 21.992 
                 15.197 
                 1.00 
                 52.30 
                 O 
               
               
                 ATOM 
                 3381 
                 O 
                 HOH 
                 W 
                 105 
                 52.552 
                 23.250 
                 25.811 
                 1.00 
                 48.16 
                 O 
               
               
                 ATOM 
                 3382 
                 O 
                 HOH 
                 W 
                 106 
                 24.153 
                 12.188 
                 30.527 
                 1.00 
                 27.39 
                 O 
               
               
                 ATOM 
                 3383 
                 O 
                 HOH 
                 W 
                 107 
                 53.933 
                 −9.516 
                 4.486 
                 1.00 
                 42.89 
                 O 
               
               
                 ATOM 
                 3384 
                 O 
                 HOH 
                 W 
                 108 
                 23.827 
                 37.285 
                 16.265 
                 1.00 
                 54.62 
                 O 
               
               
                 ATOM 
                 3385 
                 O 
                 HOH 
                 W 
                 109 
                 28.396 
                 33.187 
                 28.407 
                 1.00 
                 53.09 
                 O 
               
               
                 ATOM 
                 3386 
                 O 
                 HOH 
                 W 
                 110 
                 31.985 
                 20.657 
                 32.687 
                 1.00 
                 58.85 
                 O 
               
               
                 ATOM 
                 3387 
                 O 
                 HOH 
                 W 
                 111 
                 18.171 
                 −15.401 
                 30.507 
                 1.00 
                 56.89 
                 O 
               
               
                 ATOM 
                 3388 
                 O 
                 HOH 
                 W 
                 112 
                 22.082 
                 0.773 
                 46.243 
                 1.00 
                 48.16 
                 O 
               
               
                 ATOM 
                 3389 
                 O 
                 HOH 
                 W 
                 113 
                 34.526 
                 22.736 
                 14.520 
                 1.00 
                 41.26 
                 O 
               
               
                 ATOM 
                 3390 
                 O 
                 HOH 
                 W 
                 114 
                 22.419 
                 6.371 
                 28.995 
                 1.00 
                 56.85 
                 O 
               
               
                 ATOM 
                 3391 
                 O 
                 HOH 
                 W 
                 115 
                 67.422 
                 16.825 
                 11.168 
                 1.00 
                 60.46 
                 O 
               
               
                 ATOM 
                 3392 
                 O 
                 HOH 
                 W 
                 116 
                 67.448 
                 23.130 
                 0.776 
                 1.00 
                 33.43 
                 O 
               
               
                 ATOM 
                 3393 
                 O 
                 HOH 
                 W 
                 117 
                 18.592 
                 16.299 
                 30.811 
                 1.00 
                 42.83 
                 O 
               
               
                 ATOM 
                 3394 
                 O 
                 HOH 
                 W 
                 118 
                 34.587 
                 24.867 
                 10.841 
                 1.00 
                 54.23 
                 O 
               
               
                 ATOM 
                 3395 
                 O 
                 HOH 
                 W 
                 119 
                 30.859 
                 34.219 
                 31.592 
                 1.00 
                 42.88 
                 O 
               
               
                 ATOM 
                 3396 
                 O 
                 HOH 
                 W 
                 120 
                 49.605 
                 4.517 
                 19.934 
                 1.00 
                 62.19 
                 O 
               
               
                 ATOM 
                 3397 
                 O 
                 HOH 
                 W 
                 121 
                 5.422 
                 −5.622 
                 26.696 
                 1.00 
                 68.49 
                 O 
               
               
                 ATOM 
                 3398 
                 O 
                 HOH 
                 W 
                 122 
                 17.557 
                 13.571 
                 16.130 
                 1.00 
                 43.21 
                 O 
               
               
                 ATOM 
                 3399 
                 O 
                 HOH 
                 W 
                 123 
                 27.902 
                 37.884 
                 19.254 
                 1.00 
                 64.98 
                 O 
               
               
                 ATOM 
                 3400 
                 O 
                 HOH 
                 W 
                 124 
                 17.490 
                 12.457 
                 13.620 
                 1.00 
                 56.86 
                 O 
               
               
                 ATOM 
                 3401 
                 O 
                 HOH 
                 W 
                 125 
                 25.374 
                 44.666 
                 33.403 
                 1.00 
                 46.35 
                 O 
               
               
                 ATOM 
                 3402 
                 O 
                 HOH 
                 W 
                 126 
                 12.246 
                 0.705 
                 24.754 
                 1.00 
                 56.61 
                 O 
               
               
                 ATOM 
                 3403 
                 O 
                 HOH 
                 W 
                 127 
                 22.142 
                 5.206 
                 26.086 
                 1.00 
                 40.68 
                 O 
               
               
                 ATOM 
                 3404 
                 O 
                 HOH 
                 W 
                 128 
                 37.638 
                 −12.506 
                 6.296 
                 1.00 
                 57.01 
                 O 
               
               
                 ATOM 
                 3405 
                 O 
                 HOH 
                 W 
                 129 
                 48.345 
                 16.352 
                 1.698 
                 1.00 
                 30.83 
                 O 
               
               
                 ATOM 
                 3406 
                 O 
                 HOH 
                 W 
                 130 
                 20.648 
                 20.480 
                 33.583 
                 1.00 
                 34.60 
                 O 
               
               
                 ATOM 
                 3407 
                 O 
                 HOH 
                 W 
                 131 
                 64.275 
                 41.462 
                 −8.991 
                 1.00 
                 47.63 
                 O 
               
               
                 ATOM 
                 3408 
                 O 
                 HOH 
                 W 
                 132 
                 60.760 
                 12.924 
                 7.514 
                 1.00 
                 49.20 
                 O 
               
               
                 ATOM 
                 3409 
                 O 
                 HOH 
                 W 
                 133 
                 50.675 
                 6.054 
                 17.267 
                 1.00 
                 41.28 
                 O 
               
               
                 ATOM 
                 3410 
                 O 
                 HOH 
                 W 
                 134 
                 33.273 
                 −5.842 
                 12.720 
                 1.00 
                 54.10 
                 O 
               
               
                 ATOM 
                 3411 
                 O 
                 HOH 
                 W 
                 135 
                 32.026 
                 34.506 
                 33.860 
                 1.00 
                 62.11 
                 O 
               
               
                 ATOM 
                 3412 
                 O 
                 HOH 
                 W 
                 136 
                 30.538 
                 27.830 
                 33.165 
                 1.00 
                 49.21 
                 O 
               
               
                 ATOM 
                 3413 
                 O 
                 HOH 
                 W 
                 137 
                 46.775 
                 19.029 
                 10.612 
                 1.00 
                 52.46 
                 O 
               
               
                 ATOM 
                 3414 
                 O 
                 HOH 
                 W 
                 138 
                 67.563 
                 23.044 
                 3.123 
                 1.00 
                 36.24 
                 O 
               
               
                 ATOM 
                 3415 
                 O 
                 HOH 
                 W 
                 139 
                 39.108 
                 16.251 
                 0.823 
                 1.00 
                 51.06 
                 O 
               
               
                 ATOM 
                 3416 
                 O 
                 HOH 
                 W 
                 140 
                 20.593 
                 22.210 
                 39.321 
                 1.00 
                 53.90 
                 O 
               
               
                 ATOM 
                 3417 
                 O 
                 HOH 
                 W 
                 141 
                 46.106 
                 8.016 
                 1.533 
                 1.00 
                 37.88 
                 O 
               
               
                 ATOM 
                 3418 
                 O 
                 HOH 
                 W 
                 142 
                 52.095 
                 35.903 
                 9.125 
                 1.00 
                 32.61 
                 O 
               
               
                 ATOM 
                 3419 
                 O 
                 HOH 
                 W 
                 143 
                 75.389 
                 25.371 
                 16.968 
                 1.00 
                 35.99 
                 O 
               
               
                 ATOM 
                 3420 
                 O 
                 HOH 
                 W 
                 144 
                 15.057 
                 9.817 
                 16.549 
                 1.00 
                 65.48 
                 O 
               
               
                 ATOM 
                 3421 
                 O 
                 HOH 
                 W 
                 145 
                 37.631 
                 28.173 
                 28.732 
                 1.00 
                 38.60 
                 O 
               
               
                 ATOM 
                 3422 
                 O 
                 HOH 
                 W 
                 146 
                 66.515 
                 22.664 
                 20.027 
                 1.00 
                 52.17 
                 O 
               
               
                 ATOM 
                 3423 
                 O 
                 HOH 
                 W 
                 147 
                 42.528 
                 −7.022 
                 23.940 
                 1.00 
                 71.26 
                 O 
               
               
                 ATOM 
                 3424 
                 O 
                 HOH 
                 W 
                 148 
                 54.947 
                 −3.340 
                 6.545 
                 1.00 
                 55.11 
                 O 
               
               
                 ATOM 
                 3425 
                 O 
                 HOH 
                 W 
                 149 
                 28.775 
                 −10.352 
                 32.112 
                 1.00 
                 44.73 
                 O 
               
               
                 ATOM 
                 3426 
                 O 
                 HOH 
                 W 
                 150 
                 18.892 
                 31.401 
                 12.777 
                 1.00 
                 37.43 
                 O 
               
               
                 ATOM 
                 3427 
                 O 
                 HOH 
                 W 
                 151 
                 9.905 
                 −12.495 
                 39.620 
                 1.00 
                 32.28 
                 O 
               
               
                 ATOM 
                 3428 
                 O 
                 HOH 
                 W 
                 152 
                 38.303 
                 −19.018 
                 4.482 
                 1.00 
                 70.97 
                 O 
               
