# Patent

## Title
Crystal structure of the CCZ-LZ domain of NEMO

## Abstract

The invention relates to a crystal of the CC2-LZ domain of the NEMO protein, in which the three-dimensional structure has been determined by X-ray diffraction at a resolution of about 3.25 A. The invention also relates to methods for the crystallization of the CC2-LZ domain. The CC2-LZ crystals and the information derived from the crystalline structures thereof are used for identifying and designing compounds interacting with CC2-LZ.

## Background
The present invention relates to a crystal of the CC2-LZ domain of NEMO of a size and quality sufficient to allow structural data to be obtained by X-ray diffraction crystallography.
The invention relates more particularly to use of the crystallographic data and of the three-dimensional structure of the CC2-LZ domain of NEMO in identifying, modelling and designing compounds modulating the NF-κB signalling pathway.
The NF-κB pathway is activated in response to various extracellular stimuli such as bacterial LPS, proinflammatory cytokines such as IL-1 and TNFα (M. S. Hayden and S. Ghosh, Signaling to NF-kappaB, Genes Dev 18 (2004), no. 18, 2195-2224). The signals are generally transmitted from the cell receptors to the IKK complex, a pivotal regulator of the NE-κB signalling pathway. The IKK complex is composed of two kinases, IKKα and IKKβ, and a regulatory protein, NEMO (NF-κB essential modulator) (S. Yamaoka et al., Complementation cloning of NEMO, a component of the IkappaB kinase complex essential for NF-kappaB activation, Cell 93 (1998), no. 7, 1231-1240). NEMO plays a crucial role in integrating the signals coming from various stimuli and in bringing about activation of the IKK complex.
The NEMO protein is composed, at its N-terminal portion, of an IKK complex-binding domain and, at its C-terminal portion, of an oligomerisation domain (FIG. 1). It is to be noted that murine (SEQ ID NO.1) and human (SEQ ID NO:2) NEMO proteins have a high degree of sequence homology except for a 7 amino acid insertion in the human protein just upstream of a specific domain, CC2.
Activation of the IKK complex proceeds by way of a mechanism linked to the capacity of the NEMO protein to oligomerise by trans-activation via an IKKK kinase or by trans-autoactivation via the dimerisation of IKK kinases.
At present, the mechanism of activation of the IKK complex via NEMO has not been completely elucidated although numerous reports show that oligomerisation and binding to K-63 polyubiquitins involving the minimal CC2-LZ domain play an essential role (J. L. Poyet et al., Activation of the IkappaB kinases by RIP via Ikkgamma/NEMO-mediated oligomerization, J Biol Chem 275 (2000), no. 48, 37966-37977) (F. Agou et al., Inhibition of NF-kappab activation by peptides targeting NF-kappaB essential modulator (NEMO) oligomerization, J Biol Chem 279 (2004), no. 52, 54248-54257) (C. K. Ea et al., Activation of IKK by TNFalpha requires site-specific ubiquitination of RIP1 and polyubiquitin binding by NEMO, Mol Cell 22 (2006), no. 2, 245-257) (C. J. Wu, et al., Sensing of lys 63-linked polyubiquitination by NEMO is a key event in NF-kappaB activation, Nat Cell Biol 8 (2006), no. 4, 398-406). All mutations located in CC2-LZ that disrupt the oligomerisation of NEMO or binding to K-63 polyubiquitin chains (polyUb K-63) inhibit IKK activity following stimulation by cytokines (E. Vinolo et al., A point mutation in NEMO associated with anhidrotic ectodermal dysplasia with immunodeficiency pathology results in destabilization of the oligomer and reduces lipopolysaccharide- and tumour necrosis factor-mediated NF-kappaB activation, J Biol Chem 281 (2006), no. 10, 6334-6348).
The minimal oligomerisation domain CC2-LZ of NEMO (aa 251-337 in the mouse, aa 258-344 in humans) is composed of two successive motifs, a coiled-coil motif CC2 (aa 251-290 in the mouse, aa 258-297 in humans) and a leucine zipper motif LZ (aa 293-337 in the mouse, aa 300-344 in humans). Variations of one or two amino acids can be seen at the ends of the CC2-LZ domain depending on the software used for prediction of the CC2 and LZ structures.
Once activated, the IKK complex phosphorylates IκB proteins, thereby triggering degradation of the latter by the 26S proteasome and then releasing the NF-κB transcription factors, which are sequestered into the cytoplasm by IκB proteins. The NF-κB transcription factor then migrates into the nucleus and regulates the expression of genes involved in inflammation, immunity, apoptosis and cell survival. Constitutive activation of the NF-κB pathway is involved in oncogenesis.
It is observed in various solid tumours and leukaemias and also in autoimmune and inflammatory diseases (D. S. Basseres and A. S. Baldwin, Nuclear factor-kappaB and inhibitor of kappaB kinase pathways in oncogenic initiation and progression, Oncogene 25 (2006), no. 51, 6817-6830) (M. S. Hayden et al., NF-kappaB and the immune response, Oncogene 25 (2006), no. 51, 6758-6780) (J. Inoue et al., NF-kappaB activation in development and progression of cancer, Cancer Sci 98 (2007), no. 3, 268-274). Accordingly, the IKK complex has been considered to be a target of great interest for the development of anti-inflammatory and anti-tumour compounds (M. A. Calzado et al., NF-kappaB inhibitors for the treatment of inflammatory diseases and cancer, Curr Med Chem 14 (2007), no. 3, 367-376) (T. D. Gilmore and M. Herscovitch, Inhibitors of NF-kappaB signaling: 785 and counting, Oncogene 25 (2006), no. 51, 6887-6899) (F. D'Acquisto et al., Inhibition of nuclear factor kappa B (NF-kB): An emerging theme in anti-inflammatory therapies, Mol Interv 2 (2002), no. 1, 22-35). Designing compounds that target NEMO rather than kinases makes it possible to selectively suppress the stimuli-dependent IKK activity and thereby to reduce the cytotoxicity of said compounds.
In an effort to elucidate the mechanisms underlying regulation of the NF-κB signalling pathway, the crystalline structure of the IKK complex, and especially of the regulator protein NEMO, is being studied. Knowledge of the three-dimensional structure moreover is an essential advantage in establishing the sites of interaction with ligands resulting from actual screening. This three-dimensional structure is also a source of information in the virtual screening or in silico modelling approach. The crystallisation process of NEMO has been studied, without success, by D. Gopaul et al., M. Delepierre and F. Cordier (not published). There may be mentioned, especially, the fruitless attempts at crystallisation of the CC2-LZ domain bearing the zinc finger motif (aa 251-412 of NEMO) or without that motif (aa 251-388 of NEMO). Therefore, such work directed at obtaining crystals of the NEMO protein and of the CC2-LZ domain in particular has hitherto been unsuccessful.
The present invention is accordingly aimed at proposing a new strategy for obtaining crystallisation of the CC2-LZ domain of the NEMO protein. This alternative strategy is based on increasing the rigidity of the minimal oligomerisation domain of NEMO. The crystal structure was solved by crystallography by X-ray diffraction using a resolution of 3.25 Å. Subsequently, the crystal structure was solved by crystallography by X-ray diffraction using a resolution of 2.9 Å.
The present invention relates also to methods of crystallisation of the CC2-LZ domain. The CC2-LZ crystals and the information derived therefrom can be analysed for the purpose of identifying or designing compounds which enter into interaction with CC2-LZ.
The present invention accordingly relates to a crystal of the CC2-LZ domain of mammalian NEMO, the CC2-LZ peptide domain of which has the amino acid sequence SEQ ID NO.3 and the peptide variants of which derive from said amino acid sequence.
In the context of the invention, the terms “crystal”, “crystal of the CC2-LZ domain”, “crystal of a CC2-LZ complex” and “co-crystal of the CC2-LZ domain” are used without distinction and refer to a crystal of a complex comprising at least two separate entities, one entity of the crystal according to the invention being the CC2-LZ domain or one of its variants.
The present invention relates also to a crystal of a complex of the CC2-LZ domain of mammalian NEMO, the CC2-LZ peptide domain of which has the amino acid sequence SEQ ID NO.4 and the peptide variants of which derive from said amino acid sequence.
An “amino acid sequence” has to be understood as a peptide sequence isolated from the natural context. It especially comprises sequences that have been isolated, chemically synthesised and/or purified and possibly modified by genetic engineering.
“Variants” are understood to mean amino acid sequences of the peptides described hereinbefore comprising conservative substitutions or conservative point mutations and having substantially the same properties as the peptides respectively encoded by the sequences SEQ ID NO.3 and SEQ ID NO.4 or, that is, the capacity to oligomerise and to bind to K-63 polyubiquitins.
The present invention furthermore relates to a crystal of a complex of the CC2-LZ domain of mammalian NEMO, the unit cell parameters of which are as follows:

    
    
        a=b=63.5±5 Å;
        c=437.5±5 Å; and
        α=β=γ=90°;

and the crystal has a space group P43212.

    
    


According to the common understanding in the context of the invention, the expression “unit cell parameter” denotes the parameters a, b and c of the unit cell of the crystal, corresponding to the lengths of the non-coplanar base vectors (a, b, c) and the angles α, β and γ formed between the vectors (a, b, c). The angle α is the angle between vectors b and c, β the angle between vectors a and c, and γ the angle between vectors a and c. The unit cell is understood to be the parallelepiped constructed by the vectors (a, b, c).
The symmetry operations which leave a crystal substantially unchanged, a crystal being an infinite object formed by the repetition of a finite motif, are groups. When the crystal is of three dimensions, these are then referred to as “space groups”.
It is to be understood that the crystal of a complex of the CC2-LZ domain, according to the present invention, is not limited to the native CC2-LZ domain. The crystal of a complex according to the invention does indeed include mutants of native CC2-LZ. Such mutants are obtained by addition, deletion or substitution of at least one amino acid in the polypeptide sequence of native CC2-LZ and have substantially the same three-dimensional structure as that of the native CC2-LZ domain.
“Having substantially the same three-dimensional structure” is understood to mean having a set of atomic structure coordinates obtained from a crystal which have an average deviation less than or equal to 5 Å, preferably 2 Å, when they are superimposed on the atomic structure coordinates of native CC2-LZ from which the mutant has been derived when at least 50% to about 100% of the alpha carbon atoms of native CC2-LZ are included in the superimposition.
The invention relates preferably to a co-crystal comprising the CC2-LZ domain of mammalian NEMO and at least one ankyrin or a fragment thereof capable of stabilising the complex formed with the CC2-LZ domain, the unit cell parameters of which are as follows:

    
    
        a=b=63.5±5 Å;
        c=437.5±5 Å; and
        α=β=γ=90;

and the co-crystal of which has a space group P43212.

    
    


An “ankyrin” is understood to refer to modular proteins of various sizes involved in numerous protein-protein interactions. The ankyrins are genetically conserved proteins as they are found in bacteria, plants, fungi and animals and their structure is based on repeating structural units of about 33 amino acids.
An “ankyrin fragment” according to the invention is capable of binding and stabilising the complex formed with the CC2-LZ domain of NEMO.
The invention relates preferably to a crystal of the CC2-LZ domain of a mammalian NEMO protein and an ankyrin 1D5 (SEQ ID NO.5). The invention relates also to a crystal of the CC2-LZ domain of a mammalian NEMO protein and an ankyrin 2A1 or 2F6 as described by Wyler et al. (Inhibition of NF-kappaB activation with designed ankyrin-repeat proteins targeting the ubiquitin-binding/oligomerization domain of NEMO, Protein Sci 16 (2007), no. 9, 2013-2022).
In order to facilitate crystallogenesis, the CC2-LZ domain is in fact complexed with an ankyrin 1D5, which binds to the CC2-LZ with a strong affinity and rigidifies the peptide domain. The diffraction profile obtained from crystals of CC2-LZ complexed with, the ankyrin 1D5 is used to determine the three-dimensional structure of the CC2-LZ by molecular replacement.
The ankyrin or ankyrin fragment is preferably complexed with the LZ motif of the CC2-LZ domain, more specifically in order to stabilise it. The LZ motif is in fact more flexible and thermodynamically more unstable than the CC2 motif of the CC2-LZ domain.
The co-crystal of the CC2-LZ domain of NEMO with an ankyrin protein can be obtained by a crystallisation method comprising the following steps:

    
    
        incubation of at least one ankyrin or ankyrin fragment and the CC2-LZ domain;
        co-crystallisation of the ankyrin or ankyrin fragment/CC2-LZ protein complex by growing crystals by vapour diffusion.
    
    


In a preferred embodiment, the CC2-LZ crystallisation method corresponds to the method as described in Example 1.
The invention relates preferably to the crystal of a complex of the CC2-LZ domain of NEMO or the co-crystal of CC2-LZ having the crystallographic coordinates described in Table 1.
Preferably, the crystal and co-crystal of the CC2-LZ domain according to the invention are in each case defined by their three-dimensional structure obtained by X-ray diffraction, which is shown in FIGS. 2 and 3.
The three-dimensional structure of CC2-LZ forms an elongated dimer composed of two parallel α helices which associate with one another to form a coiled-coil structure (FIG. 2) (FIG. 3). The CC2-LZ dimer interacts with two ankyrin 1D5 molecules, each ankyrin forming contacts with the α helices on the two LZ chains. Three residues located between the CC2 motif and the LZ motif (aa 291-293, mouse numbering) form a pseudo coiled-coil. The domain of binding to the K-63 polyubiquitin chains, which is described in Ea et al., is composed of 67 amino acids (259-325 human numbering, 252-318 mouse numbering) corresponding to the C-terminal region of the CC2 and the N-terminal region of the LZ. By cross-referencing data obtained from the three-dimensional structure, from directed mutagenesis and from CC2-LZ sequence alignment, the region forming the site of binding to the ubiquitins was determined as being between amino acids 293 and 323 in the murine polypeptide sequence of NEMO (aa 300-330 human numbering).
The three-dimensional structure of the CC2-LZ crystal and co-crystal according to the invention is obtained by a method comprising the following steps:

    
    
        obtaining a crystal or co-crystal of the CC2-LZ protein;
        exposure of the crystal to X-rays;
        collection of X-ray diffraction data;
        use of that data to calculate the electron density map of said crystal;
        building and refinement of the model starting from the electron density map.
    
    


Advantageously, the method of determining the three-dimensional structure of CC2-LZ corresponds to the method as described in Example 1.
The invention relates also, on the one hand, to the crystal of murine CC2-LZ protein comprising the mutation Val316Pro (V316Pro) and/or the mutation Phe305Ala (F305A) and, on the other hand, to the crystal of human CC2-LZ protein likewise comprising the mutation Ala323Pro (A323P) and/or the mutation Phe312Ala (F312A).
The various mutations obtained by directed mutagenesis in the human CC2-LZ protein are shown in FIG. 4. The mutation Glu296Ala (E296A, position 289 in the mouse) is located at the C-terminal end of the CC2 and is outside the site of interaction with the ubiquitins (position aa 259-325, human numbering, and aa 252-318, mouse numbering). The mutations Phe312Ala (F312A, position 305 in the mouse) and Glu315Ala (E315A, position 308 in the mouse) are located within the site of binding to the ubiquitins. The mutations Glu315Ala and Ala323Pro (A323P, position 316 in the mouse) are implicated in two human pathologies, is respectively anhydrotic ectodermal dysplasia with immunodeficiency (AED-ID) (R. Doffinger et al., Genetic heterogeneity of mendelian susceptibility to mycobacterial infection, Microbes Infect 2 (2000), no. 13, 1553-1557) and incontinentia pigmenti (IP) (A. Smahi et al., Genomic rearrangement in nemo impairs NF-kappaB activation and is a cause of incontinentia pigmenti. The international incontinentia pigmenti (IP) consortium, Nature 405 (2000), no. 6785, 466-472). The double mutation Leu329Ala Leu336Ala (L329A L336A, positions 322 and 329, respectively, in the mouse) is located in the leucine zipper domain of CC2-LZ.
The capabilities of the wild-type NEMO protein and of the above-defined mutant NEMO proteins in restoring activation of the NF-κB pathway in response to the proinflammatory cytokine TNF-α are compared and illustrated in FIG. 5. For that purpose, NEMO-deficient mouse embryo fibroblasts (MEF) are transiently co-transfected on the one hand with the plasmid coding for the Igκ-luciferase reporter gene and on the other hand with the plasmids coding for the various proteins, and then stimulated with TNFα for 24 hours. The wild-type protein completely restores the NF-κB pathway whereas TNFα-dependent activation of the NF-κB pathway is affected by the mutant proteins in differing degrees. The mutations A323P and F312A give rise to the two strongest inhibitions, namely 95% and 78% inhibition, respectively.
For the mutation A323P, which is the cause of a severe form of incontinentia pigmenti, a fault in NEMO dimerisation is the cause of the inactivation of the NE-κB pathway, a result similar to that obtained by Sebban-Benin et al. (Identification of TRAF6-dependent NEMO polyubiquitination sites through analysis of a new NEMO mutation causing incontinentia pigmenti, Hum Mol Genet 16 (2007), no. 23, 2805-2815).
The protein of the CC2-LZ domain of NEMO mutated at position F312A shows an elution profile, on gel filtration, which is the same as that of the wild-type CC2-LZ protein, indicating that this mutation does not affect the stability of the dimer but rather modifies activation of the NF-κB pathway (FIG. 5). Study of this mutant demonstrates for the first time that the fault in activation is not due to a fault in dimerisation of the site of interaction with the ubiquitins but rather to a fault in interaction with K63 polyubiquitin chains, as shown by Ea et al. Consequently, these results underline the possibility of inhibiting the NF-κB pathway, either by modifying the dimerisation of NEMO or by inhibiting the interaction of NEMO with polyubiquitin chains.
The present invention makes possible, on the one hand, the structural validation, by directed mutagenesis, of an active conformation of NEMO and, on the other hand, the determination of the residues that are critical for oligomerisation of the protein and, as a consequence thereof, for activation of the IKK complex as well as those involved in binding to the K-63 polyubiquitins.
The invention relates preferably to a method of identifying compounds capable of binding to the CC2-LZ domain of NEMO, on the basis of crystallographic data obtained in said invention. Peptides mimicking the CC2 or LZ sequence are shown as being capable of disrupting the oligomerisation of NEMO and thereby suppressing activation of the NF-κB pathway in cells in culture. Advantageously, the invention relates to the elaboration and identification of compounds interfering with the oligomerisation of the CC2-LZ domain, which inhibits the binding of said domain to K-63 polyubiquitins.
In the context of the invention, “compounds” are understood to be all chemical molecules which inhibit the dimerisation of the CC2-LZ domain of NEMO or which inhibit the interaction of the CC2-LZ domain of NEMO with the polyubiquitin chains.
The crystallographic data of the domain of NEMO has accordingly made it possible to design peptides having high affinity for this protein. The CC2-LZ: CC2-LZ interactions which make it possible to form in vivo active complexes of NEMO involve numerous non-covalent linkages. As destabilisation of those complexes by small molecules is very difficult to demonstrate in a high-throughput screening context, it is necessary to identify a peptide probe which mimics that interaction, over a reduced portion of the peptide, and which has a greater affinity. Such a peptide probe can then be labelled with a fluorescent group and its association with CC2-LZ demonstrated by a fluorescence polarisation measurement. This system makes it possible to subsequently set up high-throughput screening campaigns. In order to have a rational and effective approach for creating this peptide probe, knowledge of the three-dimensional structure of the CC2-LZ domain is absolutely indispensable. Already two peptides, referred to as P8RD and PH4, have been designed using this principle (FIG. 11).
The peptide probes according to the invention are preferably the peptide PH4 and the peptide P8RD, which have the amino acid sequences SEQ ID NO.6 and SEQ ID NO.7, respectively.
P8RD has an affinity of 60 nM whereas the peptide PH4 has an affinity of 170 nM. These measurements are carried out at pH 7 and at ambient temperature in a stringent buffer corresponding to 20 mM Tris-Acetate-MES containing 200 mM potassium chloride and 0.5% Tween 20. They are carried out by fluorescence polarisation with the aid of peptides coupled at the N-terminal with the fluorophores Fluorescein or Cy5. For forming the peptide probes of the invention, the peptides can be coupled to any kind of fluorophore.
Finally, the present invention relates to a method of identifying compounds of the dimerisation of NEMO or of the interaction of NEMO with polyubiquitin chains between a peptide probe according to the invention and the CC2-LZ domain of NEMO. This HTS (High-Throughput Screening) method comprises the following steps:

    
    
        bringing said peptide and said CC2-LZ domain of NEMO into contact;
        adding the compound under test;
        measuring the fluorescence polarisation in the presence of the compound under test;
        comparing said measurement in the absence of the compound under test.
    
    


The structure-activity relationships of these peptides and also the three-dimensional structure of the CC2-LZ target of NEMO will make it possible to design other peptides having affinities of the nM order of magnitude by favouring the zone of interaction of NEMO for ubiquitin and/or polyubiquitin chains having any kind of side chain (K63, K48, K6, N-terminal).
The model of the CC2-LZ domain of NEMO/ubiquitin complex is shown in FIGS. 7, 8 and 10. The “model of the . . . complex” is understood to mean the three-dimensional structure of the CC2-LZ/ubiquitin complex.
The model of the CC2-LZ of NEMO/ubiquitin complex was built on the basis of structural information obtained from the Rabex-5 IUIM/ubiquitin complex used (Lee S. et al. Structural basis for ubiquitin recognition and autoubiquitination by Rabex-5. Nat Struct Mol Biol 13, 264-271, 2006). The model of the CC2-LZ/ubiquitin complex was verified experimentally by means of the chemical shifts observed by NMR of the interaction between ubiquitin and the CC2-LZ domain of NEMO (FIG. 9).
The three-dimensional structure of the CC2-LZ domain of NEMO is deduced from the model of the CC2-LZ/ubiquitin complex. This three-dimensional structure of CC2-LZ can be used for in silico designing or in silico screening of compounds capable of binding to the CC2-LZ domain of NEMO. The present invention accordingly relates to a method of designing compounds capable of binding to the CC2-LZ domain of NEMO using the three-dimensional structure of the CC2-LZ domain obtained from the crystallographic coordinates of the crystal according to the invention.
Finally, the invention relates to compounds identified by the above identification and design methods. Preferably, these compounds inhibit dimerisation of the CC2-LZ domain of NEMO or inhibit the interaction of the CC2-LZ domain of NEMO with the polyubiquitin chains.