               
                 ATOM 
                 3429 
                 O 
                 HOH 
                 W 
                 153 
                 15.856 
                 34.267 
                 36.720 
                 1.00 
                 58.14 
                 O 
               
               
                 ATOM 
                 3430 
                 O 
                 HOH 
                 W 
                 154 
                 30.760 
                 5.017 
                 7.768 
                 1.00 
                 43.73 
                 O 
               
               
                 ATOM 
                 3431 
                 O 
                 HOH 
                 W 
                 155 
                 16.890 
                 20.222 
                 33.788 
                 1.00 
                 49.43 
                 O 
               
               
                 ATOM 
                 3432 
                 O 
                 HOH 
                 W 
                 156 
                 33.273 
                 2.733 
                 7.110 
                 1.00 
                 39.05 
                 O 
               
               
                 ATOM 
                 3433 
                 O 
                 HOH 
                 W 
                 157 
                 49.572 
                 43.793 
                 7.514 
                 1.00 
                 43.22 
                 O 
               
               
                 ATOM 
                 3434 
                 O 
                 HOH 
                 W 
                 158 
                 30.541 
                 3.798 
                 48.182 
                 1.00 
                 55.17 
                 O 
               
               
                 ATOM 
                 3435 
                 O 
                 HOH 
                 W 
                 159 
                 16.015 
                 34.924 
                 32.024 
                 1.00 
                 48.83 
                 O 
               
               
                 ATOM 
                 3436 
                 O 
                 HOH 
                 W 
                 160 
                 51.712 
                 35.074 
                 −4.804 
                 1.00 
                 64.25 
                 O 
               
               
                 ATOM 
                 3437 
                 O 
                 HOH 
                 W 
                 161 
                 36.464 
                 −3.007 
                 −0.285 
                 1.00 
                 38.44 
                 O 
               
               
                 ATOM 
                 3438 
                 O 
                 HOH 
                 W 
                 162 
                 16.182 
                 15.269 
                 31.037 
                 1.00 
                 66.49 
                 O 
               
               
                 ATOM 
                 3439 
                 O 
                 HOH 
                 W 
                 163 
                 35.025 
                 8.191 
                 26.758 
                 1.00 
                 58.94 
                 O 
               
               
                 ATOM 
                 3440 
                 O 
                 HOH 
                 W 
                 164 
                 66.113 
                 10.299 
                 20.931 
                 1.00 
                 56.12 
                 O 
               
               
                 ATOM 
                 3441 
                 O 
                 HOH 
                 W 
                 165 
                 55.630 
                 −22.839 
                 7.058 
                 1.00 
                 40.94 
                 O 
               
               
                 ATOM 
                 3442 
                 O 
                 HOH 
                 W 
                 166 
                 70.597 
                 24.001 
                 10.339 
                 1.00 
                 38.15 
                 O 
               
               
                 ATOM 
                 3443 
                 O 
                 HOH 
                 W 
                 167 
                 33.827 
                 8.257 
                 29.433 
                 1.00 
                 47.62 
                 O 
               
               
                 ATOM 
                 3444 
                 O 
                 HOH 
                 W 
                 168 
                 38.651 
                 3.562 
                 1.821 
                 1.00 
                 46.00 
                 O 
               
               
                 ATOM 
                 3445 
                 O 
                 HOH 
                 W 
                 169 
                 17.931 
                 8.596 
                 15.903 
                 1.00 
                 63.55 
                 O 
               
               
                 ATOM 
                 3446 
                 O 
                 HOH 
                 W 
                 170 
                 53.590 
                 12.112 
                 2.058 
                 1.00 
                 52.40 
                 O 
               
               
                 ATOM 
                 3447 
                 O 
                 HOH 
                 W 
                 171 
                 12.498 
                 6.890 
                 22.243 
                 1.00 
                 48.61 
                 O 
               
               
                 ATOM 
                 3448 
                 O 
                 HOH 
                 W 
                 172 
                 45.282 
                 16.726 
                 −1.766 
                 1.00 
                 53.43 
                 O 
               
               
                 ATOM 
                 3449 
                 O 
                 HOH 
                 W 
                 173 
                 33.374 
                 0.766 
                 3.579 
                 1.00 
                 48.57 
                 O 
               
               
                 ATOM 
                 3450 
                 O 
                 HOH 
                 W 
                 174 
                 17.563 
                 13.972 
                 38.450 
                 1.00 
                 48.25 
                 O 
               
               
                 ATOM 
                 3451 
                 O 
                 HOH 
                 W 
                 175 
                 68.951 
                 20.742 
                 22.836 
                 1.00 
                 58.59 
                 O 
               
               
                 ATOM 
                 3452 
                 O 
                 HOH 
                 W 
                 176 
                 37.600 
                 −19.066 
                 −0.214 
                 1.00 
                 54.28 
                 O 
               
               
                 ATOM 
                 3453 
                 O 
                 HOH 
                 W 
                 177 
                 58.850 
                 2.171 
                 16.664 
                 1.00 
                 66.83 
                 O 
               
               
                 ATOM 
                 3454 
                 O 
                 HOH 
                 W 
                 178 
                 37.338 
                 −18.592 
                 14.900 
                 1.00 
                 66.88 
                 O 
               
               
                 ATOM 
                 3455 
                 O 
                 HOH 
                 W 
                 179 
                 9.482 
                 6.134 
                 21.968 
                 1.00 
                 71.18 
                 O 
               
               
                 ATOM 
                 3456 
                 O 
                 HOH 
                 W 
                 180 
                 15.502 
                 31.876 
                 18.773 
                 1.00 
                 54.02 
                 O 
               
               
                 ATOM 
                 3457 
                 O 
                 HOH 
                 W 
                 181 
                 14.514 
                 −4.130 
                 26.924 
                 1.00 
                 55.36 
                 O 
               
               
                 ATOM 
                 3458 
                 O 
                 HOH 
                 W 
                 182 
                 70.672 
                 29.846 
                 −1.684 
                 1.00 
                 60.93 
                 O 
               
               
                 ATOM 
                 3459 
                 O 
                 HOH 
                 W 
                 183 
                 51.258 
                 13.722 
                 1.255 
                 1.00 
                 43.34 
                 O 
               
               
                 ATOM 
                 3460 
                 O 
                 HOH 
                 W 
                 184 
                 10.716 
                 1.766 
                 47.290 
                 1.00 
                 67.75 
                 O 
               
               
                 ATOM 
                 3461 
                 O 
                 HOH 
                 W 
                 185 
                 58.832 
                 8.512 
                 6.813 
                 1.00 
                 53.65 
                 O 
               
               
                 ATOM 
                 3462 
                 O 
                 HOH 
                 W 
                 186 
                 −4.086 
                 −12.572 
                 36.744 
                 1.00 
                 62.79 
                 O 
               
               
                 ATOM 
                 3463 
                 O 
                 HOH 
                 W 
                 187 
                 46.508 
                 24.691 
                 2.250 
                 1.00 
                 47.04 
                 O 
               
               
                 ATOM 
                 3464 
                 O 
                 HOH 
                 W 
                 188 
                 13.873 
                 5.882 
                 44.387 
                 1.00 
                 58.50 
                 O 
               
               
                 ATOM 
                 3465 
                 O 
                 HOH 
                 W 
                 189 
                 51.139 
                 28.495 
                 18.297 
                 1.00 
                 57.53 
                 O 
               
               
                 ATOM 
                 3466 
                 O 
                 HOH 
                 W 
                 190 
                 30.947 
                 10.141 
                 52.110 
                 1.00 
                 57.16 
                 O 
               
               
                 ATOM 
                 3467 
                 O 
                 HOH 
                 W 
                 191 
                 65.605 
                 25.389 
                 14.283 
                 1.00 
                 43.24 
                 O 
               
               
                 ATOM 
                 3468 
                 O 
                 HOH 
                 W 
                 192 
                 18.126 
                 13.182 
                 30.638 
                 1.00 
                 41.72 
                 O 
               
               
                 ATOM 
                 3469 
                 O 
                 HOH 
                 W 
                 193 
                 55.794 
                 −1.873 
                 17.214 
                 1.00 
                 36.16 
                 O 
               
               
                 ATOM 
                 3470 
                 O 
                 HOH 
                 W 
                 194 
                 33.783 
                 33.110 
                 17.457 
                 1.00 
                 54.55 
                 O 
               
               
                 ATOM 
                 3471 
                 O 
                 HOH 
                 W 
                 195 
                 38.853 
                 −14.910 
                 11.939 
                 1.00 
                 63.88 
                 O 
               
               
                 ATOM 
                 3472 
                 O 
                 HOH 
                 W 
                 196 
                 49.456 
                 22.757 
                 10.865 
                 1.00 
                 63.46 
                 O 
               
               
                 ATOM 
                 3473 
                 O 
                 HOH 
                 W 
                 197 
                 28.587 
                 7.862 
                 11.381 
                 1.00 
                 52.03 
                 O 
               
               
                 ATOM 
                 3474 
                 O 
                 HOH 
                 W 
                 198 
                 34.947 
                 35.941 
                 19.703 
                 1.00 
                 70.80 
                 O 
               
               
                 ATOM 
                 3475 
                 O 
                 HOH 
                 W 
                 199 
                 55.475 
                 24.490 
                 −7.980 
                 1.00 
                 51.18 
                 O 
               
               
                 ATOM 
                 3476 
                 O 
                 HOH 
                 W 
                 200 
                 56.743 
                 13.758 
                 −6.598 
                 1.00 
                 65.21 
                 O 
               
               
                 ATOM 
                 3477 
                 O 
                 HOH 
                 W 
                 201 
                 12.911 
                 −7.264 
                 23.286 
                 1.00 
                 60.82 
                 O 
               
               
                 ATOM 
                 3478 
                 O 
                 HOH 
                 W 
                 202 
                 5.138 
                 2.264 
                 22.647 
                 1.00 
                 62.03 
                 O 
               
               
                 ATOM 
                 3479 
                 O 
                 HOH 
                 W 
                 203 
                 13.304 
                 35.163 
                 27.777 
                 1.00 
                 46.47 
                 O 
               
               
                 ATOM 
                 3480 
                 O 
                 HOH 
                 W 
                 204 
                 25.888 
                 −4.844 
                 26.526 
                 1.00 
                 48.34 
                 O 
               
               
                 ATOM 
                 3481 
                 O 
                 HOH 
                 W 
                 205 
                 14.760 
                 20.897 
                 17.935 
                 1.00 
                 40.89 
                 O 
               
               
                 ATOM 
                 3482 
                 O 
                 HOH 
                 W 
                 206 
                 53.987 
                 26.147 
                 −11.062 
                 1.00 
                 49.82 
                 O 
               
               
                 ATOM 
                 3483 
                 O 
                 HOH 
                 W 
                 207 
                 68.989 
                 21.658 
                 5.489 
                 1.00 
                 44.82 
                 O 
               
               
                 ATOM 
                 3484 
                 O 
                 HOH 
                 W 
                 208 
                 4.346 
                 1.281 
                 33.781 
                 1.00 
                 35.17 
                 O 
               
               
                 ATOM 
                 3485 
                 O 
                 HOH 
                 W 
                 209 
                 43.654 
                 22.216 
                 2.326 
                 1.00 
                 56.61 
                 O 
               
               
                 ATOM 
                 3486 
                 O 
                 HOH 
                 W 
                 210 
                 57.660 
                 −0.011 
                 17.662 
                 1.00 
                 57.39 
                 O 
               
               
                 ATOM 
                 3487 
                 O 
                 HOH 
                 W 
                 211 
                 21.597 
                 34.434 
                 36.749 
                 1.00 
                 53.23 
                 O 
               
               
                 ATOM 
                 3488 
                 O 
                 HOH 
                 W 
                 212 
                 14.578 
                 8.819 
                 26.105 
                 1.00 
                 36.35 
                 O 
               
               
                 ATOM 
                 3489 
                 O 
                 HOH 
                 W 
                 213 
                 13.688 
                 13.351 
                 16.929 
                 1.00 
                 60.60 
                 O 
               
               
                 ATOM 
                 3490 
                 O 
                 HOH 
                 W 
                 214 
                 6.756 
                 −7.170 
                 24.322 
                 1.00 
                 56.84 
                 O 
               
               
                 ATOM 
                 3491 
                 O 
                 HOH 
                 W 
                 215 
                 67.898 
                 11.572 
                 28.182 
                 1.00 
                 55.11 
                 O 
               
               
                 ATOM 
                 3492 
                 O 
                 HOH 
                 W 
                 216 
                 57.714 
                 24.233 
                 22.731 
                 1.00 
                 44.21 
                 O 
               
               
                 ATOM 
                 3493 
                 O 
                 HOH 
                 W 
                 217 
                 58.213 
                 41.336 
                 −4.038 
                 1.00 
                 57.86 
                 O 
               
               
                 ATOM 
                 3494 
                 O 
                 HOH 
                 W 
                 218 
                 12.270 
                 −5.061 
                 48.893 
                 1.00 
                 43.21 
                 O 
               
               
                 ATOM 
                 3495 
                 O 
                 HOH 
                 W 
                 219 
                 70.379 
                 28.854 
                 2.049 
                 1.00 
                 42.00 
                 O 
               
               
                 ATOM 
                 3496 
                 O 
                 HOH 
                 W 
                 220 
                 50.260 
                 −5.040 
                 1.589 
                 1.00 
                 48.18 
                 O 
               
               
                 ATOM 
                 3497 
                 O 
                 HOH 
                 W 
                 221 
                 56.271 
                 31.125 
                 −7.728 
                 1.00 
                 52.70 
                 O 
               
               
                 ATOM 
                 3498 
                 O 
                 HOH 
                 W 
                 222 
                 14.596 
                 5.260 
                 21.037 
                 1.00 
                 66.32 
                 O 
               
               
                 ATOM 
                 3499 
                 O 
                 HOH 
                 W 
                 223 
                 34.755 
                 −8.144 
                 17.238 
                 1.00 
                 51.05 
                 O 
               
               
                 ATOM 
                 3500 
                 O 
                 HOH 
                 W 
                 224 
                 48.049 
                 −5.297 
                 0.350 
                 1.00 
                 51.97 
                 O 
               
               
                 ATOM 
                 3501 
                 O 
                 HOH 
                 W 
                 225 
                 39.891 
                 10.372 
                 −0.744 
                 1.00 
                 57.12 
                 O 
               
               
                 ATOM 
                 3502 
                 O 
                 HOH 
                 W 
                 226 
                 56.777 
                 16.253 
                 3.098 
                 1.00 
                 44.22 
                 O 
               
               
                 ATOM 
                 3503 
                 O 
                 HOH 
                 W 
                 227 
                 41.686 
                 6.425 
                 30.801 
                 1.00 
                 58.48 
                 O 
               
               
                 ATOM 
                 3504 
                 O 
                 HOH 
                 W 
                 228 
                 31.152 
                 3.461 
                 14.490 
                 1.00 
                 61.32 
                 O 
               
               
                 ATOM 
                 3505 
                 O 
                 HOH 
                 W 
                 229 
                 20.483 
                 5.907 
                 24.097 
                 1.00 
                 54.34 
                 O 
               
               
                 ATOM 
                 3506 
                 O 
                 HOH 
                 W 
                 230 
                 19.242 
                 7.120 
                 14.031 
                 1.00 
                 41.44 
                 O 
               
               
                 ATOM 
                 3507 
                 O 
                 HOH 
                 W 
                 231 
                 31.016 
                 13.010 
                 −0.673 
                 1.00 
                 38.51 
                 O 
               
               
                 ATOM 
                 3508 
                 O 
                 HOH 
                 W 
                 232 
                 70.871 
                 26.732 
                 9.211 
                 1.00 
                 50.35 
                 O 
               
               
                 ATOM 
                 3509 
                 O 
                 HOH 
                 W 
                 233 
                 62.530 
                 5.381 
                 16.924 
                 1.00 
                 69.00 
                 O 
               
               
                 ATOM 
                 3510 
                 O 
                 HOH 
                 W 
                 234 
                 58.689 
                 10.135 
                 26.681 
                 1.00 
                 61.24 
                 O 
               
               
                 ATOM 
                 3511 
                 O 
                 HOH 
                 W 
                 235 
                 48.099 
                 28.707 
                 −1.499 
                 1.00 
                 41.34 
                 O 
               
               
                 ATOM 
                 3512 
                 O 
                 HOH 
                 W 
                 236 
                 56.075 
                 11.436 
                 −8.202 
                 1.00 
                 72.01 
                 O 
               
               
                 ATOM 
                 3513 
                 O 
                 HOH 
                 W 
                 237 
                 44.741 
                 25.584 
                 8.874 
                 1.00 
                 56.34 
                 O 
               
               
                 ATOM 
                 3514 
                 O 
                 HOH 
                 W 
                 238 
                 25.074 
                 2.290 
                 49.071 
                 1.00 
                 61.02 
                 O 
               
               
                 ATOM 
                 3515 
                 O 
                 HOH 
                 W 
                 239 
                 13.166 
                 21.601 
                 29.112 
                 1.00 
                 61.73 
                 O 
               
               
                 ATOM 
                 3516 
                 O 
                 HOH 
                 W 
                 240 
                 27.871 
                 0.758 
                 7.409 
                 1.00 
                 58.43 
                 O 
               
               
                 ATOM 
                 3517 
                 O 
                 HOH 
                 W 
                 241 
                 29.447 
                 3.216 
                 9.465 
                 1.00 
                 45.36 
                 O 
               
               
                 ATOM 
                 3518 
                 O 
                 HOH 
                 W 
                 242 
                 33.613 
                 −4.885 
                 10.263 
                 1.00 
                 47.86 
                 O 
               
               
                 ATOM 
                 3519 
                 O 
                 HOH 
                 W 
                 243 
                 53.720 
                 6.429 
                 0.325 
                 1.00 
                 57.39 
                 O 
               
               
                 ATOM 
                 3520 
                 O 
                 HOH 
                 W 
                 244 
                 29.614 
                 2.734 
                 6.372 
                 1.00 
                 50.86 
                 O 
               
               
                 ATOM 
                 3521 
                 O 
                 HOH 
                 W 
                 245 
                 17.179 
                 1.833 
                 49.731 
                 1.00 
                 29.82 
                 O 
               
               
                 ATOM 
                 3522 
                 O 
                 HOH 
                 W 
                 246 
                 19.272 
                 8.281 
                 10.603 
                 1.00 
                 48.32 
                 O 
               
               
                 ATOM 
                 3523 
                 O 
                 HOH 
                 W 
                 247 
                 40.725 
                 −15.193 
                 24.266 
                 1.00 
                 53.01 
                 O 
               
               
                 ATOM 
                 3524 
                 O 
                 HOH 
                 W 
                 248 
                 29.119 
                 −7.888 
                 30.396 
                 1.00 
                 49.32 
                 O 
               