The present invention is illustrated—but without being limited as a result—by the Figures and the Examples that follow:
FIG. 1: Representation of the NEMO protein.
FIG. 2: Three-dimensional structure of the CC2-LZ domain of NEMO complexed with two ankyrin molecules. The two sub-units of the CC2-LZ are in dark grey whilst the ankyrins are in light grey.
FIG. 3: Structure of the CC2-LZ domain of NEMO in the complex with the ankyrins 1D5. Ribbon diagram of the complex in a side view. The NEMO helices are shown in levels of grey depending on the domain: CC2, NOA or LZ. The ankyrin 1D5 chains are in dark grey in a position to the side.
FIG. 4: Locations, within the human CC2-LZ domain, of the various mutations obtained by directed mutagenesis. The domain of binding to the polyubiquitins is shown in white. The numbering used for the amino acids corresponds to that of the human protein.
FIG. 5: Effect of the various mutations on activation of the NF-κB pathway. The numbering of the mutations corresponds to that of the human CC2-LZ protein.
FIG. 6: Model of the CC2-LZ domain of NEMO/ubiquitin complex. Alignment sequence between Rabex-5 (MIU/IUIM) (SEQ ID NO:12) (first line) and NEMO (NOA motif) (amino acids 292-319 of SEQ ID NO:1 (second line), with the positions of the structural motif of NOA (a-g) below. The continuous and broken vertical lines denote identical and similar residues, respectively. The diagonal line indicates spatially similar residues from the aspect of the structural model according to the invention. Strictly conserved residues in the NOA motif are indicated by *.
FIG. 7: Side view of the CC2-LZ of NEMO/ubiquitin complex. The NEMO helices are coloured as in FIG. 3. The ubiquitin molecules are in grey in a position to the side and the ankyrin 1D5 molecules of the co-crystal are in semi-transparent light grey also in a position to the side.
FIG. 8: Close-up view of the NOA/ubiquitin interface. The residues involved in the interaction are drawn in a “ball and stick” type representation, with the carbon atoms in grey (ubiquitin) and white (NEMO).
FIG. 9: Chemical shifts observed by NMR of ubiquitin bound to the CC2-LZ domain of NEMO. Average variations in the chemical shift Δδav as a function of the chemical residue. The elements of the corresponding secondary structure are shown above the graph of the chemical shifts.
FIG. 10: Representation of the interaction between ubiquitin and the NOA region of the CC2-LZ domain. Dark grey is used for the residues involved in a strong interaction. The residues of ubiquitins are shown in light grey for 0.05<Δδav<0.085 ppm.
FIG. 11: Peptide sequences PH4 (SEQ JD NO:6) and P8RD (SEQ ID NO:7), which were designed taking into account the crystallographic structure of the CC2-LZ domain.



EXAMPLE 1
Crystallographic Structure of the CC2-LZ Domain
1.1 Construction of Plasmids, Expression and Purification of Ankyrin 1D5 and CC2-LZ Proteins
Evolving the ankyrin 1D5 is carried out by ribosome display using the N2C DARPin (designed ankyrin repeat protein) library (H. K. Binz et al., High-affinity binders selected from designed ankyrin repeat protein libraries, Nat Biotechnol 22 (2004), no. 5, 575-582) for selection. The results of this study and also the amino acids of the ankyrin 1D5 which differ from the initial model are described in the publication of Wyler et al. The cDNA of the ankyrin 1D5 is cloned into the vector pQE30 (Qiagen) in phase with a histidine tag located at the N-terminal end. The pQE30-1D5 plasmid is introduced into a strain of E. coli XL-1 blue and expression of the 1D5 protein is induced by adding IPTG 1 mM to the culture medium for 3-3.5 hours at 37° C. The bacteria are recovered by sedimentation, washed in Tris/HCl buffer 50 mM pH 8 and lysed by sonication in a Tris/HCl buffer 50 mM pH8, NaCl 0.5M (buffer A) in the presence of protease inhibitors (Complete free EDTA, Roche). The soluble extract is recovered after centrifuging and is loaded onto a nickel column pre-equilibrated with buffer A. The 1D5 protein is eluted using a linear gradient of imidazole. The fractions containing the protein are collected and then dialysed against a buffer of 20 mM Tris/HCl pH 7.6, 50 mM KCl using dialysis bags having a cut-off threshold of 6-8 kDa (Spectra/Por). The protein is concentrated by ultrafiltration in Amicon tubes (Millipore) having a cut-off threshold of 5 kDa.
The CC2-LZ (SEQ ID NO.3) (aa 251-337 of murine NEMO) is cloned into the plasmid pET28 in phase with a histidine tag located at the N-terminal end. This domain corresponds to residues 258-344 of human NEMO (SEQ ID NO.4). The protein is expressed in a strain of E. coli, BL21-gold (DE3) and purified on a nickel column as described for the purification of the ankyrin 1D5. The CC2-LZ protein is then purified on a cation exchange Poros 20-HS column (Perseptive Biosystem). The column is pre-equilibrated in a buffer of 50 mM MES pH 7.1, 50 mM KCl and the proteins are eluted by a linear gradient of KCl. The fractions of interest are collected and dialysed against a buffer of 20 mM Tris/HCl pH 8.0, 100 mM KCl, and then concentrated by ultrafiltration.
The purity of the protein is determined as greater than 98% according to analysis by electrophoresis under denaturing conditions and staining with Coomassie blue. The protein concentration is determined by the method of Bradford and by measurement of the absorption at 280 nm using a coefficient of absorption of 2312 M−1cm−1 for CC2-LZ and 1490 M−1cm−1 for 1D5.
The 1D5 and CC2-LZ proteins are incubated together for 30 minutes in ice and the complex is purified on a Superdex 200 HR column (Pharmacia) equilibrated in a buffer of 20 mM Tris/HCl pH 8, 100 mM KCl. The binding stoichiometry in the complex is 1:1. The complex is concentrated by ultrafiltration to obtain a protein concentration of 10-13 mg/ml.
1.2 Crystallisation Conditions for the Ankyrin 1D5/CC2-LZ Protein Complex
Crystals grew in reproducible manner under two different conditions (Jena Bioscience ref: 3A4 and 8B5). The reservoir solution 3A4 contains: 10% PEG 40000, 5% isopropanol, 100 mM Na Hepes pH 7.5, and the solution 8B5 contains: 5% MPD (2-methyl-2,4-pentadiol), 5% ethanol, 100 mM Na Hepes pH7.5. The crystals grew under vapour diffusion in suspended droplets seeded with micro-crystals (microseeding). 1 μl of the protein complex is added to 1 μl of the reservoir solution and equilibrated under vapour diffusion at 18-20° C. for more than 36 hours. Micro-crystals (0.1 μl) obtained starting from fragments of crystals are introduced into the drop. After seeding, the crystals grow in a few days to reach a size of 300×150×20 μm. For cryogenic protection, the crystals are plunged for 30 seconds into the reservoir solution additionally Containing PEG 4000 and 20% C glycerol for 3A4 or 30% MPD for 8B5. The crystals are mounted in nylon loops and frozen very rapidly before data collection.
1.3 Analysis of the Ankyrin 1D5/CC2-LZ Protein Complex
The X-ray diffraction data (1=0.9794 Å) are recorded using the PX06SA beamline at the SLS (Swiss Synchrotron Light Source) and a Pilatus 6M hybrid pixel detector (crystal-detector distance: 640 mm and 0.5° oscillations per step at 100° K). The data sets are processed using the XDS program package. All the crystals belong to the same space group P43212 with the following crystal unit cell parameters:
a=b=63.5 Å and c=437.5 Å.
1.4 Determination and Refinement of the Crystallographic Structure of the CC2-LZ Domain of NEMO
The structure was solved by molecular replacement using the AmoRe program using the atomic model of ankyrin 2JAB (Zhand et al., to be published) and a theoretical model for the NEMO helices. The data between 15 and 3.5 Å resolution were used for these calculations. After analysis of the electron density map, manual building of the model was carried out using O. Refinement with TLS Was performed using the Refmac program. The model was refined maintaining non-crystallographic symmetry constraints for the ankyrin (chain C and D) and for the NEMO helices (residues 251 to 290, N-terminal region, and residues 294 to 337, C-terminal region). The final model contains 26 molecules of solvent and one molecule of glycerol, with a resolution Rcryst/Rfree of 20.8%/26.1% at 3.5 Å. The stereochemical data and the R factors are given in Table 1. The stereochemical quality of the model was analysed using PRO-CHECK.
1.5 Obtaining the Model of the CC2-LZ Domain of NEMO/Ubiquitin Complex
The best candidates for modelling the CC2-LZ/ubiquitin complex are structures containing a simple α helix such as UIM (ubiquitin-interacting motif) and inverted UIM (IUIM or MIU) obtained from Rabex-5. After comparison of the sequences, sequence identity of about 20% between the NOA motif of the CC2-LZ domain and the IUIM of Rabex-5 was observed (FIG. 6). The IUIM motif of Rabex-5 binds to the hydrophobic region of ubiquitin centred on the residue Ile 44. It has also been shown that this same residue Ile 44 is necessary in the interaction between NEMO and the polyubiquitin K63 (Bloor S. et al. Signal processing by its coil zipper domain activates IKK gamma, Proc Natl Acad Sci USA 105, 1279-84, 2008), which clearly suggests that ubiquitin binds in equivalent manner to the NOA motif of NEMO and to the Rabex-5 IUIM. Consequently, the known three-dimensional structure of the Rabex-5 IUIM/ubiquitin complex was used as a guide in elaboration of the model of the CC2-LZ/ubiquitin complex.
In order to respect the symmetry, two molecules of ubiquitin are bound to the NEMO helix. The complementarity index for the CC2-LZ/ubiquitin complex is 0.69, which is higher than that of the CC2-LZ/ankyrin 1D5 complex (SC=0.65). The molecules of ubiquitin bind to the hydrophobic region, of NOA, the binding site of which partially overlaps the ankyrins 1D5. The residue D304 of NOA is embedded in the centre of the CC2-LZ/ubiquitin interface and forms H bonds with the H68 residue of the ubiquitin. The other main interactions involve non-polar residues, including Ala 307, corresponding to the invariant Ala residue found in the IUIM motif and the residue F305 involved in the NEMO/polyubiquitin K63 interaction. These interactions mask the hydrophobic surface of NOA, which is not favoured in energy terms, from solvent, which contributes to the stabilisation of this region. The three-dimensional structure of the CC2-LZ/ubiquitin model is further verified by means of various experiments such as directed mutagenesis or chemical shifts observed by NMR (FIG. 9).













Crystal parameters



Parameters of the unit cell (Å)
a = b = 63.5 c = 437.5


Space group
P43212


Diffraction dataa


Temperature (K)
100


Resolution range (Å)
30-3.25


Reflections observed (I)0 (I))
280.552 (15.169) 


Unique reflections (I 0 (I))
28.729 (2.134) 


Filling level (%)
99.1 (99.4)


Rsymb
0.140 (0.449)


I/(I)
5.5 (1.7)


Monomers per asymmetric unit
2


Solvent occupation (%)
73.3


Matthews coefficient (Å3/Da)
4.6


Refinement


Resolution (Å)
20-3.25


Rfactor
0.208


Rfree
0.261


rmsdc of bond lengths (Å)
0.013


rmsd of bond angles (°)
1.573


Ramachandran diagram (%)


Residues in the “Most favoured” conformation
91.8


Residues in the “Additionally allowed”
8.0


conformation


Residues in the “Generously allowed”
0.2


conformation


Residues in the “Disallowed” conformation
0.0


Data sets and refinement:





aValues in parentheses are given for the external resolution envelope: 3.43-3.25 Å.


bRsym = S |I − (I)|/S (I), where I is the measurement intensity of each reflection and (I) is the mean intensity of that reflection.


c(rmsd) Mean square deviation.






EXAMPLE 2
Structural Validation by Directed Mutagenesis of an Active Conformation of NEMO
2.1 Construction of Plasmids and Directed Mutagenesis
The cDNA coding for the human CC2-LZ domain of NEMO, designated Tax CC2-LZ and extending from Met 215 to Glu 362 (human numbering), is obtained by PCR using the following two nucleotide primers: NEMO 1 SEQ ID NO.8 (5′-CCCCATATGGAGCGCCAGGCCGCCTC) and NEMO 2 SEQ ID NO.9 (5′-TGAGGAAGCGGATGTCGAGTAGCTCGAGGGG). This cDNA is introduced between the NdeI and XhoI restriction sites of a bacterial expression vector, pET-28b (Novagen), to generate the vector pET-NEMO.
The FLAG tag corresponding to the sequence DYKDDDDK (SEQ ID NO:13) is introduced into a mammalian expression vector, pcDNA3, between the HindIII and EcoRI restriction sties to create the plasmid pcFLAG.
The cDNA coding for the human form of NEMO is amplified by PCR using the following two nucleotide primers, NEMO 3 SEQ ID NO.10 (5′-GGGGAATTCTAATAGGCACCTCTGGAAGAG) and NEMO 4 SEQ ID NO.11 (5′-CATGGAGTGCATTGAGTAGCTCGAGGGG) and is then introduced into the pcFLAG plasmid between the EcoRI and XhoI restriction sites to create the plasmid pcNEMO-WT.
The point mutations Glu296Ala, Phe312Ala, Glu315Ala, Ala323Pro and the double mutant Leu329Ala Leu336Ala are introduced on the one hand into the bacterial vector pET-NEMO-WT and on the other hand into the mammalian vector pcDNA3/NEMO-WT using the directed mutagenesis technique whose protocol is described in the kit “Quikchange II Site-Directed Mutagenesis” from Stratagene.
2.2 Functional Complementation in Mouse Embryo Fibroblasts
NEMO-deficient mouse embryo fibroblasts (MEF) are cultured in cell culture jars and transiently transfected with a mixture containing: 0.2 μg of a plasmid pEF1 coding for β-galactosidase, 0.5 μg of a plasmid containing the Igk-luciferase reporter gene and 2 μg of plasmids expressing the different variants of NEMO. Twenty-four hours after transfection, the cells are activated with TNFα (20 ng/ml) for 24 hours. The cells are then recovered and then lysed in 110 μl of a buffer of 25 mM Tris/Phosphate pH 7.8, 8 mM MgCl2, 1% Triton, 1 mM dithiothreitol, 15% to glycerol to which a cocktail of proteases is added (Roche). The cell lysate is centrifuged at 13 000 rpm for 20 min at 4° C. The activity of the reporter gene is measured.
2.3 Expression and Purification of the Wild-Type Protein and of the Mutant F312A
Purification is carried out using an AKTA Purifier 100 apparatus (Amersham Pharmacia Biotech). Purification of the various proteins is performed starting from a culture of 3 litres of BL21-Gold D3 bacteria (Stratagene) transformed with the various pET 28 plasmids and in the presence of kanamycin (50 μg/ml). Expression of the proteins is induced using 1 mM IPTG at 37° C. for 4 hours. After centrifuging for 20 min at 6000 g at 4° C., the bacteria are washed in a buffer of Tris/HCl 100 mM pH 8 containing 10 mM MgCl2. The bacterial sediments are frozen at −20° C. The sediments are then resuspended in an extraction buffer (Tris/HCl 50 mM pH 8, KCl 20 mM and glycerol 5%) containing a mixture of protease inhibitors (Complete EDTA-free, Roche) at a concentration of 2 ml/g of bacteria and then broken up using a French Press under a pressure of 1500 psi. The bacterial lysate is subjected 3 times to 10 seconds of sonication at 90 W, thereby making it possible to reduce the viscosity of the medium by fragmentation of the DNA. The lysate is then diluted 2.5 times in a buffer of Tris/HCl 50 mM pH8, NaCl 1M and is then centrifuged at 10 000 g for 30 min at 4° C. The supernatant is then placed on a 20 ml Ni-NTA Superflow affinity column (Qiagen) previously equilibrated in the aforesaid buffer. After washing the column over an entire night to remove all the non-adsorbed proteins and also the DNA, the proteins are eluted by a linear gradient (0-500 mM) of imidazole (ACS, Merck) in the equilibration buffer of the column. The fractions containing the protein of interest are collected and dialysed against a buffer of HEPES 20 mM pH 7.5, KCl 50 mM, EDTA 1 mM. The dialysate, whose pH is brought to 6 using MES 1M, is loaded onto a Poros 20-HS cation exchange column (Perseptive Biosystem) previously equilibrated in a buffer of MES 50 mM pH 6, KCl 50 mM. Elution is carried out by means of a linear gradient of KCl (50 mM-1M). The protein fractions are combined and then concentrated by ultrafiltration (Amicon-Ultra with a cut-off threshold of 10 000) and dialysed against a buffer of Tris/HCl 20 mM pH 8, KCl 100 mM. The proteins are stored in aliquots at −80° C. The purity of the various proteins is determined as >98% according to analysis by electrophoresis under denaturing conditions and staining with Coomassie blue. The protein concentration is determined by is measurement of the absorbance at 280 nm using a molar extinction coefficient of 5960 M−1 cm−1.
2.4 Gel Filtration of the Wild-Type Protein and the Mutant F312A
The gel filtration experiments are carried out at 4° C. on a Superdex 75 HR 10/30 column (Amersham Biosciences). The column is equilibrated in a buffer of Tris/HCl 50 mM pH7.5, NaCl 200 mM, DTE 0.2 mM at 4° C. with a flow rate of 0.5 ml/min. A sample of constant volume (200 μl), at a concentration of 0.3 μM, is injected onto the column at a rate of 0.5 ml/min. The proteins are diluted in the equilibration buffer of the column and allowed to stand at 4° C. for 2 hours before injection in order to allow them to equilibrate. In order to detect elution of the proteins, an RF-10 AXL spectrofluorimeter (Shimadzu) is connected on-line to the AKTA apparatus. The intrinsic fluorescence is recorded, measuring the emission of fluorescence of the tyrosine residues at 310 nm after excitation at 280 nm.