               
                 ATOM 
                 3525 
                 O 
                 HOH 
                 W 
                 249 
                 49.189 
                 23.307 
                 −5.216 
                 1.00 
                 42.80 
                 O 
               
               
                 ATOM 
                 3526 
                 O 
                 HOH 
                 W 
                 250 
                 54.694 
                 28.682 
                 −11.150 
                 1.00 
                 66.83 
                 O 
               
               
                 ATOM 
                 3527 
                 O 
                 HOH 
                 W 
                 251 
                 60.944 
                 16.846 
                 0.662 
                 1.00 
                 52.36 
                 O 
               
               
                 ATOM 
                 3528 
                 O 
                 HOH 
                 W 
                 252 
                 16.228 
                 18.028 
                 33.087 
                 1.00 
                 49.65 
                 O 
               
               
                 ATOM 
                 3529 
                 O 
                 HOH 
                 W 
                 253 
                 45.158 
                 30.281 
                 11.427 
                 1.00 
                 45.27 
                 O 
               
               
                 ATOM 
                 3530 
                 O 
                 HOH 
                 W 
                 254 
                 26.898 
                 6.397 
                 13.473 
                 1.00 
                 50.93 
                 O 
               
               
                 ATOM 
                 3531 
                 O 
                 HOH 
                 W 
                 255 
                 57.476 
                 −18.207 
                 3.515 
                 1.00 
                 68.56 
                 O 
               
               
                 ATOM 
                 3532 
                 O 
                 HOH 
                 W 
                 256 
                 32.813 
                 19.282 
                 2.967 
                 1.00 
                 36.17 
                 O 
               
               
                 ATOM 
                 3533 
                 O 
                 HOH 
                 W 
                 257 
                 9.491 
                 2.419 
                 44.597 
                 1.00 
                 52.45 
                 O 
               
               
                 ATOM 
                 3534 
                 O 
                 HOH 
                 W 
                 258 
                 35.271 
                 −3.932 
                 16.911 
                 1.00 
                 66.53 
                 O 
               
               
                 ATOM 
                 3535 
                 O 
                 HOH 
                 W 
                 259 
                 49.732 
                 14.842 
                 −2.401 
                 1.00 
                 43.97 
                 O 
               
               
                 ATOM 
                 3536 
                 O 
                 HOH 
                 W 
                 260 
                 27.521 
                 20.972 
                 11.308 
                 1.00 
                 47.00 
                 O 
               
               
                 ATOM 
                 3537 
                 O 
                 HOH 
                 W 
                 261 
                 43.115 
                 10.114 
                 −1.913 
                 1.00 
                 35.84 
                 O 
               
               
                 ATOM 
                 3538 
                 O 
                 HOH 
                 W 
                 262 
                 21.275 
                 0.044 
                 21.585 
                 1.00 
                 67.57 
                 O 
               
               
                 ATOM 
                 3539 
                 O 
                 HOH 
                 W 
                 263 
                 37.120 
                 20.797 
                 18.864 
                 1.00 
                 79.96 
                 O 
               
               
                 ATOM 
                 3540 
                 O 
                 HOH 
                 W 
                 264 
                 47.410 
                 −17.381 
                 18.378 
                 1.00 
                 74.12 
                 O 
               
               
                 ATOM 
                 3541 
                 O 
                 HOH 
                 W 
                 265 
                 62.924 
                 21.666 
                 −0.960 
                 1.00 
                 50.01 
                 O 
               
               
                 ATOM 
                 3542 
                 O 
                 HOH 
                 W 
                 266 
                 35.999 
                 −1.885 
                 −2.786 
                 1.00 
                 49.94 
                 O 
               
               
                 ATOM 
                 3543 
                 O 
                 HOH 
                 W 
                 267 
                 74.941 
                 28.538 
                 16.431 
                 1.00 
                 59.06 
                 O 
               
               
                 ATOM 
                 3544 
                 O 
                 HOH 
                 W 
                 268 
                 46.761 
                 1.281 
                 −0.475 
                 1.00 
                 67.06 
                 O 
               
               
                 ATOM 
                 3545 
                 O 
                 HOH 
                 W 
                 269 
                 48.670 
                 8.707 
                 0.836 
                 1.00 
                 49.88 
                 O 
               
               
                 ATOM 
                 3546 
                 O 
                 HOH 
                 W 
                 270 
                 66.079 
                 13.752 
                 6.762 
                 1.00 
                 42.69 
                 O 
               
               
                 ATOM 
                 3547 
                 O 
                 HOH 
                 W 
                 271 
                 16.090 
                 16.729 
                 37.464 
                 1.00 
                 69.24 
                 O 
               
               
                 ATOM 
                 3548 
                 O 
                 HOH 
                 W 
                 272 
                 77.143 
                 27.199 
                 11.644 
                 1.00 
                 52.10 
                 O 
               
               
                 ATOM 
                 3549 
                 O 
                 HOH 
                 W 
                 273 
                 51.882 
                 22.494 
                 −6.310 
                 1.00 
                 59.08 
                 O 
               
               
                 ATOM 
                 3550 
                 O 
                 HOH 
                 W 
                 274 
                 50.771 
                 43.361 
                 4.510 
                 1.00 
                 48.05 
                 O 
               
               
                 ATOM 
                 3551 
                 O 
                 HOH 
                 W 
                 275 
                 46.898 
                 34.616 
                 12.107 
                 1.00 
                 65.71 
                 O 
               
               
                 ATOM 
                 3552 
                 O 
                 HOH 
                 W 
                 276 
                 23.075 
                 46.450 
                 29.289 
                 1.00 
                 47.04 
                 O 
               
               
                 ATOM 
                 3553 
                 O 
                 HOH 
                 W 
                 277 
                 14.404 
                 12.889 
                 31.126 
                 1.00 
                 57.95 
                 O 
               
               
                 ATOM 
                 3554 
                 O 
                 HOH 
                 W 
                 278 
                 36.453 
                 −11.467 
                 1.613 
                 1.00 
                 57.63 
                 O 
               
               
                 ATOM 
                 3555 
                 O 
                 HOH 
                 W 
                 279 
                 8.112 
                 9.700 
                 21.211 
                 1.00 
                 59.50 
                 O 
               
               
                 ATOM 
                 3556 
                 O 
                 HOH 
                 W 
                 280 
                 46.998 
                 14.682 
                 −2.760 
                 1.00 
                 52.71 
                 O 
               
               
                 ATOM 
                 3557 
                 O 
                 HOH 
                 W 
                 281 
                 17.921 
                 3.335 
                 17.731 
                 1.00 
                 49.98 
                 O 
               
               
                 ATOM 
                 3558 
                 O 
                 HOH 
                 W 
                 282 
                 32.865 
                 28.042 
                 19.693 
                 1.00 
                 50.59 
                 O 
               
               
                 ATOM 
                 3559 
                 O 
                 HOH 
                 W 
                 283 
                 25.586 
                 31.869 
                 10.003 
                 1.00 
                 63.81 
                 O 
               
               
                 ATOM 
                 3560 
                 O 
                 HOH 
                 W 
                 284 
                 31.186 
                 −6.345 
                 2.371 
                 1.00 
                 49.17 
                 O 
               
               
                 ATOM 
                 3561 
                 O 
                 HOH 
                 W 
                 285 
                 15.416 
                 17.750 
                 24.533 
                 1.00 
                 48.35 
                 O 
               
               
                 ATOM 
                 3562 
                 O 
                 HOH 
                 W 
                 286 
                 38.078 
                 −16.872 
                 18.075 
                 1.00 
                 71.42 
                 O 
               
               
                 ATOM 
                 3563 
                 O 
                 HOH 
                 W 
                 287 
                 9.244 
                 3.329 
                 41.771 
                 1.00 
                 50.93 
                 O 
               
               
                 ATOM 
                 3564 
                 O 
                 HOH 
                 W 
                 288 
                 52.401 
                 34.885 
                 3.571 
                 1.00 
                 60.33 
                 O 
               
               
                 ATOM 
                 3565 
                 O 
                 HOH 
                 W 
                 289 
                 31.377 
                 39.196 
                 25.255 
                 1.00 
                 51.58 
                 O 
               
               
                 ATOM 
                 3566 
                 O 
                 HOH 
                 W 
                 290 
                 14.500 
                 17.886 
                 22.018 
                 1.00 
                 50.10 
                 O 
               
               
                 ATOM 
                 3567 
                 O 
                 HOH 
                 W 
                 291 
                 40.282 
                 7.206 
                 17.126 
                 1.00 
                 42.88 
                 O 
               
               
                 ATOM 
                 3568 
                 O 
                 HOH 
                 W 
                 292 
                 30.260 
                 17.132 
                 9.954 
                 1.00 
                 55.27 
                 O 
               
               
                 ATOM 
                 3569 
                 O 
                 HOH 
                 W 
                 293 
                 38.681 
                 −1.970 
                 −2.008 
                 1.00 
                 60.38 
                 O 
               
               
                 ATOM 
                 3570 
                 O 
                 HOH 
                 W 
                 294 
                 19.629 
                 9.142 
                 21.868 
                 1.00 
                 62.74 
                 O 
               
               
                 ATOM 
                 3571 
                 O 
                 HOH 
                 W 
                 295 
                 15.109 
                 −8.962 
                 30.732 
                 1.00 
                 50.70 
                 O 
               
               
                 ATOM 
                 3572 
                 O 
                 HOH 
                 W 
                 296 
                 20.081 
                 2.438 
                 49.837 
                 1.00 
                 47.62 
                 O 
               
               
                 ATOM 
                 3573 
                 O 
                 HOH 
                 W 
                 297 
                 56.603 
                 15.529 
                 −0.198 
                 1.00 
                 46.06 
                 O 
               
               
                 ATOM 
                 3574 
                 O 
                 HOH 
                 W 
                 298 
                 27.818 
                 6.514 
                 7.376 
                 1.00 
                 50.96 
                 O 
               
               
                 ATOM 
                 3575 
                 O 
                 HOH 
                 W 
                 299 
                 24.897 
                 22.369 
                 9.701 
                 1.00 
                 32.90 
                 O 
               
               
                 ATOM 
                 3576 
                 O 
                 HOH 
                 W 
                 300 
                 54.872 
                 −12.316 
                 12.229 
                 1.00 
                 64.45 
                 O 
               
               
                 ATOM 
                 3577 
                 O 
                 HOH 
                 W 
                 301 
                 47.153 
                 −4.394 
                 19.519 
                 1.00 
                 51.72 
                 O 
               
               
                 ATOM 
                 3578 
                 O 
                 HOH 
                 W 
                 302 
                 28.548 
                 27.445 
                 38.300 
                 1.00 
                 57.61 
                 O 
               
               
                 ATOM 
                 3579 
                 O 
                 HOH 
                 W 
                 303 
                 44.013 
                 −17.633 
                 4.722 
                 1.00 
                 75.42 
                 O 
               
               
                 ATOM 
                 3580 
                 O 
                 HOH 
                 W 
                 304 
                 48.151 
                 26.251 
                 −1.702 
                 1.00 
                 38.80 
                 O 
               
               
                 ATOM 
                 3581 
                 O 
                 HOH 
                 W 
                 305 
                 19.193 
                 10.914 
                 11.697 
                 1.00 
                 47.15 
                 O 
               
               
                 ATOM 
                 3582 
                 O 
                 HOH 
                 W 
                 306 
                 22.985 
                 24.448 
                 10.233 
                 1.00 
                 42.45 
                 O 
               
               
                 ATOM 
                 3583 
                 O 
                 HOH 
                 W 
                 307 
                 37.607 
                 −9.929 
                 15.371 
                 1.00 
                 54.35 
                 O 
               
               
                 ATOM 
                 3584 
                 O 
                 HOH 
                 W 
                 308 
                 53.957 
                 −16.667 
                 11.106 
                 1.00 
                 73.02 
                 O 
               
               
                 ATOM 
                 3585 
                 O 
                 HOH 
                 W 
                 309 
                 11.604 
                 28.463 
                 23.443 
                 1.00 
                 76.29 
                 O 
               
               
                 ATOM 
                 3586 
                 O 
                 HOH 
                 W 
                 310 
                 31.389 
                 2.126 
                 35.240 
                 1.00 
                 54.80 
                 O 
               
               
                 ATOM 
                 3587 
                 O 
                 HOH 
                 W 
                 311 
                 41.669 
                 −17.196 
                 13.469 
                 1.00 
                 55.16 
                 O 
               
               
                 ATOM 
                 3588 
                 O 
                 HOH 
                 W 
                 312 
                 23.733 
                 40.464 
                 35.441 
                 1.00 
                 58.58 
                 O 
               
               
                 ATOM 
                 3589 
                 O 
                 HOH 
                 W 
                 313 
                 20.071 
                 8.403 
                 45.139 
                 1.00 
                 55.44 
                 O 
               
               
                 ATOM 
                 3590 
                 O 
                 HOH 
                 W 
                 314 
                 68.778 
                 28.533 
                 17.512 
                 1.00 
                 45.32 
                 O 
               
               
                 ATOM 
                 3591 
                 O 
                 HOH 
                 W 
                 315 
                 64.181 
                 14.152 
                 10.857 
                 1.00 
                 51.72 
                 O 
               
               
                 ATOM 
                 3592 
                 O 
                 HOH 
                 W 
                 316 
                 29.049 
                 1.903 
                 46.292 
                 1.00 
                 43.97 
                 O 
               
               
                 ATOM 
                 3593 
                 O 
                 HOH 
                 W 
                 317 
                 62.143 
                 14.172 
                 9.271 
                 1.00 
                 63.02 
                 O 
               
               
                 ATOM 
                 3594 
                 O 
                 HOH 
                 W 
                 318 
                 24.107 
                 −2.007 
                 49.865 
                 1.00 
                 38.66 
                 O 
               
               
                 ATOM 
                 3595 
                 O 
                 HOH 
                 W 
                 319 
                 41.007 
                 −7.072 
                 0.043 
                 1.00 
                 56.35 
                 O 
               
               
                 ATOM 
                 3596 
                 O 
                 HOH 
                 W 
                 320 
                 68.195 
                 21.721 
                 14.142 
                 1.00 
                 46.50 
                 O 
               
               
                 ATOM 
                 3597 
                 O 
                 HOH 
                 W 
                 321 
                 22.462 
                 39.174 
                 37.178 
                 1.00 
                 69.52 
                 O 
               
               
                 ATOM 
                 3598 
                 O 
                 HOH 
                 W 
                 322 
                 17.783 
                 6.183 
                 19.862 
                 1.00 
                 54.61 
                 O 
               
               
                 ATOM 
                 3599 
                 O 
                 HOH 
                 W 
                 323 
                 46.953 
                 22.632 
                 18.131 
                 1.00 
                 51.51 
                 O 
               
               
                 ATOM 
                 3600 
                 O 
                 HOH 
                 W 
                 324 
                 30.988 
                 −1.282 
                 12.374 
                 1.00 
                 50.56 
                 O 
               
               
                 ATOM 
                 3601 
                 O 
                 HOH 
                 W 
                 325 
                 46.824 
                 9.645 
                 16.570 
                 1.00 
                 76.67 
                 O 
               
               
                 ATOM 
                 3602 
                 O 
                 HOH 
                 W 
                 326 
                 47.709 
                 3.790 
                 27.072 
                 1.00 
                 52.42 
                 O 
               
               
                 ATOM 
                 3603 
                 O 
                 HOH 
                 W 
                 327 
                 37.100 
                 14.801 
                 1.681 
                 1.00 
                 49.38 
                 O 
               
               
                 ATOM 
                 3604 
                 O 
                 HOH 
                 W 
                 328 
                 41.476 
                 −1.502 
                 0.396 
                 1.00 
                 58.29 
                 O 
               
               
                 ATOM 
                 3605 
                 O 
                 HOH 
                 W 
                 329 
                 67.547 
                 38.430 
                 −0.728 
                 1.00 
                 44.88 
                 O 
               
               
                 ATOM 
                 3606 
                 O 
                 HOH 
                 W 
                 330 
                 62.517 
                 25.184 
                 21.058 
                 1.00 
                 64.10 
                 O 
               
               
                 ATOM 
                 3607 
                 O 
                 HOH 
                 W 
                 331 
                 −0.557 
                 −2.635 
                 37.863 
                 1.00 
                 45.19 
                 O 
               
               
                 ATOM 
                 3608 
                 O 
                 HOH 
                 W 
                 332 
                 69.664 
                 27.202 
                 −0.020 
                 1.00 
                 51.53 
                 O 
               
               
                 ATOM 
                 3609 
                 O 
                 HOH 
                 W 
                 333 
                 30.130 
                 −0.340 
                 29.038 
                 1.00 
                 57.18 
                 O 
               
               
                 ATOM 
                 3610 
                 O 
                 HOH 
                 W 
                 334 
                 51.237 
                 27.533 
                 −6.173 
                 1.00 
                 47.91 
                 O 
               
               
                 ATOM 
                 3611 
                 O 
                 HOH 
                 W 
                 335 
                 0.933 
                 −1.230 
                 32.070 
                 1.00 
                 57.36 
                 O 
               
               
                 ATOM 
                 3612 
                 O 
                 HOH 
                 W 
                 336 
                 31.115 
                 −13.376 
                 −0.361 
                 1.00 
                 45.10 
                 O 
               
               
                 ATOM 
                 3613 
                 O 
                 HOH 
                 W 
                 337 
                 45.532 
                 6.225 
                 27.169 
                 1.00 
                 66.83 
                 O 
               
               
                 ATOM 
                 3614 
                 O 
                 HOH 
                 W 
                 338 
                 38.789 
                 −3.517 
                 28.225 
                 1.00 
                 63.88 
                 O 
               
               
                 ATOM 
                 3615 
                 O 
                 HOH 
                 W 
                 339 
                 21.603 
                 23.747 
                 35.437 
                 1.00 
                 58.20 
                 O 
               
               
                 ATOM 
                 3616 
                 O 
                 HOH 
                 W 
                 340 
                 51.744 
                 32.705 
                 1.437 
                 1.00 
                 69.55 
                 O 
               
               
                 ATOM 
                 3617 
                 O 
                 HOH 
                 W 
                 341 
                 53.285 
                 23.459 
                 20.176 
                 1.00 
                 50.19 
                 O 
               
               
                 ATOM 
                 3618 
                 O 
                 HOH 
                 W 
                 342 
                 50.116 
                 30.832 
                 6.312 
                 1.00 
                 31.41 
                 O 
               
               
                 ATOM 
                 3619 
                 O 
                 HOH 
                 W 
                 343 
                 56.433 
                 5.701 
                 7.393 
                 1.00 
                 42.02 
                 O 
               
               
                 ATOM 
                 3620 
                 O 
                 HOH 
                 W 
                 344 
                 37.416 
                 20.918 
                 24.575 
                 1.00 
                 55.74 
                 O 
               