TABLE 1







Chains A & B = Nemo CC2LZ with numbering corresponding to entry O88522


Nemo aa = M251 to L336


chain A starts at 242 and chain B at 247 (extra aa from the his tag)


chains C& D = ankyrin 1D5 (aa 12 to 136)


REMARK Written by O version 11.0.5


REMARK Fri Nov 9 11:30:17 2007













CRYST1
63.499
63.499
437.472
 90.00
90.00
 90.00











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
0.015748
0.000000
0.000000
0.00000


SCALE2
0.000000
0.015748
0.000000
0.00000


SCALE3
0.000000
0.000000
0.002286
0.00000


















ATOM
1
N
VAL
A
242
56.460
37.782
235.855
1.00
91.30
7


ATOM
2
CA
VAL
A
242
57.909
38.147
235.886
1.00
90.83
6


ATOM
3
CB
VAL
A
242
58.315
39.047
234.639
1.00
90.87
6


ATOM
4
CG1
VAL
A
242
59.704
38.671
234.120
1.00
90.25
6


ATOM
5
CG2
VAL
A
242
57.284
38.950
233.503
1.00
90.33
6


ATOM
6
C
VAL
A
242
58.376
38.794
237.240
1.00
90.98
6


ATOM
7
O
VAL
A
242
59.397
39.509
237.240
1.00
91.19
8


ATOM
8
N
PRO
A
243
57.655
38.548
238.390
1.00
90.67
7


ATOM
9
CA
PRO
A
243
58.202
39.037
239.689
1.00
90.27
6


ATOM
10
CB
PRO
A
243
57.126
38.653
240.723
1.00
90.07
6


ATOM
11
CG
PRO
A
243
56.375
37.540
240.096
1.00
90.45
6


ATOM
12
CD
PRO
A
243
56.371
37.842
238.596
1.00
90.65
6


ATOM
13
C
PRO
A
243
59.499
38.312
240.017
1.00
89.62
6


ATOM
14
O
PRO
A
243
59.553
37.077
239.966
1.00
89.75
8


ATOM
15
N
ARG
A
244
60.541
39.067
240.341
1.00
88.70
7


ATOM
16
CA
ARG
A
244
61.872
38.470
240.464
1.00
87.55
6


ATOM
17
CB
ARG
A
244
62.947
39.465
239.995
1.00
87.84
6


ATOM
18
CG
ARG
A
244
63.014
39.608
238.442
1.00
88.81
6


ATOM
19
CD
ARG
A
244
63.118
41.070
237.958
1.00
90.11
6


ATOM
20
NE
ARG
A
244
63.866
41.926
238.892
1.00
90.83
7


ATOM
21
CZ
ARG
A
244
64.326
43.151
238.622
1.00
90.77
6


ATOM
22
NH1
ARG
A
244
64.139
43.706
237.425
1.00
90.57
7


ATOM
23
NH2
ARG
A
244
64.988
43.819
239.559
1.00
90.60
7


ATOM
24
C
ARG
A
244
62.142
37.865
241.857
1.00
86.31
6


ATOM
25
O
ARG
A
244
63.298
37.625
242.226
1.00
86.43
8


ATOM
26
N
GLY
A
245
61.057
37.604
242.605
1.00
84.69
7


ATOM
27
CA
GLY
A
245
61.092
36.869
243.883
1.00
82.05
6


ATOM
28
C
GLY
A
245
61.335
37.747
245.101
1.00
80.21
6


ATOM
29
O
GLY
A
245
62.456
37.794
245.628
1.00
80.36
8


ATOM
30
N
SER
A
246
60.286
38.426
245.565
1.00
77.76
7


ATOM
31
CA
SER
A
246
60.425
39.428
246.624
1.00
75.11
6


ATOM
32
CB
SER
A
246
59.634
40.689
246.220
1.00
75.41
6


ATOM
33
OG
SER
A
246
59.738
41.711
247.201
1.00
75.87
8


ATOM
34
C
SER
A
246
60.011
38.954
248.029
1.00
72.89
6


ATOM
35
O
SER
A
246
59.422
39.727
248.773
1.00
72.73
8


ATOM
36
N
HIS
A
247
60.322
37.708
248.392
1.00
70.26
7


ATOM
37
CA
HIS
A
247
59.913
37.120
249.697
1.00
68.09
6


ATOM
38
CB
HIS
A
247
60.277
35.641
249.762
1.00
67.82
6


ATOM
39
CG
HIS
A
247
59.186
34.734
249.301
1.00
67.04
6


ATOM
40
ND1
HIS
A
247
58.145
34.350
250.118
1.00
66.33
7


ATOM
41
CE1
HIS
A
247
57.331
33.558
249.446
1.00
66.01
6


ATOM
42
NE2
HIS
A
247
57.810
33.409
248.224
1.00
66.25
7


ATOM
43
CD2
HIS
A
247
58.969
34.136
248.107
1.00
66.19
6


ATOM
44
C
HIS
A
247
60.439
37.801
250.974
1.00
66.82
6


ATOM
45
O
HIS
A
247
61.560
38.276
251.027
1.00
66.82
8


ATOM
46
N
MET
A
248
59.632
37.847
252.018
1.00
65.13
7


ATOM
47
CA
MET
A
248
60.064
38.545
253.196
1.00
63.85
6


ATOM
48
CB
MET
A
248
58.872
39.115
253.929
1.00
63.42
6


ATOM
49
CG
MET
A
248
58.207
40.253
253.206
1.00
61.36
6


ATOM
50
SD
MET
A
248
58.774
41.914
253.596
1.00
57.47
16


ATOM
51
CE
MET
A
248
60.164
41.666
254.723
1.00
57.52
6


ATOM
52
C
MET
A
248
60.801
37.570
254.070
1.00
64.18
6


ATOM
53
O
MET
A
248
61.670
37.954
254.840
1.00
64.07
8


ATOM
54
N
ALA
A
249
60.452
36.294
253.928
1.00
64.58
7


ATOM
55
CA
ALA
A
249
61.043
35.208
254.706
1.00
64.98
6


ATOM
56
CB
ALA
A
249
59.958
34.470
255.465
1.00
64.98
6


ATOM
57
C
ALA
A
249
61.812
34.241
253.811
1.00
65.59
6


ATOM
58
O
ALA
A
249
62.166
34.563
252.674
1.00
65.95
8


ATOM
59
N
SER
A
250
62.059
33.042
254.310
1.00
66.12
7


ATOM
60
CA
SER
A
250
62.839
32.087
253.553
1.00
66.93
6


ATOM
61
CB
SER
A
250
63.744
31.314
254.508
1.00
66.77
6


ATOM
62
OG
SER
A
250
64.646
30.481
253.810
1.00
65.76
8


ATOM
63
C
SER
A
250
61.970
31.123
252.738
1.00
67.78
6


ATOM
64
O
SER
A
250
61.227
30.342
253.310
1.00
68.10
8


ATOM
65
N
MET
A
251
62.056
31.178
251.410
1.00
68.65
7


ATOM
66
CA
MET
A
251
61.516
30.102
250.572
1.00
69.76
6


ATOM
67
CB
MET
A
251
60.218
30.531
249.884
1.00
69.79
6


ATOM
68
CG
MET
A
251
59.165
31.143
250.777
1.00
70.09
6


ATOM
69
SD
MET
A
251
58.290
29.962
251.810
1.00
71.12
16


ATOM
70
CE
MET
A
251
57.647
28.875
250.577
1.00
71.11
6


ATOM
71
C
MET
A
251
62.540
29.722
249.506
1.00
70.50
6


ATOM
72
O
MET
A
251
62.395
30.116
248.350
1.00
70.57
8


ATOM
73
N
GLN
A
252
63.564
28.951
249.872
1.00
71.84
7


ATOM
74
CA
GLN
A
252
64.688
28.819
248.959
1.00
72.21
6


ATOM
75
CB
GLN
A
252
65.925
28.261
249.676
1.00
72.09
6


ATOM
76
CG
GLN
A
252
67.098
28.095
248.749
1.00
71.00
6


ATOM
77
CD
GLN
A
252
68.311
28.812
249.232
1.00
69.60
6


ATOM
78
OE1
GLN
A
252
69.065
28.298
250.045
1.00
70.22
8


ATOM
79
NE2
GLN
A
252
68.523
30.007
248.720
1.00
69.23
7


ATOM
80
C
GLN
A
252
64.307
27.971
247.769
1.00
72.45
6


ATOM
81
O
GLN
A
252
64.345
28.428
246.629
1.00
72.33
8


ATOM
82
N
LEU
A
253
63.933
26.738
248.090
1.00
72.90
7


ATOM
83
CA
LEU
A
253
63.577
25.691
247.155
1.00
73.09
6


ATOM
84
CB
LEU
A
253
63.357
24.395
247.949
1.00
72.61
6


ATOM
85
CG
LEU
A
253
62.668
23.226
247.256
1.00
71.41
6


ATOM
86
CD1
LEU
A
253
63.595
22.667
246.234
1.00
70.33
6


ATOM
87
CD2
LEU
A
253
62.284
22.164
248.235
1.00
72.09
6


ATOM
88
C
LEU
A
253
62.276
26.054
246.483
1.00
73.74
6


ATOM
89
O
LEU
A
253
62.118
25.996
245.254
1.00
73.87
8


ATOM
90
N
GLU
A
254
61.323
26.421
247.318
1.00
74.31
7


ATOM
91
CA
GLU
A
254
59.992
26.671
246.823
1.00
75.04
6


ATOM
92
CB
GLU
A
254
59.005
26.863
247.966
1.00
74.85
6


ATOM
93
CG
GLU
A
254
57.603
27.212
247.489
1.00
75.09
6


ATOM
94
CD
GLU
A
254
56.927
26.092
246.722
1.00
75.76
6


ATOM
95
OE1
GLU
A
254
56.661
25.012
247.298
1.00
76.58
8


ATOM
96
OE2
GLU
A
254
56.644
26.301
245.532
1.00
75.99
8


ATOM
97
C
GLU
A
254
59.957
27.875
245.904
1.00
75.25
6


ATOM
98
O
GLU
A
254
59.127
27.941
244.996
1.00
75.30
8


ATOM
99
N
ASP
A
255
60.850
28.825
246.140
1.00
75.42
7


ATOM
100
CA
ASP
A
255
60.950
29.945
245.246
1.00
75.73
6


ATOM
101
CB
ASP
A
255
61.946
30.955
245.757
1.00
75.91
6


ATOM
102
CG
ASP
A
255
61.599
32.354
245.335
1.00
77.56
6


ATOM
103
OD1
ASP
A
255
61.563
32.620
244.112
1.00
79.25
8


ATOM
104
OD2
ASP
A
255
61.348
33.195
246.227
1.00
79.41
8


ATOM
105
C
ASP
A
255
61.330
29.449
243.859
1.00
75.60
6


ATOM
106
O
ASP
A
255
60.526
29.514
242.933
1.00
75.72
8


ATOM
107
N
LEU
A
256
62.537
28.920
243.728
1.00
75.34
7


ATOM
108
CA
LEU
A
256
62.928
28.242
242.509
1.00
75.30
6


ATOM
109
CB
LEU
A
256
64.109
27.309
242.778
1.00
75.19
6


ATOM
110
CG
LEU
A
256
65.514
27.903
242.786
1.00
75.23
6


ATOM
111
CD1
LEU
A
256
66.534
26.772
242.738
1.00
75.17
6


ATOM
112
CD2
LEU
A
256
65.729
28.881
241.617
1.00
74.99
6


ATOM
113
C
LEU
A
256
61.774
27.431
241.925
1.00
75.31
6


ATOM
114
O
LEU
A
256
61.341
27.649
240.800
1.00
75.30
8


ATOM
115
N
ARG
A
257
61.272
26.501
242.718
1.00
75.47
7


ATOM
116
CA
ARG
A
257
60.233
25.586
242.290
1.00
75.75
6


ATOM
117
CB
ARG
A
257
59.745
24.788
243.507
1.00
75.66
6


ATOM
118
CG
ARG
A
257
59.159
23.466
243.150
1.00
75.77
6


ATOM
119
CD
ARG
A
257
58.663
22.720
244.350
1.00
75.78
6


ATOM
120
NE
ARG
A
257
58.741
21.305
244.035
1.00
77.55
7


ATOM
121
CZ
ARG
A
257
59.852
20.583
244.167
1.00
78.63
6


ATOM
122
NH1
ARG
A
257
60.954
21.149
244.635
1.00
78.96
7


ATOM
123
NH2
ARG
A
257
59.871
19.296
243.840
1.00
78.95
7


ATOM
124
C
ARG
A
257
59.068
26.315
241.618
1.00
75.79
6


ATOM
125
O
ARG
A
257
58.643
25.940
240.526
1.00
75.72
8


ATOM
126
N
GLN
A
258
58.558
27.350
242.280
1.00
76.03
7


ATOM
127
CA
GLN
A
258
57.466
28.152
241.729
1.00
76.53
6


ATOM
128
CB
GLN
A
258
56.919
29.156
242.741
1.00
76.59
6


ATOM
129
CG
GLN
A
258
55.526
28.841
243.261
1.00
78.00
6


ATOM
130
CD
GLN
A
258
55.383
29.164
244.762
1.00
80.85
6


ATOM
131
OE1
GLN
A
258
55.779
30.245
245.224
1.00
81.22
8


ATOM
132
NE2
GLN
A
258
54.830
28.214
245.531
1.00
81.21
7


ATOM
133
C
GLN
A
258
57.916
28.906
240.496
1.00
76.57
6


ATOM
134
O
GLN
A
258
57.408
28.678
239.411
1.00
76.75
8


ATOM
135
N
GLN
A
259
58.873
29.806
240.672
1.00
76.54
7


ATOM
136
CA
GLN
A
259
59.466
30.559
239.579
1.00
76.73
6


ATOM
137
CB
GLN
A
259
60.854
30.983
240.013
1.00
76.46
6


ATOM
138
CG
GLN
A
259
61.437
32.124
239.256
1.00
77.09
6


ATOM
139
CD
GLN
A
259
62.109
33.116
240.183
1.00
78.35
6


ATOM
140
OE1
GLN
A
259
62.761
32.735
241.153
1.00
79.03
8


ATOM
141
NE2
GLN
A
259
61.941
34.403
239.898
1.00
79.78
7


ATOM
142
C
GLN
A
259
59.582
29.768
238.276
1.00
77.02
6


ATOM
143
O
GLN
A
259
59.241
30.259
237.204
1.00
77.36
8


ATOM
144
N
LEU
A
260
60.087
28.547
238.385
1.00
77.32
7


ATOM
145
CA
LEU
A
260
60.234
27.628
237.266
1.00
77.61
6


ATOM
146
CB
LEU
A
260
60.851
26.319
237.778
1.00
77.46
6


ATOM
147
CG
LEU
A
260
61.475
25.205
236.920
1.00
77.15
6


ATOM
148
CD1
LEU
A
260
60.463
24.422
236.101
1.00
76.69
6


ATOM
149
CD2
LEU
A
260
62.579
25.730
236.044
1.00
76.14
6


ATOM
150
C
LEU
A
260
58.881
27.332
236.660
1.00
78.11
6


ATOM
151
O
LEU
A
260
58.634
27.600
235.489
1.00
78.27
8


ATOM
152
N
GLN
A
261
57.998
26.786
237.482
1.00
78.83
7


ATOM
153
CA
GLN
A
261
56.678
26.388
237.041
1.00
79.56
6


ATOM
154
CB
GLN
A
261
55.894
25.806
238.223
1.00
79.87
6


ATOM
155
CG
GLN
A
261
55.317
24.406
237.970
1.00
81.14
6


ATOM
156
CD
GLN
A
261
53.927
24.449
237.344
1.00
82.68
6


ATOM
157
OE1
GLN
A
261
52.924
24.570
238.055
1.00
83.22
8


ATOM
158
NE2
GLN
A
261
53.861
24.343
236.013
1.00
82.41
7


ATOM
159
C
GLN
A
261
55.972
27.583
236.421
1.00
79.62
6


ATOM
160
O
GLN
A
261
55.300
27.456
235.403
1.00
79.75
8


ATOM
161
N
GLN
A
262
56.171
28.753
237.011
1.00
79.91
7


ATOM
162
CA
GLN
A
262
55.520
29.942
236.513
1.00
80.58
6


ATOM
163
CB
GLN
A
262
55.553
31.086
237.533
1.00
80.55
6


ATOM
164
CG
GLN
A
262
56.669
32.105
237.335
1.00
81.54
6


ATOM
165
CD
GLN
A
262
56.384
33.438
238.010
1.00
81.86
6


ATOM
166
OE1
GLN
A
262
55.735
33.495
239.066
1.00
83.81
8


ATOM
167
NE2
GLN
A
262
56.872
34.526
237.404
1.00
82.80
7


ATOM
168
C
GLN
A
262
56.106
30.349
235.166
1.00
80.47
6


ATOM
169
O
GLN
A
262
55.387
30.859
234.316
1.00
80.72
8


ATOM
170
N
ALA
A
263
57.398
30.106
234.967
1.00
80.53
7


ATOM
171
CA
ALA
A
263
58.057
30.460
233.712
1.00
80.70
6


ATOM
172
CB
ALA
A
263
59.544
30.496
233.899
1.00
80.51
6


ATOM
173
C
ALA
A
263
57.688
29.497
232.588
1.00
80.85
6


ATOM
174
O
ALA
A
263
57.431
29.908
231.466
1.00
81.05
8


ATOM
175
N
GLU
A
264
57.664
28.213
232.902
1.00
81.06
7


ATOM
176
CA
GLU
A
264
57.188
27.197
231.979
1.00
81.63
6


ATOM
177
CB
GLU
A
264
57.079
25.857
232.693
1.00
81.60
6


ATOM
178
CG
GLU
A
264
58.146
24.850
232.314
1.00
82.66
6


ATOM
179
CD
GLU
A
264
58.097
23.583
233.173
1.00
82.90
6


ATOM
180
OE1
GLU
A
264
57.918
22.488
232.600
1.00
84.53
8


ATOM
181
OE2
GLU
A
264
58.227
23.671
234.416
1.00
84.53
8


ATOM
182
C
GLU
A
264
55.818
27.523
231.444
1.00
81.51
6


ATOM
183
O
GLU
A
264
55.570
27.414
230.245
1.00
81.74
8


ATOM
184
N
GLU
A
265
54.920
27.904
232.346
1.00
81.43
7


ATOM
185
CA
GLU
A
265
53.560
28.251
231.945
1.00
81.40
6


ATOM
186
CB
GLU
A
265
52.613
28.305
233.157
1.00
81.27
6


ATOM
187
CG
GLU
A
265
52.578
29.625
233.903
1.00
81.42
6


ATOM
188
CD
GLU
A
265
51.769
29.565
235.181
1.00
81.82
6


ATOM
189
OE1
GLU
A
265
51.485
30.641
235.749
1.00
82.88
8


ATOM
190
OE2
GLU
A
265
51.422
28.450
235.627
1.00
82.41
8


ATOM
191
C
GLU
A
265
53.508
29.526
231.061
1.00
81.15
6


ATOM
192
O
GLU
A
265
52.698
29.611
230.126
1.00
81.13
8


ATOM
193
N
ALA
A
266
54.390
30.484
231.355
1.00
80.69
7


ATOM
194
CA
ALA
A
266
54.572
31.683
230.551
1.00
80.22
6


ATOM
195
CB
ALA
A
266
55.623
32.567
231.176
1.00
80.03
6


ATOM
196
C
ALA
A
266
54.998
31.303
229.145
1.00
79.99
6


ATOM
197
O
ALA
A
266
54.476
31.834
228.171
1.00
80.24
8


ATOM
198
N
LEU
A
267
55.947
30.380
229.039
1.00
79.60
7


ATOM
199
CA
LEU
A
267
56.433
29.930
227.737
1.00
79.38
6


ATOM
200
CB
LEU
A
267
57.411
28.769
227.876
1.00
79.44
6


ATOM
201
CG
LEU
A
267
58.871
28.994
228.257
1.00
79.42
6


ATOM
202
CD1
LEU
A
267
59.469
27.694
228.743
1.00
79.16
6


ATOM
203
CD2
LEU
A
267
59.667
29.539
227.097
1.00
79.14
6


ATOM
204
C
LEU
A
267
55.316
29.452
226.841
1.00
79.34
6


ATOM
205
O
LEU
A
267
55.239
29.850
225.683
1.00
79.45
8


ATOM
206
N
VAL
A
268
54.467
28.573
227.366
1.00
79.21
7


ATOM
207
CA
VAL
A
268
53.361
28.030
226.572
1.00
79.04
6


ATOM
208
CB
VAL
A
268
52.613
26.883
227.300
1.00
78.93
6


ATOM
209
CG1
VAL
A
268
51.418
26.402
226.487
1.00
78.36
6


ATOM
210
CG2
VAL
A
268
53.564
25.725
227.558
1.00
78.85
6


ATOM
211
C
VAL
A
268
52.424
29.161
226.157
1.00
79.09
6


ATOM
212
O
VAL
A
268
52.099
29.294
224.985
1.00
79.08
8


ATOM
213
N
ALA
A
269
52.035
29.988
227.123
1.00
79.16
7


ATOM
214
CA
ALA
A
269
51.241
31.190
226.878
1.00
79.02
6


ATOM
215
CB
ALA
A
269
51.134
32.011
228.173
1.00
79.10
6


ATOM
216
C
ALA
A
269
51.790
32.044
225.712
1.00
78.94
6


ATOM
217
O
ALA
A
269
51.016
32.524
224.875
1.00
78.93
8


ATOM
218
N
LYS
A
270
53.118
32.206
225.668
1.00
78.91
7


ATOM
219
CA
LYS
A
270
53.831
32.939
224.603
1.00
79.11
6


ATOM
220
CB
LYS
A
270
55.349
32.913
224.847
1.00