               
                 ATOM 
                 3621 
                 O 
                 HOH 
                 W 
                 345 
                 67.567 
                 26.023 
                 15.813 
                 1.00 
                 43.48 
                 O 
               
               
                 ATOM 
                 3622 
                 O 
                 HOH 
                 W 
                 346 
                 14.406 
                 44.657 
                 26.427 
                 1.00 
                 65.51 
                 O 
               
               
                 ATOM 
                 3623 
                 O 
                 HOH 
                 W 
                 347 
                 17.703 
                 5.856 
                 16.750 
                 1.00 
                 45.27 
                 O 
               
               
                 ATOM 
                 3624 
                 O 
                 HOH 
                 W 
                 348 
                 44.529 
                 25.367 
                 21.896 
                 1.00 
                 61.22 
                 O 
               
               
                 ATOM 
                 3625 
                 O 
                 HOH 
                 W 
                 349 
                 43.676 
                 8.317 
                 25.804 
                 1.00 
                 47.68 
                 O 
               
               
                 ATOM 
                 3626 
                 O 
                 HOH 
                 W 
                 350 
                 59.266 
                 11.361 
                 7.848 
                 1.00 
                 69.95 
                 O 
               
               
                 ATOM 
                 3627 
                 O 
                 HOH 
                 W 
                 351 
                 50.382 
                 13.506 
                 12.091 
                 1.00 
                 35.61 
                 O 
               
               
                 ATOM 
                 3628 
                 O 
                 HOH 
                 W 
                 352 
                 52.344 
                 20.190 
                 −3.908 
                 1.00 
                 41.33 
                 O 
               
               
                 ATOM 
                 3629 
                 O 
                 HOH 
                 W 
                 353 
                 70.633 
                 22.306 
                 8.035 
                 1.00 
                 49.69 
                 O 
               
               
                 ATOM 
                 3630 
                 O 
                 HOH 
                 W 
                 354 
                 20.918 
                 9.448 
                 14.526 
                 1.00 
                 49.51 
                 O 
               
               
                 ATOM 
                 3631 
                 O 
                 HOH 
                 W 
                 355 
                 46.850 
                 29.538 
                 −5.784 
                 1.00 
                 55.83 
                 O 
               
               
                 ATOM 
                 3632 
                 O 
                 HOH 
                 W 
                 356 
                 7.257 
                 −10.627 
                 28.472 
                 1.00 
                 75.56 
                 O 
               
               
                 ATOM 
                 3633 
                 O 
                 HOH 
                 W 
                 357 
                 29.522 
                 21.084 
                 28.772 
                 1.00 
                 29.76 
                 O 
               
               
                 ATOM 
                 3634 
                 O 
                 HOH 
                 W 
                 358 
                 58.141 
                 −5.422 
                 8.999 
                 1.00 
                 72.75 
                 O 
               
               
                 ATOM 
                 3635 
                 O 
                 HOH 
                 W 
                 359 
                 44.287 
                 32.961 
                 31.887 
                 1.00 
                 52.80 
                 O 
               
               
                 ATOM 
                 3636 
                 O 
                 HOH 
                 W 
                 360 
                 52.292 
                 13.939 
                 −1.485 
                 1.00 
                 45.87 
                 O 
               
               
                 ATOM 
                 3637 
                 O 
                 HOH 
                 W 
                 361 
                 38.838 
                 −12.010 
                 13.154 
                 1.00 
                 53.39 
                 O 
               
               
                 ATOM 
                 3638 
                 O 
                 HOH 
                 W 
                 362 
                 71.746 
                 29.166 
                 11.917 
                 1.00 
                 66.84 
                 O 
               
               
                 ATOM 
                 3639 
                 O 
                 HOH 
                 W 
                 363 
                 34.791 
                 26.989 
                 17.836 
                 1.00 
                 58.17 
                 O 
               
               
                 ATOM 
                 3640 
                 O 
                 HOH 
                 W 
                 364 
                 49.720 
                 18.422 
                 10.244 
                 1.00 
                 58.39 
                 O 
               
               
                 ATOM 
                 3641 
                 O 
                 HOH 
                 W 
                 365 
                 36.609 
                 −19.691 
                 18.159 
                 1.00 
                 56.62 
                 O 
               
               
                 ATOM 
                 3642 
                 O 
                 HOH 
                 W 
                 366 
                 52.019 
                 34.567 
                 −0.128 
                 1.00 
                 62.35 
                 O 
               
               
                 ATOM 
                 3643 
                 O 
                 HOH 
                 W 
                 367 
                 8.099 
                 4.733 
                 38.644 
                 1.00 
                 59.14 
                 O 
               
               
                 ATOM 
                 3644 
                 O 
                 HOH 
                 W 
                 368 
                 24.162 
                 43.585 
                 29.340 
                 1.00 
                 54.80 
                 O 
               
               
                 ATOM 
                 3645 
                 O 
                 HOH 
                 W 
                 369 
                 12.065 
                 11.038 
                 40.551 
                 1.00 
                 50.21 
                 O 
               
               
                 ATOM 
                 3646 
                 O 
                 HOH 
                 W 
                 370 
                 51.445 
                 34.226 
                 7.596 
                 1.00 
                 46.49 
                 O 
               
               
                 ATOM 
                 3647 
                 O 
                 HOH 
                 W 
                 371 
                 46.917 
                 37.194 
                 10.718 
                 1.00 
                 47.06 
                 O 
               
               
                 ATOM 
                 3648 
                 O 
                 HOH 
                 W 
                 372 
                 37.530 
                 8.417 
                 −1.409 
                 1.00 
                 50.26 
                 O 
               
               
                 ATOM 
                 3649 
                 O 
                 HOH 
                 W 
                 373 
                 16.046 
                 20.046 
                 23.951 
                 1.00 
                 62.38 
                 O 
               
               
                 ATOM 
                 3650 
                 O 
                 HOH 
                 W 
                 374 
                 31.497 
                 29.299 
                 30.333 
                 1.00 
                 55.86 
                 O 
               
               
                 ATOM 
                 3651 
                 O 
                 HOH 
                 W 
                 375 
                 55.680 
                 31.078 
                 13.913 
                 1.00 
                 66.00 
                 O 
               
               
                 ATOM 
                 3652 
                 O 
                 HOH 
                 W 
                 376 
                 −1.126 
                 −12.205 
                 37.405 
                 1.00 
                 46.93 
                 O 
               
               
                 ATOM 
                 3653 
                 O 
                 HOH 
                 W 
                 377 
                 57.780 
                 19.822 
                 −4.481 
                 1.00 
                 52.77 
                 O 
               
               
                 ATOM 
                 3654 
                 O 
                 HOH 
                 W 
                 378 
                 20.558 
                 24.848 
                 11.749 
                 1.00 
                 44.63 
                 O 
               
               
                 ATOM 
                 3655 
                 O 
                 HOH 
                 W 
                 379 
                 18.424 
                 49.479 
                 19.940 
                 1.00 
                 56.67 
                 O 
               
               
                 ATOM 
                 3656 
                 O 
                 HOH 
                 W 
                 380 
                 22.486 
                 31.556 
                 10.000 
                 1.00 
                 50.34 
                 O 
               
               
                 ATOM 
                 3657 
                 O 
                 HOH 
                 W 
                 381 
                 53.741 
                 23.702 
                 −9.251 
                 1.00 
                 48.43 
                 O 
               
               
                 ATOM 
                 3658 
                 O 
                 HOH 
                 W 
                 382 
                 34.525 
                 24.186 
                 16.557 
                 1.00 
                 65.32 
                 O 
               
               
                 ATOM 
                 3659 
                 O 
                 HOH 
                 W 
                 383 
                 17.235 
                 19.518 
                 21.375 
                 1.00 
                 58.33 
                 O 
               
               
                 ATOM 
                 3660 
                 O 
                 HOH 
                 W 
                 384 
                 57.882 
                 3.621 
                 8.079 
                 1.00 
                 39.82 
                 O 
               
               
                 ATOM 
                 3661 
                 O 
                 HOH 
                 W 
                 385 
                 26.561 
                 28.879 
                 35.275 
                 1.00 
                 73.69 
                 O 
               
               
                 ATOM 
                 3662 
                 O 
                 HOH 
                 W 
                 386 
                 45.960 
                 30.047 
                 14.517 
                 1.00 
                 40.29 
                 O 
               
               
                 ATOM 
                 3663 
                 O 
                 HOH 
                 W 
                 387 
                 24.745 
                 5.242 
                 28.231 
                 1.00 
                 77.59 
                 O 
               
               
                 ATOM 
                 3664 
                 O 
                 HOH 
                 W 
                 388 
                 38.843 
                 −22.197 
                 1.181 
                 1.00 
                 69.86 
                 O 
               
               
                 ATOM 
                 3665 
                 O 
                 HOH 
                 W 
                 389 
                 24.914 
                 45.052 
                 21.953 
                 1.00 
                 47.80 
                 O 
               
               
                 ATOM 
                 3666 
                 O 
                 HOH 
                 W 
                 390 
                 23.968 
                 5.180 
                 9.472 
                 1.00 
                 36.09 
                 O 
               
               
                 ATOM 
                 3667 
                 O 
                 HOH 
                 W 
                 391 
                 45.167 
                 22.341 
                 10.168 
                 1.00 
                 58.85 
                 O 
               
               
                 ATOM 
                 3668 
                 O 
                 HOH 
                 W 
                 392 
                 63.994 
                 23.103 
                 −6.623 
                 1.00 
                 41.36 
                 O 
               
               
                 ATOM 
                 3669 
                 O 
                 HOH 
                 W 
                 393 
                 43.211 
                 28.094 
                 26.866 
                 1.00 
                 64.82 
                 O 
               