78.99
6


ATOM
221
CG
LYS
A
270
55.889
33.820
225.931
1.00
78.89
6


ATOM
222
CD
LYS
A
270
56.069
35.237
225.432
1.00
78.84
6


ATOM
223
CE
LYS
A
270
56.701
36.117
226.481
1.00
78.53
6


ATOM
224
NZ
LYS
A
270
58.147
35.838
226.532
1.00
78.40
7


ATOM
225
C
LYS
A
270
53.629
32.276
223.259
1.00
79.26
6


ATOM
226
O
LYS
A
270
53.286
32.921
222.266
1.00
79.27
8


ATOM
227
N
GLN
A
271
53.900
30.977
223.239
1.00
79.44
7


ATOM
228
CA
GLN
A
271
53.703
30.146
222.065
1.00
79.70
6


ATOM
229
CB
GLN
A
271
54.020
28.702
222.410
1.00
79.72
6


ATOM
230
CG
GLN
A
271
54.034
27.800
221.212
1.00
79.95
6


ATOM
231
CD
GLN
A
271
55.299
27.960
220.416
1.00
80.65
6


ATOM
232
OE1
GLN
A
271
55.254
28.250
219.231
1.00
80.79
8


ATOM
233
NE2
GLN
A
271
56.444
27.786
221.071
1.00
81.31
7


ATOM
234
C
GLN
A
271
52.275
30.214
221.508
1.00
79.85
6


ATOM
235
O
GLN
A
271
52.092
30.352
220.305
1.00
79.94
8


ATOM
236
N
GLU
A
272
51.274
30.090
222.386
1.00
79.87
7


ATOM
237
CA
GLU
A
272
49.872
30.333
222.036
1.00
79.75
6


ATOM
238
CB
GLU
A
272
49.032
30.636
223.279
1.00
79.91
6


ATOM
239
CG
GLU
A
272
47.978
29.614
223.638
1.00
81.15
6


ATOM
240
CD
GLU
A
272
48.506
28.534
224.572
1.00
83.38
6


ATOM
241
OE1
GLU
A
272
48.181
28.556
225.788
1.00
84.07
8


ATOM
242
OE2
GLU
A
272
49.261
27.661
224.090
1.00
84.41
8


ATOM
243
C
GLU
A
272
49.788
31.543
221.137
1.00
79.48
6


ATOM
244
O
GLU
A
272
49.121
31.493
220.103
1.00
79.55
8


ATOM
245
N
LEU
A
273
50.469
32.621
221.554
1.00
79.02
7


ATOM
246
CA
LEU
A
273
50.489
33.901
220.839
1.00
78.51
6


ATOM
247
CB
LEU
A
273
51.075
35.027
221.700
1.00
78.34
6


ATOM
248
CG
LEU
A
273
51.318
36.343
220.934
1.00
77.65
6


ATOM
249
CD1
LEU
A
273
50.001
37.038
220.616
1.00
77.55
6


ATOM
250
CD2
LEU
A
273
52.256
37.287
221.655
1.00
77.81
6


ATOM
251
C
LEU
A
273
51.279
33.840
219.538
1.00
78.55
6


ATOM
252
O
LEU
A
273
50.829
34.371
218.512
1.00
78.74
8


ATOM
253
N
ILE
A
274
52.465
33.230
219.588
1.00
78.25
7


ATOM
254
CA
ILE
A
274
53.295
33.054
218.387
1.00
78.05
6


ATOM
255
CB
ILE
A
274
54.445
32.022
218.582
1.00
78.15
6


ATOM
256
CG1
ILE
A
274
55.511
32.529
219.564
1.00
78.91
6


ATOM
257
CD
ILE
A
274
56.444
33.614
218.999
1.00
79.68
6


ATOM
258
CG2
ILE
A
274
55.066
31.632
217.230
1.00
77.06
6


ATOM
259
C
ILE
A
274
52.461
32.491
217.263
1.00
77.87
6


ATOM
260
O
ILE
A
274
52.391
33.070
216.193
1.00
78.12
8


ATOM
261
N
ASP
A
275
51.823
31.358
217.527
1.00
77.57
7


ATOM
262
CA
ASP
A
275
51.070
30.627
216.517
1.00
77.32
6


ATOM
263
CB
ASP
A
275
50.685
29.250
217.037
1.00
77.35
6


ATOM
264
CG
ASP
A
275
51.817
28.588
217.776
1.00
78.33
6


ATOM
265
OD1
ASP
A
275
52.971
29.024
217.561
1.00
79.48
8


ATOM
266
OD2
ASP
A
275
51.569
27.661
218.584
1.00
78.95
8


ATOM
267
C
ASP
A
275
49.831
31.368
216.064
1.00
77.10
6


ATOM
268
O
ASP
A
275
49.457
31.274
214.903
1.00
77.23
8


ATOM
269
N
LYS
A
276
49.191
32.093
216.979
1.00
76.72
7


ATOM
270
CA
LYS
A
276
48.073
32.965
216.638
1.00
76.28
6


ATOM
271
CB
LYS
A
276
47.521
33.630
217.906
1.00
76.24
6


ATOM
272
CG
LYS
A
276
46.711
34.912
217.702
1.00
76.46
6


ATOM
273
CD
LYS
A
276
45.266
34.785
218.154
1.00
76.27
6


ATOM
274
CE
LYS
A
276
44.766
36.135
218.644
1.00
76.13
6


ATOM
275
NZ
LYS
A
276
43.317
36.130
218.942
1.00
76.37
7


ATOM
276
C
LYS
A
276
48.557
34.001
215.631
1.00
75.92
6


ATOM
277
O
LYS
A
276
47.882
34.264
214.638
1.00
76.06
8


ATOM
278
N
LEU
A
277
49.744
34.552
215.887
1.00
75.43
7


ATOM
279
CA
LEU
A
277
50.347
35.606
215.071
1.00
75.07
6


ATOM
280
CB
LEU
A
277
51.524
36.242
215.822
1.00
74.81
6


ATOM
281
CG
LEU
A
277
51.343
37.516
216.648
1.00
74.54
6


ATOM
282
CD1
LEU
A
277
52.698
38.142
216.886
1.00
73.76
6


ATOM
283
CD2
LEU
A
277
50.410
38.536
215.974
1.00
75.19
6


ATOM
284
C
LEU
A
277
50.853
35.108
213.727
1.00
74.91
6


ATOM
285
O
LEU
A
277
50.693
35.771
212.693
1.00
74.85
8


ATOM
286
N
LYS
A
278
51.506
33.953
213.781
1.00
74.84
7


ATOM
287
CA
LYS
A
278
52.032
33.249
212.621
1.00
74.86
6


ATOM
288
CB
LYS
A
278
52.538
31.857
213.057
1.00
74.63
6


ATOM
289
CG
LYS
A
278
53.711
31.258
212.282
1.00
73.54
6


ATOM
290
CD
LYS
A
278
55.041
31.768
212.820
1.00
72.18
6


ATOM
291
CE
LYS
A
278
56.250
31.072
212.205
1.00
71.59
6


ATOM
292
NZ
LYS
A
278
56.872
30.043
213.087
1.00
70.31
7


ATOM
293
C
LYS
A
278
50.879
33.064
211.664
1.00
75.25
6


ATOM
294
O
LYS
A
278
50.921
33.503
210.517
1.00
75.38
8


ATOM
295
N
GLU
A
279
49.827
32.444
212.177
1.00
75.64
7


ATOM
296
CA
GLU
A
279
48.639
32.143
211.414
1.00
76.14
6


ATOM
297
CB
GLU
A
279
47.713
31.285
212.249
1.00
76.14
6


ATOM
298
CG
GLU
A
279
46.620
30.605
211.479
1.00
77.32
6


ATOM
299
CD
GLU
A
279
45.497
30.185
212.395
1.00
79.14
6


ATOM
300
OE1
GLU
A
279
44.382
30.722
212.233
1.00
80.40
8


ATOM
301
OE2
GLU
A
279
45.730
29.346
213.298
1.00
79.74
8


ATOM
302
C
GLU
A
279
47.903
33.392
210.939
1.00
76.23
6


ATOM
303
O
GLU
A
279
47.401
33.414
209.830
1.00
76.56
8


ATOM
304
N
GLU
A
280
47.825
34.425
211.770
1.00
76.32
7


ATOM
305
CA
GLU
A
280
47.206
35.672
211.348
1.00
76.38
6


ATOM
306
CB
GLU
A
280
47.170
36.675
212.489
1.00
76.35
6


ATOM
307
CG
GLU
A
280
45.956
36.539
213.381
1.00
76.80
6


ATOM
308
CD
GLU
A
280
46.104
37.297
214.691
1.00
77.93
6


ATOM
309
OE1
GLU
A
280
45.309
37.030
215.618
1.00
78.26
8


ATOM
310
OE2
GLU
A
280
47.013
38.156
214.803
1.00
78.36
8


ATOM
311
C
GLU
A
280
47.962
36.261
210.172
1.00
76.62
6


ATOM
312
O
GLU
A
280
47.357
36.647
209.167
1.00
76.82
8


ATOM
313
N
ALA
A
281
49.288
36.309
210.297
1.00
76.86
7


ATOM
314
CA
ALA
A
281
50.169
36.795
209.230
1.00
76.99
6


ATOM
315
CB
ALA
A
281
51.630
36.757
209.682
1.00
77.14
6


ATOM
316
C
ALA
A
281
49.986
35.995
207.946
1.00
76.96
6


ATOM
317
O
ALA
A
281
50.338
36.453
206.863
1.00
77.04
8


ATOM
318
N
GLU
A
282
49.421
34.802
208.076
1.00
76.98
7


ATOM
319
CA
GLU
A
282
49.109
33.975
206.920
1.00
77.23
6


ATOM
320
CB
GLU
A
282
48.728
32.557
207.341
1.00
77.37
6


ATOM
321
CG
GLU
A
282
48.950
31.533
206.257
1.00
78.61
6


ATOM
322
CD
GLU
A
282
50.385
31.552
205.750
1.00
80.14
6


ATOM
323
OE1
GLU
A
282
51.248
30.934
206.411
1.00
79.79
8


ATOM
324
OE2
GLU
A
282
50.645
32.191
204.699
1.00
81.09
8


ATOM
325
C
GLU
A
282
47.997
34.556
206.059
1.00
77.07
6


ATOM
326
O
GLU
A
282
48.166
34.681
204.850
1.00
77.14
8


ATOM
327
N
GLN
A
283
46.858
34.883
206.673
1.00
76.94
7


ATOM
328
CA
GLN
A
283
45.745
35.504
205.938
1.00
76.81
6


ATOM
329
CB
GLN
A
283
44.414
35.488
206.699
1.00
77.00
6


ATOM
330
CG
GLN
A
283
43.709
34.155
206.792
1.00
77.77
6


ATOM
331
CD
GLN
A
283
43.587
33.683
208.240
1.00
79.45
6


ATOM
332
OE1
GLN
A
283
44.174
34.268
209.166
1.00
78.97
8


ATOM
333
NE2
GLN
A
283
42.810
32.623
208.445
1.00
80.36
7


ATOM
334
C
GLN
A
283
46.025
36.945
205.553
1.00
76.35
6


ATOM
335
O
GLN
A
283
45.320
37.492
204.692
1.00
76.38
8


ATOM
336
N
HIS
A
284
47.010
37.572
206.208
1.00
75.63
7


ATOM
337
CA
HIS
A
284
47.465
38.911
205.801
1.00
75.04
6


ATOM
338
CB
HIS
A
284
48.363
39.586
206.848
1.00
75.13
6


ATOM
339
CG
HIS
A
284
47.776
39.663
208.224
1.00
75.41
6


ATOM
340
ND1
HIS
A
284
46.419
39.736
208.461
1.00
75.59
7


ATOM
341
CE1
HIS
A
284
46.205
39.806
209.764
1.00
75.77
6


ATOM
342
NE2
HIS
A
284
47.374
39.797
210.379
1.00
75.45
7


ATOM
343
CD2
HIS
A
284
48.373
39.721
209.440
1.00
75.13
6


ATOM
344
C
HIS
A
284
48.242
38.783
204.497
1.00
74.47
6


ATOM
345
O
HIS
A
284
48.038
39.563
203.555
1.00
74.34
8


ATOM
346
N
LYS
A
285
49.132
37.785
204.474
1.00
73.59
7


ATOM
347
CA
LYS
A
285
49.900
37.396
203.296
1.00
72.73
6


ATOM
348
CB
LYS
A
285
50.613
36.058
203.587
1.00
72.85
6


ATOM
349
CG
LYS
A
285
51.725
35.615
202.619
1.00
73.74
6


ATOM
350
CD
LYS
A
285
51.203
34.897
201.338
1.00
75.10
6


ATOM
351
CE
LYS
A
285
50.670
33.452
201.571
1.00
75.35
6


ATOM
352
NZ
LYS
A
285
51.708
32.376
201.505
1.00
75.28
7


ATOM
353
C
LYS
A
285
48.956
37.282
202.089
1.00
71.80
6


ATOM
354
O
LYS
A
285
49.143
37.962
201.083
1.00
71.76
8


ATOM
355
N
ILE
A
286
47.913
36.467
202.240
1.00
70.67
7


ATOM
356
CA
ILE
A
286
46.969
36.136
201.166
1.00
69.68
6


ATOM
357
CB
ILE
A
286
46.022
34.950
201.583
1.00
69.69
6


ATOM
358
CG1
ILE
A
286
45.974
33.871
200.476
1.00
70.28
6


ATOM
359
CD
ILE
A
286
46.242
32.400
200.943
1.00
70.18
6


ATOM
360
CG2
ILE
A
286
44.626
35.452
201.967
1.00
68.83
6


ATOM
361
C
ILE
A
286
46.152
37.327
200.623
1.00
68.99
6


ATOM
362
O
ILE
A
286
45.689
37.314
199.478
1.00
69.02
8


ATOM
363
N
VAL
A
287
45.974
38.353
201.442
1.00
68.04
7


ATOM
364
CA
VAL
A
287
45.303
39.572
200.999
1.00
67.05
6


ATOM
365
CB
VAL
A
287
44.651
40.305
202.211
1.00
67.04
6


ATOM
366
CG1
VAL
A
287
44.677
41.813
202.060
1.00
66.05
6


ATOM
367
CG2
VAL
A
287
43.240
39.812
202.418
1.00
66.88
6


ATOM
368
C
VAL
A
287
46.290
40.473
200.248
1.00
66.58
6


ATOM
369
O
VAL
A
287
45.960
41.049
199.216
1.00
66.54
8


ATOM
370
N
MET
A
288
47.508
40.570
200.776
1.00
65.76
7


ATOM
371
CA
MET
A
288
48.574
41.382
200.195
1.00
64.98
6


ATOM
372
CB
MET
A
288
49.837
41.251
201.041
1.00
64.94
6


ATOM
373
CG
MET
A
288
49.663
41.683
202.469
1.00
65.34
6


ATOM
374
SD
MET
A
288
51.073
41.339
203.554
1.00
66.03
16


ATOM
375
CE
MET
A
288
52.398
42.312
202.814
1.00
65.40
6


ATOM
376
C
MET
A
288
48.901
40.957
198.772
1.00
63.99
6


ATOM
377
O
MET
A
288
49.336
41.774
197.960
1.00
63.69
8


ATOM
378
N
GLU
A
289
48.708
39.668
198.496
1.00
62.98
7


ATOM
379
CA
GLU
A
289
48.910
39.093
197.170
1.00
62.17
6


ATOM
380
CB
GLU
A
289
48.692
37.597
197.204
1.00
62.12
6


ATOM
381
CG
GLU
A
289
49.887
36.818
197.635
1.00
64.01
6


ATOM
382
CD
GLU
A
289
49.570
35.340
197.706
1.00
67.40
6


ATOM
383
OE1
GLU
A
289
48.640
34.925
196.960
1.00
67.38
8


ATOM
384
OE2
GLU
A
289
50.230
34.602
198.502
1.00
68.10
8


ATOM
385
C
GLU
A
289
47.946
39.674
196.148
1.00
61.13
6


ATOM
386
O
GLU
A
289
48.171
39.577
194.931
1.00
61.18
8


ATOM
387
N
THR
A
290
46.862
40.264
196.639
1.00
59.59
7


ATOM
388
CA
THR
A
290
45.918
40.933
195.759
1.00
57.74
6


ATOM
389
CB
THR
A
290
44.479
40.944
196.314
1.00
57.49
6


ATOM
390
OG1
THR
A
290
44.310
42.073
197.164
1.00
55.48
8


ATOM
391
CG2
THR
A
290
44.181
39.683
197.080
1.00
57.71
6


ATOM
392
C
THR
A
290
46.284
42.395
195.384
1.00
57.47
6


ATOM
393
O
THR
A
290
45.584
42.952
194.540
1.00
57.42
8


ATOM
394
N
VAL
A
291
47.321
43.026
196.001
1.00
56.52
7


ATOM
395
CA
VAL
A
291
47.780
44.393
195.641
1.00
55.85
6


ATOM
396
CB
VAL
A
291
48.712
44.988
196.702
1.00
55.32
6


ATOM
397
CG1
VAL
A
291
49.267
46.338
196.264
1.00
55.05
6


ATOM
398
CG2
VAL
A
291
47.952
45.150
197.972
1.00
54.94
6


ATOM
399
C
VAL
A
291
48.317
44.488
194.193
1.00
55.56
6


ATOM
400
O
VAL
A
291
47.738
45.240
193.382
1.00
55.78
8


ATOM
401
N
PRO
A
292
49.354
43.686
193.842
1.00
54.84
7


ATOM
402
CA
PRO
A
292
49.844
43.624
192.470
1.00
54.30
6


ATOM
403
CB
PRO
A
292
50.684
42.345
192.472
1.00
54.40
6


ATOM
404
CG
PRO
A
292
50.287
41.623
193.719
1.00
54.58
6


ATOM
405
CD
PRO
A
292
50.062
42.716
194.682
1.00
54.67
6


ATOM
406
C
PRO
A
292
48.664
43.468
191.510
1.00
53.71
6


ATOM
407
O
PRO
A
292
48.637
44.116
190.447
1.00
53.44
8


ATOM
408
N
VAL
A
293
47.696
42.634
191.918
1.00
53.07
7


ATOM
409
CA
VAL
A
293
46.443
42.388
191.166
1.00
52.68
6


ATOM
410
CB
VAL
A
293
45.502
41.307
191.857
1.00
52.23
6


ATOM
411
CG1
VAL
A
293
44.050
41.422
191.398
1.00
51.71
6


ATOM
412
CG2
VAL
A
293
45.974
39.922
191.590
1.00
51.88
6


ATOM
413
C
VAL
A
293
45.643
43.677
190.958
1.00
52.54
6


ATOM
414
O
VAL
A
293
45.336
44.086
189.825
1.00
52.34
8


ATOM
415
N
LEU
A
294
45.293
44.317
192.067
1.00
52.20
7


ATOM
416
CA
LEU
A
294
44.479
45.517
191.965
1.00
51.54
6


ATOM
417
CB
LEU
A
294
43.831
45.937
193.295
1.00
51.62
6


ATOM
418
CG
LEU
A
294
42.763
44.985
193.872
1.00
51.19
6


ATOM
419
CD1
LEU
A
294
41.850
45.694
194.839
1.00
48.66
6


ATOM
420
CD2
LEU
A
294
41.942
44.312
192.761
1.00
52.36
6


ATOM
421
C
LEU
A
294
45.233
46.645
191.282
1.00
51.21
6


ATOM
422
O
LEU
A
294
44.653
47.320
190.456
1.00
51.20
8


ATOM
423
N
LYS
A
295
46.525
46.818
191.576
1.00
50.73
7


ATOM
424
CA
LYS
A
295
47.325
47.786
190.837
1.00
50.37
6


ATOM
425
CB
LYS
A
295
48.789
47.692
191.272
1.00
50.63
6


ATOM
426
CG
LYS
A
295
49.533
49.026
191.280
1.00
52.16
6


ATOM
427
CD
LYS
A
295
49.194
49.934
192.516
1.00
54.46
6


ATOM
428
CE
LYS
A
295
49.806
49.444
193.874
1.00
54.25
6


ATOM
429
NZ
LYS
A
295
51.231
49.832
194.136
1.00
53.36
7


ATOM
430
C
LYS
A
295
47.140
47.524
189.331
1.00
49.83
6


ATOM
431
O
LYS
A
295
46.723
48.408
188.591
1.00
49.39
8


ATOM
432
N
ALA
A
296
47.394
46.282
188.914
1.00
49.63
7


ATOM
433
CA
ALA
A
296
47.344
45.898
187.506
1.00
49.30
6


ATOM
434
CB
ALA
A
296
47.671
44.420
187.310
1.00
49.17
6


ATOM
435
C
ALA
A
296
45.981
46.221
186.938
1.00
49.22
6


ATOM
436
O
ALA
A
296
45.894
46.820
185.872
1.00
49.72
8


ATOM
437
N
GLN
A
297
44.906
45.857
187.634
1.00
48.90
7


ATOM
438
CA
GLN
A
297
43.581
46.189
187.087
1.00
48.85
6


ATOM
439
CB
GLN
A
297
42.404
45.770
187.964
1.00
48.94
6


ATOM
440
CG
GLN
A
297
41.092
46.537
187.610
1.00
49.31
6


ATOM
441
CD
GLN
A
297
39.894
46.206
188.516
1.00
50.34
6


ATOM
442
OE1
GLN
A
297
38.945
46.995
188.622
1.00
51.69
8


ATOM
443
NE2
GLN
A
297
39.934
45.038
189.169
1.00
51.71
7


ATOM
444
C
GLN
A
297
43.469
47.675
186.861
1.00
48.33
6


ATOM
445
O
GLN
A
297
43.156
48.104
185.756
1.00
48.54
8


ATOM
446
N
ALA
A
298
43.719
48.457
187.909
1.00
47.62
7


ATOM
447
CA
ALA
A
298
43.595
49.906
187.813
1.00
46.90
6


ATOM
448
CB
ALA
A
298
44.085
50.610
189.069
1.00
46.71
6


ATOM
449
C
ALA
A
298
44.327
50.405
186.585
1.00
46.57
6


ATOM
450
O
ALA
A
298
43.726
51.062
185.753
1.00
46.74
8


ATOM
451
N
ASP
A
299
45.600
50.057
186.438
1.00
46.08
7


ATOM
452
CA
ASP
A
299
46.352
50.478
185.260
1.00
45.84
6


ATOM
453
CB
ASP
A
299
47.792
49.971
185.301
1.00
46.19
6


ATOM
454
CG
ASP
A
299
48.480
50.295
186.603
1.00
47.23
6


ATOM
455
OD1
ASP
A
299
48.105
51.324
187.224
1.00
48.55
8


ATOM
456
OD2
ASP
A
299
49.382
49.514
186.998
1.00
47.75
8


ATOM
457
C
ASP
A
299
45.687
50.041
183.963
1.00
45.16
6


ATOM
458
O
ASP
A
299
45.474
50.867
183.069
1.00
45.25
8


ATOM
459
N
ILE
A
300
45.346
48.757
183.869
1.00
44.18
7


ATOM
460
CA
ILE
A
300
44.756
48.222
182.649
1.00
43.77
6


ATOM
461
CB
ILE
A
300
44.418
46.736
182.775
1.00
43.73
6


ATOM
462
CG1
ILE
A
300
45.609
45.904
182.329
1.00
44.04
6


ATOM
463
CD
ILE
A
300
45.685
44.592
183.042
1.00
44.89
6


ATOM
464
CG2
ILE
A
300
43.274
46.359
181.875
1.00
43.73
6


ATOM
465
C
ILE
A
300
43.532
49.015
182.245
1.00
43.59
6


ATOM
466
O
ILE
A
300
43.413
49.442
181.101
1.00
43.46
8


ATOM
467
N
TYR
A
301
42.633
49.235
183.187
1.00
43.37
7


ATOM
468
CA
TYR
A
301
41.429
49.921
182.832
1.00
43.36
6


ATOM
469
CB
TYR
A
301
40.294
49.605
183.797
1.00
44.03
6


ATOM
470
CG
TYR
A
301
39.635
48.296
183.445
1.00
44.73
6


ATOM
471
CD1
TYR
A
301
39.703
47.215
184.305
1.00
45.52
6


ATOM
472
CE1
TYR
A
301
39.114
46.008
183.972
1.00
45.74
6


ATOM
473
CZ
TYR
A
301
38.447
45.881
182.770
1.00
44.85
6


ATOM
474
OH
TYR
A
301
37.862
44.679
182.448
1.00
46.21
8


ATOM
475
CE2
TYR
A
301
38.371
46.940
181.897
1.00
44.17
6


ATOM
476
CD2
TYR
A
301
38.969
48.132
182.231
1.00
44.51
6


ATOM
477
C
TYR
A
301
41.624
51.407
182.613
1.00
43.09
6


ATOM
478
O
TYR
A
301
40.897
52.007
181.821
1.00
43.38
8


ATOM
479
N
LYS
A
302
42.605
52.005
183.288
1.00
42.67
7


ATOM
480
CA
LYS
A
302
42.876
53.431
183.103
1.00
42.29
6


ATOM
481
CB
LYS
A
302
43.945
53.925
184.072
1.00
42.22
6


ATOM
482
CG
LYS
A
302
44.489
55.314
183.734
1.00
42.82
6


ATOM
483
CD
LYS
A
302
45.316
55.917
184.877
1.00
43.24
6


ATOM
484
CE
LYS
A
302
46.152
57.089
184.385
1.00
44.85
6


ATOM
485
NZ
LYS
A
302
47.558
56.891
184.885
1.00
48.09
7


ATOM
486
C
LYS
A
302
43.334
53.617
181.681
1.00
41.91
6


ATOM
487
O
LYS
A
302
42.781
54.420
180.942
1.00
41.83
8


ATOM
488
N
ALA
A
303
44.333
52.824
181.305
1.00
41.91
7


ATOM
489
CA
ALA
A
303
44.837
52.743
179.936
1.00
41.67
6


ATOM
490
CB
ALA
A
303
45.889
51.676
179.868
1.00
41.61
6


ATOM
491
C
ALA
A
303
43.751
52.471
178.899
1.00
41.57
6


ATOM
492
O
ALA
A
303
43.739
53.068
177.844
1.00
41.66
8


ATOM
493
N
ASP
A
304
42.837
51.565
179.193
1.00
41.57
7


ATOM
494
CA
ASP
A
304
41.826
51.291
178.219
1.00
41.67
6


ATOM
495
CB
ASP
A
304
41.199
49.939
178.433
1.00
42.26
6


ATOM
496
CG
ASP
A
304
42.108
48.865
177.906
1.00
45.50
6


ATOM
497
OD1
ASP
A
304
42.244
47.797
178.547
1.00
49.37
8


ATOM
498
OD2
ASP
A
304
42.750
49.136
176.853
1.00
46.89
8


ATOM
499
C
ASP
A
304
40.873
52.432
178.017
1.00
41.00
6


ATOM
500
O
ASP
A
304
40.549
52.755
176.862
1.00
41.04
8


ATOM
501
N
PHE
A
305
40.495
53.075
179.122
1.00
40.10
7


ATOM
502
CA
PHE
A
305
39.622
54.214
179.052
1.00
39.38
6


ATOM
503
CB
PHE
A
305
39.447
54.895
180.390
1.00
39.47
6


ATOM
504
CG
PHE
A
305
38.999
56.324
180.248
1.00
38.56
6


ATOM
505
CD1
PHE
A
305
37.680
56.622
180.002
1.00
38.06
6


ATOM
506
CE1
PHE
A
305
37.270
57.929
179.827
1.00
38.38
6


ATOM
507
CZ
PHE
A
305
38.170
58.944
179.885
1.00
38.12
6


ATOM
508
CE2
PHE
A
305
39.493
58.657
180.120
1.00
39.16
6


ATOM
509
CD2
PHE
A
305
39.905
57.352
180.291
1.00
38.01
6


ATOM
510
C
PHE
A
305
40.248
55.237
178.159
1.00
39.02
6


ATOM
511
O
PHE
A
305
39.594
55.830
177.305
1.00
38.98
8


ATOM
512
N
GLN
A
306
41.520
55.480
178.401
1.00
38.74
7


ATOM
513
CA
GLN
A
306
42.207
56.532
177.690
1.00
38.96
6


ATOM
514
CB
GLN
A
306
43.647
56.653
178.128
1.00
38.80
6


ATOM
515
CG
GLN
A
306
43.808
57.295
179.486
1.00
40.68
6


ATOM
516
CD
GLN
A
306
45.244
57.251
179.955
1.00
43.90
6


ATOM
517
OE1
GLN
A
306
46.159
57.403
179.154
1.00
45.50
8


ATOM
518
NE2
GLN
A
306
45.456
57.029
181.254
1.00
45.70
7


ATOM
519
C
GLN
A
306
42.147
56.285
176.211
1.00
38.86
6


ATOM
520
O
GLN
A
306
41.795
57.175
175.470
1.00
39.31
8


ATOM
521
N
ALA
A
307
42.457
55.069
175.774
1.00
38.67
7


ATOM
522
CA
ALA
A
307
42.296
54.738
174.367
1.00
38.13
6


ATOM
523
CB
ALA
A
307
42.852
53.400
174.054
1.00
37.84
6


ATOM
524
C
ALA
A
307
40.834
54.861
173.913
1.00
38.20
6


ATOM
525
O
ALA
A
307
40.600
55.327
172.808
1.00
38.71
8


ATOM
526
N
GLU
A
308
39.860
54.470
174.742
1.00
37.63
7


ATOM
527
CA
GLU
A
308
38.456
54.663
174.376
1.00
37.05
6


ATOM
528
CB
GLU
A
308
37.505
54.126
175.464
1.00
37.71
6


ATOM
529
CG
GLU
A
308
36.247
53.502
174.901
1.00
36.69
6


ATOM
530
CD
GLU
A
308
36.633
52.608
173.796
1.00
35.01
6


ATOM
531
OE1
GLU
A
308
35.850
52.419
172.842
1.00
34.91
8


ATOM
532
OE2
GLU
A
308
37.777
52.128
173.897
1.00
34.26
8


ATOM
533
C
GLU
A
308
38.182
56.135
174.125
1.00
36.47
6


ATOM
534
O
GLU
A
308
37.667
56.522
173.062
1.00
36.25
8


ATOM
535
N
ARG
A
309
38.533
56.952
175.107
1.00
35.84
7


ATOM
536
CA
ARG
A
309
38.212
58.365
175.015
1.00
35.72
6


ATOM
537
CB
ARG
A
309
38.801
59.178
176.162
1.00
35.31
6


ATOM
538
CG
ARG
A
309
38.879
60.625
175.800
1.00
34.37
6


ATOM
539
CD
ARG
A
309
37.524
61.212
175.696
1.00
35.10
6


ATOM
540
NE
ARG
A
309
37.040
61.643
177.005
1.00
39.10
7


ATOM
541
CZ
ARG
A
309
35.860
61.296
177.521
1.00
40.41
6


ATOM
542
NH1
ARG
A
309
35.031
60.519
176.817
1.00
40.79
7


ATOM
543
NH2
ARG
A
309
35.493
61.755
178.718
1.00
39.97
7


ATOM
544
C
ARG
A
309
38.756
58.894
173.712
1.00
35.44
6


ATOM
545
O
ARG
A
309
38.082
59.644
172.999
1.00
35.73
8


ATOM
546
N
HIS
A
310
39.971
58.465
173.403
1.00
34.76
7


ATOM
547
CA
HIS
A
310
40.661
58.966
172.248
1.00
34.42
6


ATOM
548
CB
HIS
A
310
42.085
58.458
172.211
1.00
34.33
6


ATOM
549
CG
HIS
A
310
42.923
59.088
171.147
1.00
35.33
6


ATOM
550
ND1
HIS
A
310
42.587
59.041
169.809
1.00
36.33
7


ATOM
551
CE1
HIS
A
310
43.518
59.662
169.104
1.00
37.03
6


ATOM
552
NE2
HIS
A
310
44.440
60.117
169.933
1.00
35.51
7


ATOM
553
CD2
HIS
A
310
44.100
59.759
171.216
1.00
35.85
6


ATOM
554
C
HIS
A
310
39.906
58.654
170.954
1.00
34.42
6


ATOM
555
O
HIS
A
310
39.729
59.561
170.136
1.00
35.07
8


ATOM
556
N
ALA
A
311
39.432
57.414
170.782
1.00
33.53
7


ATOM
557
CA
ALA
A
311
38.597
57.062
169.643
1.00
32.97
6


ATOM
558
CB
ALA
A
311
38.331
55.635
169.638
1.00
32.83
6


ATOM
559
C
ALA
A
311
37.292
57.807
169.700
1.00
33.26
6


ATOM
560
O
ALA
A
311
36.860
58.387
168.692
1.00
33.19
8


ATOM
561
N
ARG
A
312
36.681
57.797
170.890
1.00
33.54
7


ATOM
562
CA
ARG
A
312
35.368
58.419
171.118
1.00
34.12
6


ATOM
563
CB
ARG
A
312
34.981
58.332
172.602
1.00
34.08
6


ATOM
564
CG
ARG
A
312
33.564
58.795
172.904
1.00
33.75
6


ATOM
565
CD
ARG
A
312
33.568
60.168
173.500
1.00
33.44
6


ATOM
566
NE
ARG
A
312
32.214
60.649
173.768
1.00
34.06
7


ATOM
567
CZ
ARG
A
312
31.479
60.316
174.835
1.00
34.22
6


ATOM
568
NH1
ARG
A
312
31.930
59.466
175.750
1.00
32.76
7


ATOM
569
NH2
ARG
A
312
30.275
60.842
174.994
1.00
34.29
7


ATOM
570
C
ARG
A
312
35.325
59.869
170.605
1.00
34.42
6


ATOM
571
O
ARG
A
312
34.316
60.315
170.048
1.00
34.07
8


ATOM
572
N
GLU
A
313
36.428
60.587
170.773
1.00
34.75
7


ATOM
573
CA
GLU
A
313
36.458
61.946
170.296
1.00
36.02
6


ATOM
574
CB
GLU
A
313
37.708
62.689
170.745
1.00
36.55
6


ATOM
575
CG
GLU
A
313
38.049
62.452
172.178
1.00
41.53
6


ATOM
576
CD
GLU
A
313
38.736
63.633
172.852
1.00
47.48
6


ATOM
577
OE1
GLU
A
313
39.548
64.319
172.183
1.00
49.77
8


ATOM
578
OE2
GLU
A
313
38.474
63.861
174.071
1.00
51.50
8


ATOM
579
C
GLU
A
313
36.424
61.916
168.793
1.00
35.81
6


ATOM
580
O
GLU
A
313
35.544
62.535
168.171
1.00
35.63
8


ATOM
581
N
LYS
A
314
37.380
61.174
168.221
1.00
35.72
7


ATOM
582
CA
LYS
A
314
37.626
61.218
166.791
1.00
35.35
6


ATOM
583
CB
LYS
A
314
38.691
60.223
166.382
1.00
34.98
6


ATOM
584
CG
LYS
A
314
40.087
60.772
166.447
1.00
35.33
6


ATOM
585
CD
LYS
A
314
41.051
59.859
165.734
1.00
35.09
6


ATOM
586
CE
LYS
A
314
42.340
60.551
165.370
1.00
35.42
6


ATOM
587
NZ
LYS
A
314
43.481
59.603
165.698
1.00
36.91
7


ATOM
588
C
LYS
A
314
36.338
60.933
166.078
1.00
35.71
6


ATOM
589
O
LYS
A
314
36.074
61.546
165.043
1.00
35.61
8


ATOM
590
N
LEU
A
315
35.538
60.024
166.652
1.00
35.83
7


ATOM
591
CA
LEU
A
315
34.207
59.738
166.161
1.00
35.96
6


ATOM
592
CB
LEU
A
315
33.654
58.519
166.852
1.00
36.23
6


ATOM
593
CG
LEU
A
315
34.464
57.235
166.666
1.00
37.28
6


ATOM
594
CD1
LEU
A
315
34.300
56.299
167.872
1.00
37.09
6


ATOM
595
CD2
LEU
A
315
34.081
56.519
165.369
1.00
37.93
6


ATOM
596
C
LEU
A
315
33.276
60.922
166.367
1.00
36.22
6


ATOM
597
O
LEU
A
315
32.689
61.383
165.410
1.00
36.53
8


ATOM
598
N
VAL
A
316
33.152
61.440
167.590
1.00
36.39
7


ATOM
599
CA
VAL
A
316
32.242
62.560
167.843
1.00
36.51
6


ATOM
600
CB
VAL
A
316
32.494
63.210
169.210
1.00
36.14
6


ATOM
601
CG1
VAL
A
316
32.214
64.703
169.188
1.00
35.15
6


ATOM
602
CG2
VAL
A
316
31.643
62.527
170.256
1.00
36.40
6


ATOM
603
C
VAL
A
316
32.452
63.557
166.752
1.00
37.11
6


ATOM
604
O
VAL
A
316
31.520
64.093
166.179
1.00
37.40
8


ATOM
605
N
GLU
A
317
33.717
63.740
166.447
1.00
38.09
7


ATOM
606
CA
GLU
A
317
34.185
64.668
165.461
1.00
39.29
6


ATOM
607
CB
GLU
A
317
35.701
64.645
165.561
1.00
39.91
6


ATOM
608
CG
GLU
A
317
36.455
64.939
164.313
1.00
43.05
6


ATOM
609
CD
GLU
A
317
36.686
66.421
164.139
1.00
46.07
6


ATOM
610
OE1
GLU
A
317
35.764
67.099
163.611
1.00
46.37
8


ATOM
611
OE2
GLU
A
317
37.801
66.882
164.525
1.00
46.81
8


ATOM
612
C
GLU
A
317
33.683
64.266
164.069
1.00
39.27
6


ATOM
613
O
GLU
A
317
33.067
65.057
163.375
1.00
39.27
8


ATOM
614
N
LYS
A
318
33.926
63.030
163.666
1.00
39.74
7


ATOM
615
CA
LYS
A
318
33.427
62.545
162.388
1.00
40.01
6


ATOM
616
CB
LYS
A
318
33.807
61.075
162.176
1.00
39.78
6


ATOM
617
CG
LYS
A
318
33.545
60.518
160.781
1.00
38.10
6


ATOM
618
CD
LYS
A
318
34.142
61.396
159.706
1.00
37.70
6


ATOM
619
CE
LYS
A
318
35.618
61.160
159.463
1.00
36.88
6


ATOM
620
NZ
LYS
A
318
36.080
62.044
158.344
1.00
36.59
7


ATOM
621
C
LYS
A
318
31.911
62.738
162.300
1.00
40.85
6


ATOM
622
O
LYS
A
318
31.436
63.299
161.316
1.00
41.51
8


ATOM
623
N
LYS
A
319
31.156
62.300
163.317
1.00
41.24
7


ATOM
624
CA
LYS
A
319
29.701
62.528
163.347
1.00
41.73
6


ATOM
625
CB
LYS
A
319
29.084
62.138
164.697
1.00
41.47
6


ATOM
626
CG
LYS
A
319
27.567
62.314
164.735
1.00
43.40
6


ATOM
627
CD
LYS
A
319
27.032
62.547
166.157
1.00
46.30
6


ATOM
628
CE
LYS
A
319
27.301
63.987
166.703
1.00
48.83
6


ATOM
629
NZ
LYS
A
319
27.319
64.156
168.232
1.00
47.00
7


ATOM
630
C
LYS
A
319
29.357
63.989
162.968
1.00
41.84
6


ATOM
631
O
LYS
A
319
28.618
64.212
161.998
1.00
41.46
8


ATOM
632
N
GLU
A
320
29.918
64.954
163.708
1.00
42.07
7


ATOM
633
CA
GLU
A
320
29.738
66.378
163.420
1.00
43.11
6


ATOM
634
CB
GLU
A
320
30.742
67.278
164.178
1.00
43.58
6


ATOM
635
CG
GLU
A
320
30.704
67.236
165.711
1.00
47.05
6


ATOM
636
CD
GLU
A
320
29.305
67.499
166.296
1.00
52.10
6


ATOM
637
OE1
GLU
A
320
28.575
68.364
165.725
1.00
53.88
8


ATOM
638
OE2
GLU
A
320
28.941
66.846
167.327
1.00
52.67
8


ATOM
639
C
GLU
A
320
29.917
66.625
161.934
1.00
43.15
6


ATOM
640
O
GLU
A
320
29.005
67.145
161.273
1.00
43.42
8


ATOM
641
N
TYR
A
321
31.095
66.254
161.419
1.00
42.94
7


ATOM
642
CA
TYR
A
321
31.440
66.468
160.019
1.00
42.74
6


ATOM
643
CB
TYR
A
321
32.822
65.892
159.681
1.00
42.84
6


ATOM
644
CG
TYR
A
321
33.110
65.974
158.209
1.00
42.31
6


ATOM
645
CD1
TYR
A
321
33.494
67.171
157.626
1.00
42.85
6


ATOM
646
CE1
TYR
A
321
33.722
67.265
156.258
1.00
42.57
6


ATOM
647
CZ
TYR
A
321
33.549
66.155
155.474
1.00
42.11
6


ATOM
648
OH
TYR
A
321
33.768
66.233
154.135
1.00
41.62
8


ATOM
649
CE2
TYR
A
321
33.155
64.959
156.030
1.00
42.63
6


ATOM
650
CD2
TYR
A
321
32.940
64.875
157.393
1.00
42.41
6


ATOM
651
C
TYR
A
321
30.386
65.887
159.077
1.00
43.07
6


ATOM
652
O
TYR
A
321
30.001
66.540
158.100
1.00
43.16
8


ATOM
653
N
LEU
A
322
29.908
64.678
159.372
1.00
43.28
7


ATOM
654
CA
LEU
A
322
28.896
64.066
158.533
1.00
43.76
6


ATOM
655
CB
LEU
A
322
28.746
62.609
158.866
1.00
43.15
6


ATOM
656
CG
LEU
A
322
29.982
61.842
158.414
1.00
42.73
6


ATOM
657
CD1
LEU
A
322
29.634
60.383
158.329
1.00
43.70
6


ATOM
658
CD2
LEU
A
322
30.511
62.294
157.067
1.00
41.08
6


ATOM
659
C
LEU
A
322
27.558
64.796
158.570
1.00
44.89
6


ATOM
660
O
LEU
A
322
26.940
64.986
157.521
1.00
44.77
8


ATOM
661
N
GLN
A
323
27.130
65.222
159.765
1.00
46.29
7


ATOM
662
CA
GLN
A
323
25.897
65.992
159.923
1.00
47.61
6


ATOM
663
CB
GLN
A
323
25.660
66.385
161.389
1.00
47.12
6


ATOM
664
CG
GLN
A
323
24.868
65.349
162.230
1.00
48.21
6


ATOM
665
CD
GLN
A
323
25.298
65.253
163.746
1.00
49.49
6


ATOM
666
OE1
GLN
A
323
26.009
66.118
164.271
1.00
52.44
8


ATOM
667
NE2
GLN
A
323
24.853
64.191
164.432
1.00
50.57
7


ATOM
668
C
GLN
A
323
25.936
67.198
158.991
1.00
48.24
6


ATOM
669
O
GLN
A
323
24.972
67.450
158.280
1.00
48.14
8


ATOM
670
N
GLU
A
324
27.069
67.898
158.954
1.00
49.58
7


ATOM
671
CA
GLU
A
324
27.248
69.031
158.049
1.00
51.32
6


ATOM
672
CB
GLU
A
324
28.576
69.727
158.274
1.00
51.84
6


ATOM
673
CG
GLU
A
324
28.583
70.635
159.464
1.00
55.85
6


ATOM
674
CD
GLU
A
324
29.959
70.704
160.124
1.00
61.05
6


ATOM
675
OE1
GLU
A
324
30.982
70.661
159.377