               
                 ATOM 
                 3670 
                 O 
                 HOH 
                 W 
                 394 
                 12.463 
                 10.420 
                 17.753 
                 1.00 
                 51.83 
                 O 
               
               
                 ATOM 
                 3671 
                 O 
                 HOH 
                 W 
                 395 
                 23.822 
                 27.573 
                 41.487 
                 1.00 
                 37.27 
                 O 
               
               
                 ATOM 
                 3672 
                 O 
                 HOH 
                 W 
                 396 
                 13.987 
                 41.496 
                 29.635 
                 1.00 
                 62.16 
                 O 
               
               
                 ATOM 
                 3673 
                 O 
                 HOH 
                 W 
                 397 
                 33.026 
                 22.598 
                 37.699 
                 1.00 
                 51.26 
                 O 
               
               
                 ATOM 
                 3674 
                 O 
                 HOH 
                 W 
                 398 
                 64.548 
                 15.778 
                 25.784 
                 1.00 
                 73.76 
                 O 
               
               
                 ATOM 
                 3675 
                 O 
                 HOH 
                 W 
                 399 
                 4.456 
                 6.820 
                 31.188 
                 1.00 
                 52.61 
                 O 
               
               
                 ATOM 
                 3676 
                 O 
                 HOH 
                 W 
                 400 
                 56.245 
                 22.603 
                 −12.779 
                 1.00 
                 69.18 
                 O 
               
               
                 ATOM 
                 3677 
                 O 
                 HOH 
                 W 
                 401 
                 21.852 
                 21.246 
                 43.752 
                 1.00 
                 49.06 
                 O 
               
               
                 ATOM 
                 3678 
                 O 
                 HOH 
                 W 
                 402 
                 53.672 
                 −4.770 
                 2.592 
                 1.00 
                 66.30 
                 O 
               
               
                 ATOM 
                 3679 
                 O 
                 HOH 
                 W 
                 403 
                 40.577 
                 22.543 
                 17.517 
                 1.00 
                 55.37 
                 O 
               
               
                 ATOM 
                 3680 
                 O 
                 HOH 
                 W 
                 404 
                 39.682 
                 23.255 
                 9.179 
                 1.00 
                 40.71 
                 O 
               
               
                 ATOM 
                 3681 
                 O 
                 HOH 
                 W 
                 405 
                 26.738 
                 24.263 
                 8.013 
                 1.00 
                 54.59 
                 O 
               
               
                 ATOM 
                 3682 
                 O 
                 HOH 
                 W 
                 406 
                 50.210 
                 0.374 
                 1.209 
                 1.00 
                 50.49 
                 O 
               
               
                 ATOM 
                 3683 
                 O 
                 HOH 
                 W 
                 407 
                 60.590 
                 19.355 
                 27.471 
                 1.00 
                 47.33 
                 O 
               
               
                 ATOM 
                 3684 
                 O 
                 HOH 
                 W 
                 408 
                 4.171 
                 −0.693 
                 25.748 
                 1.00 
                 66.54 
                 O 
               
               
                 ATOM 
                 3685 
                 O 
                 HOH 
                 W 
                 409 
                 45.385 
                 8.836 
                 27.640 
                 1.00 
                 48.88 
                 O 
               
               
                 ATOM 
                 3686 
                 O 
                 HOH 
                 W 
                 410 
                 37.725 
                 11.971 
                 26.053 
                 1.00 
                 62.01 
                 O 
               
               
                 ATOM 
                 3687 
                 O 
                 HOH 
                 W 
                 411 
                 45.832 
                 8.800 
                 −1.281 
                 1.00 
                 46.54 
                 O 
               
               
                 ATOM 
                 3688 
                 O 
                 HOH 
                 W 
                 412 
                 13.221 
                 11.782 
                 28.251 
                 1.00 
                 39.21 
                 O 
               
               
                 ATOM 
                 3689 
                 O 
                 HOH 
                 W 
                 413 
                 23.976 
                 47.982 
                 18.021 
                 1.00 
                 53.62 
                 O 
               
               
                 ATOM 
                 3690 
                 O 
                 HOH 
                 W 
                 414 
                 63.898 
                 17.108 
                 27.312 
                 1.00 
                 46.28 
                 O 
               
               
                 ATOM 
                 3691 
                 O 
                 HOH 
                 W 
                 415 
                 5.585 
                 −10.312 
                 33.042 
                 1.00 
                 48.81 
                 O 
               
               
                 ATOM 
                 3692 
                 O 
                 HOH 
                 W 
                 416 
                 38.213 
                 2.921 
                 −0.615 
                 1.00 
                 52.43 
                 O 
               
               
                 ATOM 
                 3693 
                 O 
                 HOH 
                 W 
                 417 
                 11.363 
                 8.700 
                 42.372 
                 1.00 
                 63.77 
                 O 
               
               
                 ATOM 
                 3694 
                 O 
                 HOH 
                 W 
                 418 
                 38.189 
                 −2.578 
                 16.862 
                 1.00 
                 48.54 
                 O 
               
               
                 ATOM 
                 3695 
                 O 
                 HOH 
                 W 
                 419 
                 35.880 
                 21.127 
                 45.601 
                 1.00 
                 56.00 
                 O 
               
               
                 ATOM 
                 3696 
                 O 
                 HOH 
                 W 
                 420 
                 57.494 
                 8.004 
                 2.119 
                 1.00 
                 53.09 
                 O 
               
               
                 ATOM 
                 3697 
                 O 
                 HOH 
                 W 
                 421 
                 59.320 
                 −4.060 
                 11.061 
                 1.00 
                 53.50 
                 O 
               
               
                 ATOM 
                 3698 
                 O 
                 HOH 
                 W 
                 422 
                 31.364 
                 1.362 
                 44.832 
                 1.00 
                 47.58 
                 O 
               
               
                 ATOM 
                 3699 
                 O 
                 HOH 
                 W 
                 423 
                 64.047 
                 11.643 
                 27.376 
                 1.00 
                 58.29 
                 O 
               
               
                 ATOM 
                 3700 
                 O 
                 HOH 
                 W 
                 424 
                 32.930 
                 3.782 
                 19.596 
                 1.00 
                 51.49 
                 O 
               
               
                 ATOM 
                 3701 
                 O 
                 HOH 
                 W 
                 425 
                 38.784 
                 17.343 
                 41.490 
                 1.00 
                 60.60 
                 O 
               
               
                 ATOM 
                 3702 
                 O 
                 HOH 
                 W 
                 426 
                 37.274 
                 22.305 
                 27.368 
                 1.00 
                 46.16 
                 O 
               
               
                 ATOM 
                 3703 
                 O 
                 HOH 
                 W 
                 427 
                 2.920 
                 3.818 
                 31.574 
                 1.00 
                 48.85 
                 O 
               
               
                 ATOM 
                 3704 
                 O 
                 HOH 
                 W 
                 428 
                 31.322 
                 4.264 
                 17.113 
                 1.00 
                 61.45 
                 O 
               
               
                 ATOM 
                 3705 
                 O 
                 HOH 
                 W 
                 429 
                 37.349 
                 2.399 
                 44.067 
                 1.00 
                 59.80 
                 O 
               
               
                 ATOM 
                 3706 
                 O 
                 HOH 
                 W 
                 430 
                 30.656 
                 −2.719 
                 19.246 
                 1.00 
                 52.57 
                 O 
               
               
                 ATOM 
                 3707 
                 O 
                 HOH 
                 W 
                 431 
                 45.180 
                 15.640 
                 19.348 
                 1.00 
                 58.43 
                 O 
               
               
                 ATOM 
                 3708 
                 O 
                 HOH 
                 W 
                 432 
                 5.372 
                 −7.792 
                 47.576 
                 1.00 
                 69.85 
                 O 
               
               
                 ATOM 
                 3709 
                 O 
                 HOH 
                 W 
                 433 
                 25.527 
                 −3.157 
                 21.992 
                 1.00 
                 66.96 
                 O 
               
               
                 ATOM 
                 3710 
                 O 
                 HOH 
                 W 
                 434 
                 44.619 
                 27.583 
                 −3.072 
                 1.00 
                 47.84 
                 O 
               
               
                 ATOM 
                 3711 
                 O 
                 HOH 
                 W 
                 435 
                 13.783 
                 30.570 
                 33.920 
                 1.00 
                 58.04 
                 O 
               
               
                 ATOM 
                 3712 
                 O 
                 HOH 
                 W 
                 436 
                 34.166 
                 8.815 
                 47.993 
                 1.00 
                 56.17 
                 O 
               
               
                 ATOM 
                 3713 
                 O 
                 HOH 
                 W 
                 437 
                 43.341 
                 −13.044 
                 19.673 
                 1.00 
                 57.24 
                 O 
               
               
                 ATOM 
                 3714 
                 O 
                 HOH 
                 W 
                 438 
                 73.346 
                 13.204 
                 25.504 
                 1.00 
                 60.85 
                 O 
               
               
                 ATOM 
                 3715 
                 O 
                 HOH 
                 W 
                 439 
                 46.736 
                 20.265 
                 31.497 
                 1.00 
                 68.57 
                 O 
               
               
                 ATOM 
                 3716 
                 O 
                 HOH 
                 W 
                 440 
                 3.829 
                 1.129 
                 41.666 
                 1.00 
                 52.32 
                 O 
               
               
                 ATOM 
                 3717 
                 O 
                 HOH 
                 W 
                 441 
                 52.231 
                 13.277 
                 −7.024 
                 1.00 
                 64.60 
                 O 
               