1.00
63.21
8


ATOM
676
OE2
GLU
A
324
30.007
70.808
161.383
1.00
62.05
8


ATOM
677
C
GLU
A
324
27.164
68.619
156.602
1.00
51.58
6


ATOM
678
O
GLU
A
324
26.410
69.208
155.839
1.00
51.72
8


ATOM
679
N
GLN
A
325
27.934
67.617
156.213
1.00
52.30
7


ATOM
680
CA
GLN
A
325
27.848
67.141
154.853
1.00
53.55
6


ATOM
681
CB
GLN
A
325
28.648
65.869
154.678
1.00
53.62
6


ATOM
682
CG
GLN
A
325
30.135
66.083
154.783
1.00
54.69
6


ATOM
683
CD
GLN
A
325
30.610
67.299
154.022
1.00
55.31
6


ATOM
684
OE1
GLN
A
325
30.791
68.372
154.600
1.00
56.28
8


ATOM
685
NE2
GLN
A
325
30.812
67.142
152.718
1.00
55.13
7


ATOM
686
C
GLN
A
325
26.408
66.886
154.450
1.00
54.36
6


ATOM
687
O
GLN
A
325
25.992
67.266
153.364
1.00
54.56
8


ATOM
688
N
LEU
A
326
25.651
66.242
155.334
1.00
55.40
7


ATOM
689
CA
LEU
A
326
24.231
66.011
155.116
1.00
56.16
6


ATOM
690
CB
LEU
A
326
23.655
65.054
156.158
1.00
55.64
6


ATOM
691
CG
LEU
A
326
23.334
63.651
155.640
1.00
54.81
6


ATOM
692
CD1
LEU
A
326
22.347
62.962
156.519
1.00
54.72
6


ATOM
693
CD2
LEU
A
326
22.741
63.728
154.275
1.00
55.41
6


ATOM
694
C
LEU
A
326
23.394
67.280
155.046
1.00
57.27
6


ATOM
695
O
LEU
A
326
22.473
67.352
154.250
1.00
57.66
8


ATOM
696
N
GLU
A
327
23.700
68.274
155.867
1.00
58.54
7


ATOM
697
CA
GLU
A
327
22.969
69.523
155.786
1.00
60.05
6


ATOM
698
CB
GLU
A
327
23.312
70.445
156.960
1.00
60.19
6


ATOM
699
CG
GLU
A
327
22.394
71.676
157.155
1.00
61.03
6


ATOM
700
CD
GLU
A
327
20.925
71.335
157.421
1.00
62.03
6


ATOM
701
OE1
GLU
A
327
20.573
70.136
157.386
1.00
62.52
8


ATOM
702
OE2
GLU
A
327
20.119
72.271
157.654
1.00
61.96
8


ATOM
703
C
GLU
A
327
23.223
70.171
154.430
1.00
61.19
6


ATOM
704
O
GLU
A
327
22.296
70.280
153.630
1.00
61.54
8


ATOM
705
N
GLN
A
328
24.471
70.552
154.162
1.00
62.53
7


ATOM
706
CA
GLN
A
328
24.859
71.117
152.872
1.00
64.22
6


ATOM
707
CB
GLN
A
328
26.376
71.194
152.765
1.00
64.79
6


ATOM
708
CG
GLN
A
328
26.920
72.612
152.670
1.00
67.70
6


ATOM
709
CD
GLN
A
328
26.291
73.586
153.686
1.00
71.01
6


ATOM
710
OE1
GLN
A
328
26.909
73.906
154.721
1.00
71.92
8


ATOM
711
NE2
GLN
A
328
25.070
74.074
153.384
1.00
70.50
7


ATOM
712
C
GLN
A
328
24.301
70.399
151.657
1.00
64.82
6


ATOM
713
O
GLN
A
328
23.890
71.048
150.701
1.00
65.09
8


ATOM
714
N
LEU
A
329
24.284
69.070
151.697
1.00
65.64
7


ATOM
715
CA
LEU
A
329
23.826
68.287
150.570
1.00
66.69
6


ATOM
716
CB
LEU
A
329
24.313
66.850
150.673
1.00
66.65
6


ATOM
717
CG
LEU
A
329
24.342
66.023
149.383
1.00
66.07
6


ATOM
718
CD1
LEU
A
329
23.112
65.170
149.269
1.00
64.76
6


ATOM
719
CD2
LEU
A
329
24.538
66.908
148.133
1.00
65.81
6


ATOM
720
C
LEU
A
329
22.329
68.297
150.460
1.00
67.81
6


ATOM
721
O
LEU
A
329
21.803
68.298
149.367
1.00
68.11
8


ATOM
722
N
GLN
A
330
21.645
68.290
151.593
1.00
69.44
7


ATOM
723
CA
GLN
A
330
20.188
68.357
151.614
1.00
71.03
6


ATOM
724
CB
GLN
A
330
19.679
67.995
153.017
1.00
71.12
6


ATOM
725
CG
GLN
A
330
18.174
68.148
153.273
1.00
72.41
6


ATOM
726
CD
GLN
A
330
17.288
67.401
152.272
1.00
74.23
6


ATOM
727
OE1
GLN
A
330
17.731
66.458
151.605
1.00
74.44
8


ATOM
728
NE2
GLN
A
330
16.023
67.828
152.166
1.00
74.54
7


ATOM
729
C
GLN
A
330
19.662
69.726
151.149
1.00
71.91
6


ATOM
730
O
GLN
A
330
18.555
69.841
150.611
1.00
71.92
8


ATOM
731
N
ARG
A
331
20.470
70.759
151.338
1.00
73.14
7


ATOM
732
CA
ARG
A
331
20.103
72.086
150.868
1.00
74.41
6


ATOM
733
CB
ARG
A
331
20.850
73.164
151.648
1.00
74.06
6


ATOM
734
CG
ARG
A
331
20.530
73.166
153.130
1.00
72.82
6


ATOM
735
CD
ARG
A
331
21.195
74.320
153.847
1.00
70.75
6


ATOM
736
NE
ARG
A
331
20.934
74.285
155.281
1.00
68.50
7


ATOM
737
CZ
ARG
A
331
21.401
75.171
156.148
1.00
67.16
6


ATOM
738
NH1
ARG
A
331
22.158
76.175
155.740
1.00
66.73
7


ATOM
739
NH2
ARG
A
331
21.110
75.046
157.425
1.00
66.80
7


ATOM
740
C
ARG
A
331
20.290
72.244
149.353
1.00
75.79
6


ATOM
741
O
ARG
A
331
19.729
73.163
148.747
1.00
76.06
8


ATOM
742
N
GLU
A
332
21.065
71.341
148.756
1.00
77.29
7


ATOM
743
CA
GLU
A
332
21.313
71.315
147.315
1.00
78.99
6


ATOM
744
CB
GLU
A
332
22.620
70.585
147.039
1.00
79.10
6


ATOM
745
CG
GLU
A
332
23.711
71.450
146.478
1.00
80.61
6


ATOM
746
CD
GLU
A
332
23.989
72.646
147.343
1.00
82.74
6


ATOM
747
OE1
GLU
A
332
24.867
72.518
148.227
1.00
83.96
8


ATOM
748
OE2
GLU
A
332
23.320
73.696
147.151
1.00
83.56
8


ATOM
749
C
GLU
A
332
20.204
70.606
146.571
1.00
79.91
6


ATOM
750
O
GLU
A
332
19.723
71.079
145.544
1.00
80.08
8


ATOM
751
N
PHE
A
333
19.844
69.444
147.101
1.00
81.18
7


ATOM
752
CA
PHE
A
333
18.723
68.641
146.664
1.00
82.48
6


ATOM
753
CB
PHE
A
333
18.650
67.409
147.570
1.00
82.54
6


ATOM
754
CG
PHE
A
333
17.756
66.304
147.064
1.00
83.09
6


ATOM
755
CD1
PHE
A
333
18.246
65.346
146.166
1.00
83.45
6


ATOM
756
CE1
PHE
A
333
17.415
64.305
145.706
1.00
83.73
6


ATOM
757
CZ
PHE
A
333
16.090
64.210
146.163
1.00
83.17
6


ATOM
758
CE2
PHE
A
333
15.599
65.154
147.070
1.00
83.22
6


ATOM
759
CD2
PHE
A
333
16.435
66.188
147.524
1.00
83.25
6


ATOM
760
C
PHE
A
333
17.437
69.442
146.807
1.00
83.43
6


ATOM
761
O
PHE
A
333
16.386
69.032
146.321
1.00
83.77
8


ATOM
762
N
ASN
A
334
17.501
70.581
147.488
1.00
84.40
7


ATOM
763
CA
ASN
A
334
16.296
71.386
147.639
1.00
85.15
6


ATOM
764
CB
ASN
A
334
15.912
71.564
149.109
1.00
85.01
6


ATOM
765
CG
ASN
A
334
15.577
70.238
149.789
1.00
84.20
6


ATOM
766
OD1
ASN
A
334
15.334
69.226
149.129
1.00
82.90
8


ATOM
767
ND2
ASN
A
334
15.566
70.244
151.113
1.00
83.01
7


ATOM
768
C
ASN
A
334
16.271
72.685
146.851
1.00
85.96
6


ATOM
769
O
ASN
A
334
15.203
73.177
146.533
1.00
86.07
8


ATOM
770
N
LYS
A
335
17.433
73.227
146.514
1.00
87.13
7


ATOM
771
CA
LYS
A
335
17.478
74.371
145.609
1.00
88.32
6


ATOM
772
CB
LYS
A
335
18.704
75.249
145.885
1.00
88.31
6


ATOM
773
CG
LYS
A
335
18.469
76.248
147.008
1.00
88.61
6


ATOM
774
CD
LYS
A
335
19.747
76.581
147.736
1.00
89.01
6


ATOM
775
CE
LYS
A
335
19.443
77.262
149.053
1.00
88.95
6


ATOM
776
NZ
LYS
A
335
20.688
77.591
149.787
1.00
89.07
7


ATOM
777
C
LYS
A
335
17.393
73.904
144.152
1.00
89.02
6


ATOM
778
O
LYS
A
335
16.719
74.527
143.331
1.00
89.20
8


ATOM
779
N
LEU
A
336
18.056
72.784
143.866
1.00
89.96
7


ATOM
780
CA
LEU
A
336
18.036
72.115
142.561
1.00
90.64
6


ATOM
781
CB
LEU
A
336
19.400
71.409
142.351
1.00
90.53
6


ATOM
782
CG
LEU
A
336
19.972
70.837
141.042
1.00
90.21
6


ATOM
783
CD1
LEU
A
336
21.423
71.285
140.821
1.00
89.63
6


ATOM
784
CD2
LEU
A
336
19.876
69.315
141.019
1.00
89.73
6


ATOM
785
C
LEU
A
336
16.859
71.116
142.514
1.00
91.24
6


ATOM
786
O
LEU
A
336
16.832
70.217
141.674
1.00
91.39
8


ATOM
787
N
LYS
A
337
15.882
71.300
143.409
1.00
91.82
7


ATOM
788
CA
LYS
A
337
14.740
70.380
143.547
1.00
92.31
6


ATOM
789
CB
LYS
A
337
14.005
70.624
144.869
1.00
92.40
6


ATOM
790
CG
LYS
A
337
13.216
69.416
145.375
1.00
92.55
6


ATOM
791
CD
LYS
A
337
12.668
69.637
146.776
1.00
92.33
6


ATOM
792
CE
LYS
A
337
12.199
68.330
147.383
1.00
91.45
6


ATOM
793
NZ
LYS
A
337
11.469
68.579
148.642
1.00
90.92
7


ATOM
794
C
LYS
A
337
13.747
70.442
142.382
1.00
92.61
6


ATOM
795
O
LYS
A
337
14.096
70.638
141.218
1.00
92.91
8


ATOM
796
OXT
LYS
A
337
12.530
70.339
142.576
1.00
92.65
8


ATOM
797
N
SER
B
247
74.573
13.366
243.691
1.00
80.34
7


ATOM
798
CA
SER
B
247
74.309
12.439
244.839
1.00
80.35
6


ATOM
799
CB
SER
B
247
75.563
12.231
245.702
1.00
80.24
6


ATOM
800
OG
SER
B
247
75.643
13.191
246.747
1.00
79.88
8


ATOM
801
C
SER
B
247
73.158
12.935
245.711
1.00
80.47
6


ATOM
802
O
SER
B
247
73.052
14.136
246.002
1.00
80.69
8


ATOM
803
N
MET
B
248
72.305
11.990
246.111
1.00
80.37
7


ATOM
804
CA
MET
B
248
71.164
12.223
247.014
1.00
80.13
6


ATOM
805
CB
MET
B
248
71.640
12.350
248.464
1.00
80.27
6


ATOM
806
CG
MET
B
248
71.518
11.068
249.289
1.00
79.98
6


ATOM
807
SD
MET
B
248
70.989
11.478
250.975
1.00
80.26
16


ATOM
808
CE
MET
B
248
69.329
12.195
250.686
1.00
79.56
6


ATOM
809
C
MET
B
248
70.196
13.367
246.647
1.00
79.85
6


ATOM
810
O
MET
B
248
69.780
13.496
245.490
1.00
79.97
8


ATOM
811
N
ALA
B
249
69.858
14.198
247.634
1.00
79.47
7


ATOM
812
CA
ALA
B
249
68.688
15.087
247.548
1.00
79.06
6


ATOM
813
CB
ALA
B
249
67.809
14.918
248.822
1.00
79.23
6


ATOM
814
C
ALA
B
249
68.910
16.590
247.213
1.00
78.53
6


ATOM
815
O
ALA
B
249
67.932
17.336
247.113
1.00
78.39
8


ATOM
816
N
SER
B
250
70.165
17.029
247.043
1.00
77.83
7


ATOM
817
CA
SER
B
250
70.461
18.421
246.613
1.00
76.92
6


ATOM
818
CB
SER
B
250
71.441
19.134
247.556
1.00
76.81
6


ATOM
819
OG
SER
B
250
72.159
20.157
246.883
1.00
76.19
8


ATOM
820
C
SER
B
250
70.957
18.537
245.174
1.00
76.35
6


ATOM
821
O
SER
B
250
70.929
19.630
244.602
1.00
76.22
8


ATOM
822
N
MET
B
251
71.423
17.429
244.598
1.00
75.47
7


ATOM
823
CA
MET
B
251
71.623
17.393
243.156
1.00
74.63
6


ATOM
824
CB
MET
B
251
72.286
16.088
242.700
1.00
74.73
6


ATOM
825
CG
MET
B
251
73.773
16.275
242.344
1.00
74.68
6


ATOM
826
SD
MET
B
251
74.208
16.478
240.572
1.00
75.60
16


ATOM
827
CE
MET
B
251
73.183
17.815
239.951
1.00
73.52
6


ATOM
828
C
MET
B
251
70.290
17.711
242.440
1.00
74.03
6


ATOM
829
O
MET
B
251
70.286
18.172
241.298
1.00
74.00
8


ATOM
830
N
GLN
B
252
69.182
17.451
243.144
1.00
72.87
7


ATOM
831
CA
GLN
B
252
67.851
18.069
242.946
1.00
72.59
6


ATOM
832
CB
GLN
B
252
66.945
17.790
244.146
1.00
72.33
6


ATOM
833
CG
GLN
B
252
66.634
16.334
244.398
1.00
71.53
6


ATOM
834
CD
GLN
B
252
65.387
16.169
245.230
1.00
70.50
6


ATOM
835
OE1
GLN
B
252
65.461
15.858
246.419
1.00
70.46
8


ATOM
836
NE2
GLN
B
252
64.230
16.399
244.617
1.00
69.54
7


ATOM
837
C
GLN
B
252
67.846
19.584
242.725
1.00
72.68
6


ATOM
838
O
GLN
B
252
66.989
20.109
242.008
1.00
72.59
8


ATOM
839
N
LEU
B
253
68.769
20.300
243.357
1.00
72.96
7


ATOM
840
CA
LEU
B
253
68.833
21.736
243.122
1.00
73.18
6


ATOM
841
CB
LEU
B
253
69.477
22.490
244.297
1.00
72.92
6


ATOM
842
CG
LEU
B
253
69.411
24.021
244.327
1.00
72.11
6


ATOM
843
CD1
LEU
B
253
69.199
24.559
245.739
1.00
70.21
6


ATOM
844
CD2
LEU
B
253
70.667
24.610
243.715
1.00
71.43
6


ATOM
845
C
LEU
B
253
69.435
22.076
241.748
1.00
73.75
6


ATOM
846
O
LEU
B
253
69.037
23.068
241.143
1.00
73.75
8


ATOM
847
N
GLU
B
254
70.343
21.245
241.233
1.00
74.41
7


ATOM
848
CA
GLU
B
254
70.856
21.493
239.886
1.00
75.13
6


ATOM
849
CB
GLU
B
254
72.220
20.839
239.614
1.00
75.29
6


ATOM
850
CG
GLU
B
254
73.358
21.765
240.031
1.00
75.77
6


ATOM
851
CD
GLU
B
254
72.914
23.240
240.063
1.00
76.49
6


ATOM
852
OE1
GLU
B
254
72.725
23.833
238.973
1.00
76.50
8


ATOM
853
OE2
GLU
B
254
72.734
23.792
241.178
1.00
76.16
8


ATOM
854
C
GLU
B
254
69.831
21.299
238.772
1.00
75.31
6


ATOM
855
O
GLU
B
254
69.895
21.981
237.748
1.00
75.32
8


ATOM
856
N
ASP
B
255
68.885
20.383
238.997
1.00
75.53
7


ATOM
857
CA
ASP
B
255
67.747
20.205
238.102
1.00
75.89
6


ATOM
858
CB
ASP
B
255
66.728
19.206
238.669
1.00
76.17
6


ATOM
859
CG
ASP
B
255
67.374
17.947
239.232
1.00
77.38
6


ATOM
860
OD1
ASP
B
255
68.585
17.722
239.014
1.00
78.27
8


ATOM
861
OD2
ASP
B
255
66.657
17.172
239.903
1.00
79.00
8


ATOM
862
C
ASP
B
255
67.093
21.565
237.994
1.00
75.80
6


ATOM
863
O
ASP
B
255
67.115
22.198
236.924
1.00
75.90
8


ATOM
864
N
LEU
B
256
66.548
22.018
239.124
1.00
75.52
7


ATOM
865
CA
LEU
B
256
65.892
23.309
239.211
1.00
75.24
6


ATOM
866
CB
LEU
B
256
65.550
23.650
240.656
1.00
75.14
6


ATOM
867
CG
LEU
B
256
64.603
22.714
241.416
1.00
74.95
6


ATOM
868
CD1
LEU
B
256
64.035
23.460
242.596
1.00
74.46
6


ATOM
869
CD2
LEU
B
256
63.468
22.170
240.559
1.00
74.53
6


ATOM
870
C
LEU
B
256
66.748
24.396
238.599
1.00
75.23
6


ATOM
871
O
LEU
B
256
66.322
25.076
237.681
1.00
75.26
8


ATOM
872
N
ARG
B
257
67.973
24.539
239.061
1.00
75.41
7


ATOM
873
CA
ARG
B
257
68.760
25.623
238.529
1.00
75.72
6


ATOM
874
CB
ARG
B
257
70.006
25.859
239.344
1.00
75.90
6


ATOM
875
CG
ARG
B
257
69.671
26.588
240.622
1.00
76.28
6


ATOM
876
CD
ARG
B
257
69.917
28.087
240.509
1.00
76.40
6


ATOM
877
NE
ARG
B
257
69.597
28.787
241.757
1.00
77.53
7


ATOM
878
CZ
ARG
B
257
70.125
28.525
242.960
1.00
78.51
6


ATOM
879
NH1
ARG
B
257
71.016
27.554
243.140
1.00
78.70
7


ATOM
880
NH2
ARG
B
257
69.748
29.240
244.009
1.00
79.07
7


ATOM
881
C
ARG
B
257
69.018
25.546
237.035
1.00
75.87
6


ATOM
882
O
ARG
B
257
68.981
26.580
236.387
1.00
75.77
8


ATOM
883
N
GLN
B
258
69.226
24.341
236.491
1.00
76.21
7


ATOM
884
CA
GLN
B
258
69.279
24.149
235.032
1.00
76.55
6


ATOM
885
CB
GLN
B
258
69.742
22.740
234.622
1.00
76.74
6


ATOM
886
CG
GLN
B
258
71.192
22.662
234.152
1.00
77.32
6


ATOM
887
CD
GLN
B
258
72.182
23.127
235.215
1.00
78.99
6


ATOM
888
OE1
GLN
B
258
72.866
22.313
235.844
1.00
79.45
8


ATOM
889
NE2
GLN
B
258
72.256
24.441
235.426
1.00
79.31
7


ATOM
890
C
GLN
B
258
67.951
24.481
234.399
1.00
76.49
6


ATOM
891
O
GLN
B
258
67.871
25.437
233.641
1.00
76.75
8


ATOM
892
N
GLN
B
259
66.900
23.733
234.710
1.00
76.38
7


ATOM
893
CA
GLN
B
259
65.661
24.019
234.013
1.00
76.80
6


ATOM
894
CB
GLN
B
259
64.502
23.099
234.358
1.00
76.80
6


ATOM
895
CG
GLN
B
259
64.603
22.387
235.643
1.00
77.49
6


ATOM
896
CD
GLN
B
259
64.144
20.963
235.496
1.00
78.50
6


ATOM
897
OE1
GLN
B
259
63.675
20.564
234.430
1.00
78.56
8


ATOM
898
NE2
GLN
B
259
64.283
20.178
236.558
1.00
79.70
7


ATOM
899
C
GLN
B
259
65.270
25.483
234.073
1.00
77.10
6


ATOM
900
O
GLN
B
259
64.696
25.989
233.107
1.00
77.35
8


ATOM
901
N
LEU
B
260
65.617
26.169
235.165
1.00
77.36
7


ATOM
902
CA
LEU
B
260
65.368
27.606
235.256
1.00
77.65
6


ATOM
903
CB
LEU
B
260
65.623
28.148
236.663
1.00
77.58
6


ATOM
904
CG
LEU
B
260
64.777
29.348
237.142
1.00
77.11
6


ATOM
905
CD1
LEU
B
260
65.500
30.693
236.998
1.00
76.64
6


ATOM
906
CD2
LEU
B
260
63.393
29.398
236.498
1.00
75.83
6


ATOM
907
C
LEU
B
260
66.169
28.367
234.201
1.00
78.15
6


ATOM
908
O
LEU
B
260
65.588
29.072
233.384
1.00
78.37
8


ATOM
909
N
GLN
B
261
67.490
28.208
234.197
1.00
78.78
7


ATOM
910
CA
GLN
B
261
68.328
28.800
233.141
1.00
79.49
6


ATOM
911
CB
GLN
B
261
69.804
28.369
233.264
1.00
79.70
6


ATOM
912
CG
GLN
B
261
70.799
29.512
233.481
1.00
80.39
6


ATOM
913
CD
GLN
B
261
70.504
30.712
232.595
1.00
82.13
6


ATOM
914
OE1
GLN
B
261
70.458
30.602
231.365
1.00
82.63
8


ATOM
915
NE2
GLN
B
261
70.285
31.865
233.219
1.00
82.64
7


ATOM
916
C
GLN
B
261
67.825
28.469
231.733
1.00
79.64
6


ATOM
917
O
GLN
B
261
67.853
29.316
230.841
1.00
79.71
8


ATOM
918
N
GLN
B
262
67.376
27.231
231.552
1.00
79.89
7


ATOM
919
CA
GLN
B
262
66.880
26.748
230.275
1.00
80.36
6


ATOM
920
CB
GLN
B
262
66.504
25.279
230.382
1.00
80.40
6


ATOM
921
CG
GLN
B
262
67.649
24.319
230.179
1.00
81.23
6


ATOM
922
CD
GLN
B
262
67.227
23.099
229.385
1.00
82.18
6


ATOM
923
OE1
GLN
B
262
68.003
22.575
228.582
1.00
83.19
8


ATOM
924
NE2
GLN
B
262
65.985
22.653
229.584
1.00
82.04
7


ATOM
925
C
GLN
B
262
65.649
27.493
229.841
1.00
80.42
6


ATOM
926
O
GLN
B
262
65.508
27.861
228.680
1.00
80.53
8


ATOM
927
N
ALA
B
263
64.739
27.693
230.779
1.00
80.58
7


ATOM
928
CA
ALA
B
263
63.495
28.343
230.452
1.00
80.73
6


ATOM
929
CB
ALA
B
263
62.431
28.013
231.473
1.00
80.83
6


ATOM
930
C
ALA
B
263
63.668
29.853
230.256
1.00
80.96
6


ATOM
931
O
ALA
B
263
63.103
30.401
229.309
1.00
81.15
8


ATOM
932
N
GLU
B
264
64.458
30.519
231.104
1.00
81.16
7


ATOM
933
CA
GLU
B
264
64.738
31.950
230.905
1.00
81.56
6


ATOM
934
CB
GLU
B
264
65.651
32.499
231.988
1.00
81.50
6


ATOM
935
CG
GLU
B
264
64.907
32.850
233.240
1.00
82.27
6


ATOM
936
CD
GLU
B
264
65.844
33.157
234.373
1.00
84.36
6


ATOM
937
OE1
GLU
B
264
65.624
34.178
235.058
1.00
85.59
8


ATOM
938
OE2
GLU
B
264
66.815
32.387
234.574
1.00
85.60
8


ATOM
939
C
GLU
B
264
65.318
32.214
229.518
1.00
81.55
6


ATOM
940
O
GLU
B
264
64.982
33.214
228.873
1.00
81.73
8


ATOM
941
N
GLU
B
265
66.164
31.286
229.072
1.00
81.47
7


ATOM
942
CA
GLU
B
265
66.745
31.253
227.733
1.00
81.30
6


ATOM
943
CB
GLU
B
265
67.619
30.008
227.641
1.00
81.19
6


ATOM
944
CG
GLU
B
265
68.933
30.177
226.937
1.00
81.44
6


ATOM
945
CD
GLU
B
265
69.964
29.190
227.446
1.00
81.63
6


ATOM
946
OE1
GLU
B
265
70.951
28.923
226.724
1.00
81.94
8


ATOM
947
OE2
GLU
B
265
69.784
28.684
228.576
1.00
81.79
8


ATOM
948
C
GLU
B
265
65.672
31.172
226.645
1.00
81.05
6


ATOM
949
O
GLU
B
265
65.693
31.936
225.677
1.00
81.10
8


ATOM
950
N
ALA
B
266
64.740
30.236
226.798
1.00
80.59
7


ATOM
951
CA
ALA
B
266
63.670
30.107
225.827
1.00
80.10
6


ATOM
952
CB
ALA
B
266
62.871
28.856
226.047
1.00
79.83
6


ATOM
953
C
ALA
B
266
62.791
31.346
225.858
1.00
79.95
6


ATOM
954
O
ALA
B
266
62.359
31.820
224.822
1.00
80.15
8


ATOM
955
N
LEU
B
267
62.559
31.905
227.034
1.00
79.65
7


ATOM
956
CA
LEU
B
267
61.769
33.104
227.096
1.00
79.38
6


ATOM
957
CB
LEU
B
267
61.604
33.567
228.531
1.00
79.27
6


ATOM
958
CG
LEU
B
267
60.693
32.580
229.237
1.00
78.77
6


ATOM
959
CD1
LEU
B
267
60.468
33.027
230.675
1.00
79.02
6


ATOM
960
CD2
LEU
B
267
59.390
32.454
228.464
1.00
78.39
6


ATOM
961
C
LEU
B
267
62.334
34.186
226.176
1.00
79.46
6


ATOM
962
O
LEU
B
267
61.573
34.756
225.387
1.00
79.66
8


ATOM
963
N
VAL
B
268
63.648
34.447
226.234
1.00
79.24
7


ATOM
964
CA
VAL
B
268
64.234
35.479
225.356
1.00
79.03
6


ATOM
965
CB
VAL
B
268
65.708
35.851
225.658
1.00
78.76
6


ATOM
966
CG1
VAL
B
268
65.781
37.162
226.428
1.00
78.41
6


ATOM
967
CG2
VAL
B
268
66.424
34.745
226.376
1.00
78.78
6


ATOM
968
C
VAL
B
268
64.090
35.084
223.897
1.00
79.12
6


ATOM
969
O
VAL
B
268
63.742
35.919
223.060
1.00
79.24
8


ATOM
970
N
ALA
B
269
64.324
33.802
223.609
1.00
79.11
7


ATOM
971
CA
ALA
B
269
64.153
33.250
222.261
1.00
78.86
6


ATOM
972
CB
ALA
B
269
64.496
31.767
222.222
1.00
78.43
6


ATOM
973
C
ALA
B
269
62.756
33.490
221.711
1.00
78.81
6


ATOM
974
O
ALA
B
269
62.607
33.865
220.566
1.00
79.01
8


ATOM
975
N
LYS
B
270
61.725
33.299
222.511
1.00
78.88
7


ATOM
976
CA
LYS
B
270
60.396
33.540
221.978
1.00
79.15
6


ATOM
977
CB
LYS
B
270
59.330
32.685
222.685
1.00
79.22
6


ATOM
978
CG
LYS
B
270
59.526
31.159
222.483
1.00
79.30
6


ATOM
979
CD
LYS
B
270
58.326
30.317
223.017
1.00
79.49
6


ATOM
980
CE
LYS
B
270
58.714
28.872
223.468
1.00
79.40
6


ATOM
981
NZ
LYS
B
270
59.273
27.914
222.441
1.00
78.19
7


ATOM
982
C
LYS
B
270
60.057
35.047
221.841
1.00
79.26
6


ATOM
983
O
LYS
B
270
59.396
35.447
220.881
1.00
79.15
8


ATOM
984
N
GLN
B
271
60.554
35.881
222.751
1.00
79.44
7


ATOM
985
CA
GLN
B
271
60.407
37.320
222.590
1.00
79.74
6


ATOM
986
CB
GLN
B
271
60.929
38.075
223.801
1.00
79.76
6


ATOM
987
CG
GLN
B
271
60.070
39.272
224.114
1.00
80.42
6


ATOM
988
CD
GLN
B
271
58.629
38.865
224.375
1.00
81.53
6


ATOM
989
OE1
GLN
B
271
57.967
38.297
223.507
1.00
81.18
8


ATOM
990
NE2
GLN
B
271
58.140
39.146
225.584
1.00
82.89
7


ATOM
991
C
GLN
B
271
61.069
37.830
221.304
1.00
79.93
6


ATOM
992
O
GLN
B
271
60.507
38.686
220.612
1.00
80.16
8


ATOM
993
N
GLU
B
272
62.248
37.291
220.989
1.00
79.88
7


ATOM
994
CA
GLU
B
272
62.933
37.560
219.725
1.00
79.76
6


ATOM
995
CB
GLU
B
272
64.115
36.603
219.560
1.00
80.02
6


ATOM
996
CG
GLU
B
272
65.454
37.266
219.247
1.00
81.01
6


ATOM
997
CD
GLU
B
272
66.625
36.636
220.020
1.00
82.17
6


ATOM
998
OE1
GLU
B
272
67.732
36.548
219.448
1.00
82.51
8


ATOM
999
OE2
GLU
B
272
66.445
36.236
221.197
1.00
82.24
8


ATOM
1000
C
GLU
B
272
61.952
37.363
218.579
1.00
79.48
6


ATOM
1001
O
GLU
B
272
61.899
38.176
217.663
1.00
79.61
8


ATOM
1002
N
LEU
B
273
61.150
36.303
218.648
1.00
79.03
7


ATOM
1003
CA
LEU
B
273
60.191
36.028
217.588
1.00
78.54
6


ATOM
1004
CB
LEU
B
273
59.879
34.542
217.506
1.00
78.39
6


ATOM
1005
CG
LEU
B
273
59.663
34.064
216.076
1.00
77.93
6


ATOM
1006
CD1
LEU
B
273
60.995
34.032
215.347
1.00
77.93
6


ATOM
1007
CD2
LEU
B
273
59.007
32.695
216.056
1.00
77.26
6


ATOM
1008
C
LEU
B
273
58.914
36.858
217.685
1.00
78.45
6


ATOM
1009
O
LEU
B
273
58.353
37.242
216.676
1.00
78.45
8


ATOM
1010
N
ILE
B
274
58.457
37.139
218.893
1.00
78.25
7


ATOM
1011
CA
ILE
B
274
57.296
37.983
219.032
1.00
78.10
6


ATOM
1012
CB
ILE
B
274
56.803
37.978
220.481
1.00
78.20
6


ATOM
1013
CG1
ILE
B
274
55.898
36.757
220.660
1.00
78.50
6


ATOM
1014
CD
ILE
B
274
56.203
35.913
221.854
1.00
79.00
6


ATOM
1015
CG2
ILE
B
274
56.033
39.244
220.821
1.00
78.17
6


ATOM
1016
C
ILE
B
274
57.560
39.357
218.408
1.00
77.96
6


ATOM
1017
O
ILE
B
274
56.733
39.867
217.651
1.00
78.16
8


ATOM
1018
N
ASP
B
275
58.741
39.905
218.660
1.00
77.63
7


ATOM
1019
CA
ASP
B
275
59.083
41.225
218.169
1.00
77.40
6


ATOM
1020
CB
ASP
B
275
60.301
41.749
218.931
1.00
77.56
6


ATOM
1021
CG
ASP
B
275
60.140
41.624
220.453
1.00
77.80
6


ATOM
1022
OD1
ASP
B
275
58.997
41.709
220.960
1.00
78.11
8


ATOM
1023
OD2
ASP
B
275
61.158
41.427
221.147
1.00
78.09
8


ATOM
1024
C
ASP
B
275
59.287
41.207
216.656
1.00
77.11
6


ATOM
1025
O
ASP
B
275
58.951
42.173
215.970
1.00
77.25
8


ATOM
1026
N
LYS
B
276
59.806
40.096
216.138
1.00
76.72
7


ATOM
1027
CA
LYS
B
276
59.898
39.909
214.688
1.00
76.40
6


ATOM
1028
CB
LYS
B
276
60.563
38.583
214.319
1.00
76.63
6


ATOM
1029
CG
LYS
B
276
62.009
38.691
213.866
1.00
77.43
6


ATOM
1030
CD
LYS
B
276
62.244
39.874
212.939
1.00
77.90
6


ATOM
1031
CE
LYS
B
276
63.724
40.217
212.931
1.00
78.49
6


ATOM
1032
NZ
LYS
B
276
63.939
41.637
213.300
1.00
78.71
7


ATOM
1033
C
LYS
B
276
58.533
39.931
214.055
1.00
75.89
6


ATOM
1034
O
LYS
B
276
58.350
40.504
213.004
1.00
75.94
8


ATOM
1035
N
LEU
B
277
57.573
39.296
214.702
1.00
75.53
7


ATOM
1036
CA
LEU
B
277
56.263
39.160
214.110
1.00
75.08
6


ATOM
1037
CB
LEU
B
277
55.553
37.888
214.587
1.00
75.11
6


ATOM
1038
CG
LEU
B
277
56.172
36.496
214.302
1.00
74.93
6


ATOM
1039
CD1
LEU
B
277
55.064
35.479
213.977
1.00
74.34
6


ATOM
1040
CD2
LEU
B
277
57.226
36.516
213.165
1.00
75.23
6


ATOM
1041
C
LEU
B
277
55.422
40.398
214.340
1.00
74.97
6


ATOM
1042
O
LEU
B
277
54.655
40.780
213.468
1.00
75.06
8


ATOM
1043
N
LYS
B
278
55.567
41.040
215.491
1.00
74.88
7


ATOM
1044
CA
LYS
B
278
54.883
42.299
215.696
1.00
74.81
6


ATOM
1045
CB
LYS
B
278
55.123
42.826
217.112
1.00
74.79
6


ATOM
1046
CG
LYS
B
278
54.331
42.073
218.194
1.00
74.11
6


ATOM
1047
CD
LYS
B
278
54.678
42.573
219.594
1.00
74.15
6


ATOM
1048
CE
LYS
B
278
53.545
42.321
220.592
1.00
73.19
6


ATOM
1049
NZ
LYS
B
278
53.952
42.624
222.008
1.00
71.81
7


ATOM
1050
C
LYS
B
278
55.347
43.256
214.588
1.00
75.31
6


ATOM
1051
O
LYS
B
278
54.527
43.828
213.863
1.00
75.33
8


ATOM
1052
N
GLU
B
279
56.663
43.351
214.415
1.00
75.72
7


ATOM
1053
CA
GLU
B
279
57.269
44.196
213.397
1.00
76.38
6


ATOM
1054
CB
GLU
B
279
58.801
44.155
213.537
1.00
76.50
6


ATOM
1055
CG
GLU
B
279
59.617
44.925
212.472
1.00
77.51
6


ATOM
1056
CD
GLU
B
279
61.117
44.572
212.490
1.00
77.60
6


ATOM
1057
OE1
GLU
B
279
61.511
43.570
213.141
1.00
78.98
8


ATOM
1058
OE2
GLU
B
279
61.904
45.298
211.842
1.00
78.66
8


ATOM
1059
C
GLU
B
279
56.818
43.807
211.986
1.00
76.31
6


ATOM
1060
O
GLU
B
279
56.528
44.681
211.181
1.00
76.62
8


ATOM
1061
N
GLU
B
280
56.756
42.510
211.683
1.00
76.41
7


ATOM
1062
CA
GLU
B
280
56.321
42.069
210.352
1.00
76.31
6


ATOM
1063
CB
GLU
B
280
56.563
40.590
210.126
1.00
75.98
6


ATOM
1064
CG
GLU
B
280
57.955
40.285
209.667
1.00
75.93
6


ATOM
1065
CD
GLU
B
280
58.255
38.813
209.770
1.00
76.92
6


ATOM
1066
OE1
GLU
B
280
57.316
38.006
209.609
1.00
76.87
8


ATOM
1067
OE2
GLU
B
280
59.424
38.455
210.026
1.00
77.78
8


ATOM
1068
C
GLU
B
280
54.864
42.411
210.096
1.00
76.53
6


ATOM
1069
O
GLU
B
280
54.527
42.878
209.014
1.00
76.67
8


ATOM
1070
N
ALA
B
281
54.003
42.207
211.088
1.00
76.73
7


ATOM
1071
CA
ALA
B
281
52.601
42.575
210.936
1.00
76.84
6


ATOM
1072
CB
ALA
B
281
51.768
41.981
212.044
1.00
76.73
6


ATOM
1073
C
ALA
B
281
52.424
44.101
210.831
1.00
76.98
6


ATOM
1074
O
ALA
B
281
51.355
44.592
210.462
1.00
76.99
8


ATOM
1075
N
GLU
B
282
53.484
44.846
211.122
1.00
77.06
7


ATOM
1076
CA
GLU
B
282
53.467
46.276
210.887
1.00
77.26
6


ATOM
1077
CB
GLU
B
282
54.574
46.969
211.676
1.00
77.54
6


ATOM
1078
CG
GLU
B
282
54.186
48.357
212.147
1.00
79.01
6


ATOM
1079
CD
GLU
B
282
52.893
48.366
212.963
1.00
80.49
6


ATOM
1080
OE1
GLU
B
282
51.817
47.994
212.426
1.00
80.60
8


ATOM
1081
OE2
GLU
B
282
52.959
48.760
214.148
1.00
81.06
8


ATOM
1082
C
GLU
B
282
53.525
46.626
209.396
1.00
77.10
6


ATOM
1083
O
GLU
B
282
52.716
47.414
208.916
1.00
77.14
8


ATOM
1084
N
GLN
B
283
54.460
46.020
208.669
1.00
77.00
7


ATOM
1085
CA
GLN
B
283
54.575
46.224
207.221
1.00
76.83
6


ATOM
1086
CB
GLN
B
283
55.939
45.740
206.707
1.00
77.18
6


ATOM
1087
CG
GLN
B
283
57.141
46.193
207.541
1.00
77.46
6


ATOM
1088
CD
GLN
B
283
58.200
45.110
207.662
1.00
77.89
6


ATOM
1089
OE1
GLN
B
283
58.510
44.646
208.761
1.00
78.18
8


ATOM
1090
NE2
GLN
B
283
58.751
44.692
206.529
1.00
78.35
7


ATOM
1091
C
GLN
B
283
53.441
45.536
206.459
1.00
76.27
6


ATOM
1092
O
GLN
B
283
53.219
45.833
205.291
1.00
76.31
8


ATOM
1093
N
HIS
B
284
52.743
44.611
207.118
1.00
75.52
7


ATOM
1094
CA
HIS
B
284
51.561
43.996
206.533
1.00
74.97
6


ATOM
1095
CB
HIS
B
284
51.238
42.670
207.197
1.00
75.10
6


ATOM
1096
CG
HIS
B
284
52.332
41.665
207.079
1.00
75.87
6


ATOM
1097
ND1
HIS
B
284
52.553
40.692
208.031
1.00
77.26
7


ATOM
1098
CE1
HIS
B
284
53.591
39.959
207.670
1.00
76.88
6


ATOM
1099
NE2
HIS
B
284
54.057
40.428
206.525
1.00
76.21
7


ATOM
1100
CD2
HIS
B
284
53.290
41.499
206.138
1.00
75.90
6


ATOM
1101
C
HIS
B
284
50.383
44.928
206.669
1.00
74.37
6


ATOM
1102
O
HIS
B
284
49.545
45.033
205.771
1.00
74.33
8


ATOM
1103
N
LYS
B
285
50.320
45.609
207.803
1.00
73.53
7


ATOM
1104
CA
LYS
B
285
49.268
46.563
208.032
1.00
72.60
6


ATOM
1105
CB
LYS
B
285
49.382
47.149
209.431
1.00
72.89
6


ATOM
1106
CG
LYS
B
285
48.071
47.625
210.011
1.00
73.56
6


ATOM
1107
CD
LYS
B
285
48.311
48.410
211.284
1.00
74.04
6


ATOM
1108
CE
LYS
B
285
47.566
49.718
211.249
1.00
74.02
6


ATOM
1109
NZ
LYS
B
285
48.017
50.586
212.358
1.00
74.91
7


ATOM
1110
C
LYS
B
285
49.367
47.628
206.953
1.00
71.79
6


ATOM
1111
O
LYS
B
285
48.396
47.859
206.231
1.00
71.75
8


ATOM
1112
N
ILE
B
286
50.552
48.217
206.784
1.00
70.70
7


ATOM
1113
CA
ILE
B
286
50.706
49.314
205.818
1.00
69.62
6


ATOM
1114
CB
ILE
B
286
51.924
50.250
206.108
1.00
69.49
6


ATOM
1115
CG1
ILE
B
286
53.165
49.438
206.498
1.00
69.93
6


ATOM
1116
CD
ILE
B
286
54.282
50.219
207.230
1.00
69.79
6


ATOM
1117
CG2
ILE
B
286
51.547
51.270
207.186
1.00
68.93
6


ATOM
1118
C
ILE
B
286
50.524
48.948
204.337
1.00
68.84
6


ATOM
1119
O
ILE
B
286
50.348
49.835
203.520
1.00
68.89
8


ATOM
1120
N
VAL
B
287
50.514
47.661
203.995
1.00
67.87
7


ATOM
1121
CA
VAL
B
287
50.116
47.288
202.641
1.00
66.95
6


ATOM
1122
CB
VAL
B
287
50.887
46.081
202.035
1.00
66.83
6


ATOM
1123
CG1
VAL
B
287
52.354
46.128
202.400
1.00
66.33
6


ATOM
1124
CG2
VAL
B
287
50.273
44.789
202.449
1.00
66.81
6


ATOM
1125
C
VAL
B
287
48.601
47.100
202.570
1.00
66.53
6


ATOM
1126
O
VAL
B
287
47.977
47.437
201.554
1.00
66.63
8


ATOM
1127
N
MET
B
288
48.011
46.588
203.648
1.00
65.60
7


ATOM
1128
CA
MET
B
288
46.571