               
                 ATOM 
                 3718 
                 O 
                 HOH 
                 W 
                 442 
                 40.476 
                 19.912 
                 31.528 
                 1.00 
                 38.49 
                 O 
               
               
                 ATOM 
                 3719 
                 O 
                 HOH 
                 W 
                 443 
                 42.835 
                 −13.097 
                 16.910 
                 1.00 
                 50.34 
                 O 
               
               
                 ATOM 
                 3720 
                 O 
                 HOH 
                 W 
                 444 
                 28.031 
                 15.763 
                 48.184 
                 1.00 
                 40.06 
                 O 
               
               
                 ATOM 
                 3721 
                 O 
                 HOH 
                 W 
                 445 
                 9.673 
                 −9.229 
                 46.054 
                 1.00 
                 51.46 
                 O 
               
               
                 ATOM 
                 3722 
                 O 
                 HOH 
                 W 
                 446 
                 29.683 
                 −16.115 
                 27.350 
                 1.00 
                 54.29 
                 O 
               
               
                 ATOM 
                 3723 
                 O 
                 HOH 
                 W 
                 447 
                 54.239 
                 5.891 
                 5.248 
                 1.00 
                 61.23 
                 O 
               
               
                 ATOM 
                 3724 
                 O 
                 HOH 
                 W 
                 448 
                 19.031 
                 2.254 
                 54.929 
                 1.00 
                 48.57 
                 O 
               
               
                 ATOM 
                 3725 
                 O 
                 HOH 
                 W 
                 449 
                 61.677 
                 7.330 
                 6.963 
                 1.00 
                 74.94 
                 O 
               
               
                 ATOM 
                 3726 
                 O 
                 HOH 
                 W 
                 450 
                 31.932 
                 44.220 
                 19.866 
                 1.00 
                 59.36 
                 O 
               
               
                 ATOM 
                 3727 
                 O 
                 HOH 
                 W 
                 451 
                 10.482 
                 48.704 
                 30.828 
                 1.00 
                 65.80 
                 O 
               
               
                 ATOM 
                 3728 
                 O 
                 HOH 
                 W 
                 452 
                 6.561 
                 11.748 
                 10.662 
                 1.00 
                 54.13 
                 O 
               
               
                 ATOM 
                 3729 
                 O 
                 HOH 
                 W 
                 453 
                 15.435 
                 −0.867 
                 49.670 
                 1.00 
                 45.56 
                 O 
               
               
                 ATOM 
                 3730 
                 O 
                 HOH 
                 W 
                 454 
                 51.570 
                 37.652 
                 4.006 
                 1.00 
                 42.09 
                 O 
               
               
                 ATOM 
                 3731 
                 O 
                 HOH 
                 W 
                 455 
                 23.910 
                 26.874 
                 14.030 
                 1.00 
                 52.57 
                 O 
               
               
                 ATOM 
                 3732 
                 O 
                 HOH 
                 W 
                 456 
                 27.085 
                 29.781 
                 13.934 
                 1.00 
                 25.46 
                 O 
               
               
                 ATOM 
                 3733 
                 O 
                 HOH 
                 W 
                 457 
                 27.900 
                 28.627 
                 9.182 
                 1.00 
                 45.79 
                 O 
               
               
                 ATOM 
                 3734 
                 O 
                 HOH 
                 W 
                 458 
                 32.738 
                 29.266 
                 13.968 
                 1.00 
                 42.91 
                 O 
               
               
                 ATOM 
                 3735 
                 O 
                 HOH 
                 W 
                 459 
                 29.835 
                 30.314 
                 13.852 
                 1.00 
                 48.08 
                 O 
               
               
                 ATOM 
                 3736 
                 O 
                 HOH 
                 W 
                 460 
                 30.248 
                 −10.934 
                 4.378 
                 1.00 
                 51.32 
                 O 
               
               
                 ATOM 
                 3737 
                 O 
                 HOH 
                 W 
                 461 
                 32.581 
                 −10.951 
                 9.228 
                 1.00 
                 64.63 
                 O 
               
               
                 ATOM 
                 3738 
                 O 
                 HOH 
                 W 
                 462 
                 32.498 
                 −10.742 
                 12.543 
                 1.00 
                 54.22 
                 O 
               
               
                 ATOM 
                 3739 
                 O 
                 HOH 
                 W 
                 463 
                 11.813 
                 −0.334 
                 48.643 
                 1.00 
                 57.91 
                 O 
               
               
                 ATOM 
                 3740 
                 O 
                 HOH 
                 W 
                 464 
                 4.172 
                 −6.148 
                 31.453 
                 1.00 
                 65.05 
                 O 
               
               
                 ATOM 
                 3741 
                 O 
                 HOH 
                 W 
                 465 
                 38.613 
                 13.637 
                 20.404 
                 1.00 
                 83.38 
                 O 
               
               
                 ATOM 
                 3742 
                 O 
                 HOH 
                 W 
                 466 
                 25.868 
                 −18.454 
                 28.422 
                 1.00 
                 60.00 
                 O 
               
               
                 ATOM 
                 3743 
                 O 
                 HOH 
                 W 
                 467 
                 65.059 
                 16.988 
                 12.215 
                 1.00 
                 49.23 
                 O 
               
               
                 ATOM 
                 3744 
                 O 
                 HOH 
                 W 
                 468 
                 30.433 
                 21.112 
                 45.165 
                 1.00 
                 58.66 
                 O 
               
               
                 ATOM 
                 3745 
                 O 
                 HOH 
                 W 
                 469 
                 63.211 
                 34.666 
                 −5.360 
                 1.00 
                 44.44 
                 O 
               
               
                 ATOM 
                 3746 
                 O 
                 HOH 
                 W 
                 470 
                 46.034 
                 24.452 
                 16.370 
                 1.00 
                 47.25 
                 O 
               
               
                 ATOM 
                 3747 
                 O 
                 HOH 
                 W 
                 471 
                 38.317 
                 37.251 
                 29.410 
                 1.00 
                 57.97 
                 O 
               
               
                 ATOM 
                 3748 
                 O 
                 HOH 
                 W 
                 472 
                 45.601 
                 16.935 
                 22.457 
                 1.00 
                 50.56 
                 O 
               
               
                 ATOM 
                 3749 
                 O 
                 HOH 
                 W 
                 473 
                 57.386 
                 3.823 
                 5.277 
                 1.00 
                 47.98 
                 O 
               
               
                 ATOM 
                 3750 
                 O 
                 HOH 
                 W 
                 474 
                 48.907 
                 41.483 
                 3.217 
                 1.00 
                 46.27 
                 O 
               
               
                 ATOM 
                 3751 
                 O 
                 HOH 
                 W 
                 475 
                 60.742 
                 15.315 
                 −2.406 
                 1.00 
                 47.15 
                 O 
               
               
                 ATOM 
                 3752 
                 O 
                 HOH 
                 W 
                 476 
                 11.472 
                 30.114 
                 17.903 
                 1.00 
                 50.81 
                 O 
               
               
                 ATOM 
                 3753 
                 O 
                 HOH 
                 W 
                 477 
                 27.442 
                 −5.736 
                 4.830 
                 1.00 
                 50.01 
                 O 
               
               
                 ATOM 
                 3754 
                 O 
                 HOH 
                 W 
                 478 
                 15.963 
                 19.233 
                 13.604 
                 1.00 
                 40.24 
                 O 
               
               
                 ATOM 
                 3755 
                 O 
                 HOH 
                 W 
                 479 
                 11.847 
                 16.803 
                 29.315 
                 1.00 
                 51.87 
                 O 
               
               
                 ATOM 
                 3756 
                 O 
                 HOH 
                 W 
                 480 
                 25.373 
                 −1.129 
                 6.145 
                 1.00 
                 69.33 
                 O 
               
               
                 ATOM 
                 3757 
                 O 
                 HOH 
                 W 
                 481 
                 21.061 
                 27.210 
                 7.262 
                 1.00 
                 43.87 
                 O 
               
               
                 ATOM 
                 3758 
                 O 
                 HOH 
                 W 
                 482 
                 11.657 
                 12.994 
                 20.711 
                 1.00 
                 62.23 
                 O 
               
               
                 ATOM 
                 3759 
                 O 
                 HOH 
                 W 
                 483 
                 55.094 
                 2.305 
                 −3.240 
                 1.00 
                 66.83 
                 O 
               
               
                 ATOM 
                 3760 
                 O 
                 HOH 
                 W 
                 484 
                 19.281 
                 0.887 
                 18.463 
                 1.00 
                 65.62 
                 O 
               
               
                 ATOM 
                 3761 
                 O 
                 HOH 
                 W 
                 485 
                 44.026 
                 16.214 
                 28.232 
                 1.00 
                 64.82 
                 O 
               
               
                 ATOM 
                 3762 
                 O 
                 HOH 
                 W 
                 486 
                 53.605 
                 24.910 
                 16.745 
                 1.00 
                 73.45 
                 O 
               
               
                 ATOM 
                 3763 
                 O 
                 HOH 
                 W 
                 487 
                 15.314 
                 30.821 
                 22.775 
                 1.00 
                 45.14 
                 O 
               
               
                 ATOM 
                 3764 
                 O 
                 HOH 
                 W 
                 488 
                 20.855 
                 2.452 
                 52.883 
                 1.00 
                 51.84 
                 O 
               
               
                 ATOM 
                 3765 
                 O 
                 HOH 
                 W 
                 489 
                 32.918 
                 5.487 
                 −2.045 
                 1.00 
                 45.08 
                 O