46.338
203.674
1.00
64.90
6


ATOM
1129
CB
MET
B
288
46.196
45.456
204.852
1.00
65.05
6


ATOM
1130
CG
MET
B
288
46.674
44.021
204.716
1.00
65.48
6


ATOM
1131
SD
MET
B
288
46.458
43.062
206.238
1.00
65.82
16


ATOM
1132
CE
MET
B
288
44.655
42.971
206.344
1.00
65.62
6


ATOM
1133
C
MET
B
288
45.768
47.631
203.700
1.00
63.99
6


ATOM
1134
O
MET
B
288
44.592
47.646
203.336
1.00
63.69
8


ATOM
1135
N
GLU
B
289
46.415
48.714
204.126
1.00
63.04
7


ATOM
1136
CA
GLU
B
289
45.824
50.043
204.022
1.00
62.18
6


ATOM
1137
CB
GLU
B
289
46.610
51.084
204.832
1.00
62.43
6


ATOM
1138
CG
GLU
B
289
47.608
50.519
205.860
1.00
64.75
6


ATOM
1139
CD
GLU
B
289
47.231
50.743
207.351
1.00
68.11
6


ATOM
1140
OE1
GLU
B
289
46.027
50.924
207.645
1.00
69.21
8


ATOM
1141
OE2
GLU
B
289
48.145
50.730
208.234
1.00
68.26
8


ATOM
1142
C
GLU
B
289
45.712
50.506
202.561
1.00
61.05
6


ATOM
1143
O
GLU
B
289
44.855
51.317
202.266
1.00
61.15
8


ATOM
1144
N
THR
B
290
46.552
50.001
201.650
1.00
59.51
7


ATOM
1145
CA
THR
B
290
46.584
50.563
200.299
1.00
58.05
6


ATOM
1146
CB
THR
B
290
47.921
50.363
199.570
1.00
58.19
6


ATOM
1147
OG1
THR
B
290
47.993
49.037
199.033
1.00
58.37
8


ATOM
1148
CG2
THR
B
290
49.080
50.600
200.509
1.00
58.09
6


ATOM
1149
C
THR
B
290
45.477
49.968
199.519
1.00
57.49
6


ATOM
1150
O
THR
B
290
45.314
50.181
198.326
1.00
57.68
8


ATOM
1151
N
VAL
B
291
44.666
49.246
200.219
1.00
56.42
7


ATOM
1152
CA
VAL
B
291
43.718
48.486
199.483
1.00
55.71
6


ATOM
1153
CB
VAL
B
291
43.220
47.261
200.256
1.00
55.56
6


ATOM
1154
CG1
VAL
B
291
41.969
46.707
199.600
1.00
55.43
6


ATOM
1155
CG2
VAL
B
291
44.306
46.204
200.310
1.00
54.82
6


ATOM
1156
C
VAL
B
291
42.552
49.347
199.060
1.00
55.33
6


ATOM
1157
O
VAL
B
291
42.378
49.641
197.868
1.00
55.71
8


ATOM
1158
N
PRO
B
292
41.720
49.732
200.028
1.00
54.73
7


ATOM
1159
CA
PRO
B
292
40.521
50.486
199.688
1.00
54.28
6


ATOM
1160
CB
PRO
B
292
40.145
51.120
201.018
1.00
54.38
6


ATOM
1161
CG
PRO
B
292
40.523
50.044
202.006
1.00
54.24
6


ATOM
1162
CD
PRO
B
292
41.793
49.456
201.477
1.00
54.47
6


ATOM
1163
C
PRO
B
292
40.705
51.534
198.598
1.00
53.72
6


ATOM
1164
O
PRO
B
292
39.911
51.592
197.675
1.00
53.29
8


ATOM
1165
N
VAL
B
293
41.763
52.325
198.702
1.00
53.39
7


ATOM
1166
CA
VAL
B
293
42.062
53.332
197.705
1.00
53.05
6


ATOM
1167
CB
VAL
B
293
43.204
54.276
198.213
1.00
53.33
6


ATOM
1168
CG1
VAL
B
293
44.530
53.502
198.503
1.00
52.63
6


ATOM
1169
CG2
VAL
B
293
43.389
55.463
197.270
1.00
53.56
6


ATOM
1170
C
VAL
B
293
42.303
52.660
196.331
1.00
52.71
6


ATOM
1171
O
VAL
B
293
41.619
52.992
195.346
1.00
52.66
8


ATOM
1172
N
LEU
B
294
43.237
51.704
196.309
1.00
52.03
7


ATOM
1173
CA
LEU
B
294
43.530
50.872
195.166
1.00
51.42
6


ATOM
1174
CB
LEU
B
294
44.341
49.681
195.642
1.00
51.29
6


ATOM
1175
CG
LEU
B
294
45.821
49.605
195.327
1.00
52.20
6


ATOM
1176
CD1
LEU
B
294
45.935
49.186
193.870
1.00
53.41
6


ATOM
1177
CD2
LEU
B
294
46.581
50.926
195.614
1.00
53.79
6


ATOM
1178
C
LEU
B
294
42.259
50.332
194.586
1.00
51.01
6


ATOM
1179
O
LEU
B
294
41.973
50.511
193.399
1.00
51.36
8


ATOM
1180
N
LYS
B
295
41.482
49.668
195.425
1.00
50.27
7


ATOM
1181
CA
LYS
B
295
40.291
49.038
194.916
1.00
49.99
6


ATOM
1182
CB
LYS
B
295
39.535
48.286
195.985
1.00
49.83
6


ATOM
1183
CG
LYS
B
295
38.105
48.030
195.568
1.00
50.37
6


ATOM
1184
CD
LYS
B
295
37.650
46.632
195.890
1.00
52.74
6


ATOM
1185
CE
LYS
B
295
36.141
46.584
195.964
1.00
54.24
6


ATOM
1186
NZ
LYS
B
295
35.659
45.207
195.748
1.00
56.16
7


ATOM
1187
C
LYS
B
295
39.372
50.061
194.284
1.00
49.78
6


ATOM
1188
O
LYS
B
295
38.936
49.903
193.146
1.00
49.60
8


ATOM
1189
N
ALA
B
296
39.088
51.125
195.020
1.00
49.58
7


ATOM
1190
CA
ALA
B
296
38.144
52.104
194.551
1.00
49.02
6


ATOM
1191
CB
ALA
B
296
38.004
53.194
195.520
1.00
48.90
6


ATOM
1192
C
ALA
B
296
38.575
52.629
193.207
1.00
49.00
6


ATOM
1193
O
ALA
B
296
37.763
52.661
192.298
1.00
49.49
8


ATOM
1194
N
GLN
B
297
39.842
53.007
193.065
1.00
48.68
7


ATOM
1195
CA
GLN
B
297
40.349
53.458
191.786
1.00
48.80
6


ATOM
1196
CB
GLN
B
297
41.842
53.558
191.871
1.00
48.95
6


ATOM
1197
CG
GLN
B
297
42.372
54.895
192.225
1.00
50.82
6


ATOM
1198
CD
GLN
B
297
43.883
54.802
192.392
1.00
54.01
6


ATOM
1199
OE1
GLN
B
297
44.632
54.969
191.416
1.00
55.82
8


ATOM
1200
NE2
GLN
B
297
44.344
54.473
193.617
1.00
53.38
7


ATOM
1201
C
GLN
B
297
39.985
52.466
190.672
1.00
48.49
6


ATOM
1202
O
GLN
B
297
39.303
52.829
189.675
1.00
48.61
8


ATOM
1203
N
ALA
B
298
40.432
51.220
190.860
1.00
47.57
7


ATOM
1204
CA
ALA
B
298
40.160
50.143
189.931
1.00
47.03
6


ATOM
1205
CB
ALA
B
298
40.479
48.830
190.580
1.00
46.90
6


ATOM
1206
C
ALA
B
298
38.691
50.192
189.511
1.00
46.81
6


ATOM
1207
O
ALA
B
298
38.340
50.356
188.330
1.00
47.03
8


ATOM
1208
N
ASP
B
299
37.822
50.102
190.495
1.00
46.29
7


ATOM
1209
CA
ASP
B
299
36.419
50.110
190.206
1.00
46.02
6


ATOM
1210
CB
ASP
B
299
35.645
49.877
191.487
1.00
46.83
6


ATOM
1211
CG
ASP
B
299
35.892
48.485
192.037
1.00
48.73
6


ATOM
1212
OD1
ASP
B
299
36.270
47.580
191.228
1.00
49.88
8


ATOM
1213
OD2
ASP
B
299
35.733
48.308
193.269
1.00
51.06
8


ATOM
1214
C
ASP
B
299
35.981
51.349
189.469
1.00
45.12
6


ATOM
1215
O
ASP
B
299
35.308
51.230
188.459
1.00
45.22
8


ATOM
1216
N
ILE
B
300
36.393
52.519
189.937
1.00
44.09
7


ATOM
1217
CA
ILE
B
300
36.060
53.753
189.250
1.00
43.72
6


ATOM
1218
CB
ILE
B
300
36.694
54.977
189.931
1.00
43.59
6


ATOM
1219
CG1
ILE
B
300
35.762
55.546
190.987
1.00
43.28
6


ATOM
1220
CD
ILE
B
300
35.743
54.793
192.284
1.00
44.16
6


ATOM
1221
CG2
ILE
B
300
36.898
56.096
188.944
1.00
43.97
6


ATOM
1222
C
ILE
B
300
36.452
53.704
187.769
1.00
43.60
6


ATOM
1223
O
ILE
B
300
35.635
54.011
186.898
1.00
43.41
8


ATOM
1224
N
TYR
B
301
37.690
53.302
187.489
1.00
43.36
7


ATOM
1225
CA
TYR
B
301
38.197
53.302
186.123
1.00
43.35
6


ATOM
1226
CB
TYR
B
301
39.698
53.006
186.076
1.00
43.80
6


ATOM
1227
CG
TYR
B
301
40.600
54.066
186.707
1.00
45.04
6


ATOM
1228
CD1
TYR
B
301
41.526
53.722
187.671
1.00
44.37
6


ATOM
1229
CE1
TYR
B
301
42.342
54.671
188.251
1.00
44.78
6


ATOM
1230
CZ
TYR
B
301
42.259
55.988
187.870
1.00
45.46
6


ATOM
1231
OH
TYR
B
301
43.093
56.900
188.477
1.00
46.80
8


ATOM
1232
CE2
TYR
B
301
41.357
56.384
186.906
1.00
45.30
6


ATOM
1233
CD2
TYR
B
301
40.531
55.418
186.323
1.00
46.46
6


ATOM
1234
C
TYR
B
301
37.487
52.299
185.261
1.00
43.10
6


ATOM
1235
O
TYR
B
301
37.150
52.590
184.123
1.00
43.59
8


ATOM
1236
N
LYS
B
302
37.275
51.101
185.785
1.00
42.64
7


ATOM
1237
CA
LYS
B
302
36.596
50.097
184.995
1.00
42.03
6


ATOM
1238
CB
LYS
B
302
36.556
48.749
185.701
1.00
41.54
6


ATOM
1239
CG
LYS
B
302
35.605
47.804
185.039
1.00
40.94
6


ATOM
1240
CD
LYS
B
302
35.862
46.391
185.411
1.00
41.71
6


ATOM
1241
CE
LYS
B
302
34.602
45.591
185.233
1.00
42.85
6


ATOM
1242
NZ
LYS
B
302
34.871
44.190
185.536
1.00
44.78
7


ATOM
1243
C
LYS
B
302
35.205
50.639
184.653
1.00
41.79
6


ATOM
1244
O
LYS
B
302
34.814
50.716
183.482
1.00
41.49
8


ATOM
1245
N
ALA
B
303
34.492
51.086
185.673
1.00
41.76
7


ATOM
1246
CA
ALA
B
303
33.197
51.690
185.444
1.00
41.88
6


ATOM
1247
CB
ALA
B
303
32.612
52.285
186.722
1.00
42.11
6


ATOM
1248
C
ALA
B
303
33.301
52.756
184.368
1.00
41.85
6


ATOM
1249
O
ALA
B
303
32.404
52.845
183.540
1.00
42.28
8


ATOM
1250
N
ASP
B
304
34.381
53.548
184.369
1.00
41.58
7


ATOM
1251
CA
ASP
B
304
34.515
54.717
183.460
1.00
41.51
6


ATOM
1252
CB
ASP
B
304
35.850
55.434
183.661
1.00
41.69
6


ATOM
1253
CG
ASP
B
304
35.735
56.697
184.519
1.00
44.65
6


ATOM
1254
OD1
ASP
B
304
36.675
56.953
185.319
1.00
46.81
8


ATOM
1255
OD2
ASP
B
304
34.721
57.442
184.398
1.00
46.76
8


ATOM
1256
C
ASP
B
304
34.550
54.274
182.047
1.00
40.98
6


ATOM
1257
O
ASP
B
304
33.808
54.761
181.177
1.00
41.29
8


ATOM
1258
N
PHE
B
305
35.475
53.358
181.824
1.00
40.21
7


ATOM
1259
CA
PHE
B
305
35.681
52.763
180.538
1.00
39.45
6


ATOM
1260
CB
PHE
B
305
36.807
51.738
180.652
1.00
39.05
6


ATOM
1261
CG
PHE
B
305
36.826
50.753
179.531
1.00
38.86
6


ATOM
1262
CD1
PHE
B
305
37.541
51.019
178.374
1.00
37.47
6


ATOM
1263
CE1
PHE
B
305
37.547
50.140
177.335
1.00
37.04
6


ATOM
1264
CZ
PHE
B
305
36.834
48.971
177.419
1.00
37.67
6


ATOM
1265
CE2
PHE
B
305
36.112
48.686
178.565
1.00
38.35
6


ATOM
1266
CD2
PHE
B
305
36.104
49.573
179.615
1.00
37.84
6


ATOM
1267
C
PHE
B
305
34.378
52.119
180.012
1.00
39.28
6


ATOM
1268
O
PHE
B
305
33.942
52.377
178.881
1.00
38.93
8


ATOM
1269
N
GLN
B
306
33.749
51.288
180.830
1.00
39.04
7


ATOM
1270
CA
GLN
B
306
32.586
50.602
180.332
1.00
39.30
6


ATOM
1271
CB
GLN
B
306
32.007
49.734
181.419
1.00
39.64
6


ATOM
1272
CG
GLN
B
306
32.953
48.649
181.826
1.00
40.83
6


ATOM
1273
CD
GLN
B
306
32.341
47.804
182.885
1.00
44.16
6


ATOM
1274
OE1
GLN
B
306
31.868
46.716
182.597
1.00
46.09
8


ATOM
1275
NE2
GLN
B
306
32.283
48.319
184.126
1.00
46.74
7


ATOM
1276
C
GLN
B
306
31.593
51.624
179.772
1.00
39.03
6


ATOM
1277
O
GLN
B
306
31.066
51.448
178.663
1.00
39.11
8


ATOM
1278
N
ALA
B
307
31.409
52.714
180.521
1.00
38.65
7


ATOM
1279
CA
ALA
B
307
30.575
53.824
180.105
1.00
38.23
6


ATOM
1280
CB
ALA
B
307
30.526
54.875
181.165
1.00
38.13
6


ATOM
1281
C
ALA
B
307
31.070
54.403
178.782
1.00
38.20
6


ATOM
1282
O
ALA
B
307
30.256
54.580
177.860
1.00
38.84
8


ATOM
1283
N
GLU
B
308
32.376
54.673
178.646
1.00
37.47
7


ATOM
1284
CA
GLU
B
308
32.892
55.133
177.324
1.00
36.90
6


ATOM
1285
CB
GLU
B
308
34.398
55.225
177.232
1.00
36.92
6


ATOM
1286
CG
GLU
B
308
35.014
56.446
177.787
1.00
38.12
6


ATOM
1287
CD
GLU
B
308
34.592
57.750
177.130
1.00
38.09
6


ATOM
1288
OE1
GLU
B
308
34.577
57.860
175.870
1.00
35.41
8


ATOM
1289
0E2
GLU
B
308
34.316
58.685
177.936
1.00
38.58
8


ATOM
1290
C
GLU
B
308
32.542
54.195
176.205
1.00
36.58
6


ATOM
1291
O
GLU
B
308
31.975
54.625
175.193
1.00
36.41
8


ATOM
1292
N
ARG
B
309
32.908
52.914
176.364
1.00
36.19
7


ATOM
1293
CA
ARG
B
309
32.663
51.953
175.294
1.00
35.52
6


ATOM
1294
CB
ARG
B
309
33.011
50.537
175.664
1.00
35.26
6


ATOM
1295
CG
ARG
B
309
32.884
49.632
174.477
1.00
33.84
6


ATOM
1296
CD
ARG
B
309
34.054
49.851
173.616
1.00
33.35
6


ATOM
1297
NE
ARG
B
309
34.874
48.658
173.584
1.00
35.40
7


ATOM
1298
CZ
ARG
B
309
36.148
48.627
173.204
1.00
37.19
6


ATOM
1299
NH1
ARG
B
309
36.756
49.742
172.842
1.00
37.42
7


ATOM
1300
NH2
ARG
B
309
36.815
47.473
173.160
1.00
38.83
7


ATOM
1301
C
ARG
B
309
31.211
51.999
174.907
1.00
35.49
6


ATOM
1302
O
ARG
B
309
30.889
52.034
173.713
1.00
35.68
8


ATOM
1303
N
HIS
B
310
30.341
52.034
175.917
1.00
34.98
7


ATOM
1304
CA
HIS
B
310
28.930
52.053
175.655
1.00
34.61
6


ATOM
1305
CB
HIS
B
310
28.140
52.168
176.931
1.00
34.23
6


ATOM
1306
CG
HIS
B
310
26.684
52.125
176.685
1.00
34.16
6


ATOM
1307
ND1
HIS
B
310
25.913
53.261
176.649
1.00
35.32
7


ATOM
1308
CE1
HIS
B
310
24.669
52.930
176.356
1.00
37.05
6


ATOM
1309
NE2
HIS
B
310
24.620
51.624
176.166
1.00
36.92
7


ATOM
1310
CD2
HIS
B
310
25.874
51.099
176.350
1.00
34.67
6


ATOM
1311
C
HIS
B
310
28.580
53.189
174.684
1.00
34.48
6


ATOM
1312
O
HIS
B
310
27.908
52.958
173.650
1.00
34.89
8


ATOM
1313
N
ALA
B
311
29.074
54.389
175.004
1.00
33.62
7


ATOM
1314
CA
ALA
B
311
28.875
55.565
174.164
1.00
33.41
6


ATOM
1315
CB
ALA
B
311
29.408
56.807
174.848
1.00
33.21
6


ATOM
1316
C
ALA
B
311
29.565
55.378
172.815
1.00
33.50
6


ATOM
1317
O
ALA
B
311
28.953
55.525
171.729
1.00
33.66
8


ATOM
1318
N
ARG
B
312
30.839
55.037
172.873
1.00
33.26
7


ATOM
1319
CA
ARG
B
312
31.585
54.854
171.647
1.00
33.71
6


ATOM
1320
CB
ARG
B
312
32.993
54.390
171.963
1.00
33.44
6


ATOM
1321
CG
ARG
B
312
33.833
54.153
170.745
1.00
32.77
6


ATOM
1322
CD
ARG
B
312
33.962
52.689
170.479
1.00
32.61
6


ATOM
1323
NE
ARG
B
312
34.778
52.445
169.300
1.00
32.74
7


ATOM
1324
CZ
ARG
B
312
36.073
52.167
169.316
1.00
31.55
6


ATOM
1325
NH1
ARG
B
312
36.719
52.083
170.459
1.00
31.53
7


ATOM
1326
NH2
ARG
B
312
36.716
51.973
168.178
1.00
31.34
7


ATOM
1327
C
ARG
B
312
30.907
53.921
170.614
1.00
34.20
6


ATOM
1328
O
ARG
B
312
31.039
54.102
169.409
1.00
33.66
8


ATOM
1329
N
GLU
B
313
30.183
52.916
171.086
1.00
34.91
7


ATOM
1330
CA
GLU
B
313
29.522
52.024
170.167
1.00
35.75
6


ATOM
1331
CB
GLU
B
313
29.069
50.765
170.876
1.00
35.96
6


ATOM
1332
CG
GLU
B
313
30.234
49.829
171.117
1.00
38.97
6


ATOM
1333
CD
GLU
B
313
29.882
48.623
171.969
1.00
44.28
6


ATOM
1334
OE1
GLU
B
313
29.174
48.774
172.998
1.00
46.98
8


ATOM
1335
OE2
GLU
B
313
30.343
47.517
171.624
1.00
46.65
8


ATOM
1336
C
GLU
B
313
28.395
52.769
169.502
1.00
35.56
6


ATOM
1337
O
GLU
B
313
28.391
52.887
168.284
1.00
35.47
8


ATOM
1338
N
LYS
B
314
27.502
53.340
170.316
1.00
35.58
7


ATOM
1339
CA
LYS
B
314
26.308
54.053
169.837
1.00
35.41
6


ATOM
1340
CB
LYS
B
314
25.598
54.744
170.998
1.00
35.01
6


ATOM
1341
CG
LYS
B
314
25.139
53.788
172.054
1.00
35.61
6


ATOM
1342
CD
LYS
B
314
24.429
54.484
173.194
1.00
36.90
6


ATOM
1343
CE
LYS
B
314
23.197
53.692
173.623
1.00
36.65
6


ATOM
1344
NZ
LYS
B
314
22.228
53.599
172.482
1.00
38.02
7


ATOM
1345
C
LYS
B
314
26.708
55.067
168.782
1.00
35.55
6


ATOM
1346
O
LYS
B
314
26.005
55.253
167.782
1.00
35.05
8


ATOM
1347
N
LEU
B
315
27.863
55.701
169.031
1.00
35.90
7


ATOM
1348
CA
LEU
B
315
28.502
56.619
168.091
1.00
36.06
6


ATOM
1349
CB
LEU
B
315
29.733
57.273
168.712
1.00
35.55
6


ATOM
1350
CG
LEU
B
315
29.467
58.481
169.617
1.00
36.63
6


ATOM
1351
CD1
LEU
B
315
30.711
58.935
170.328
1.00
38.75
6


ATOM
1352
CD2
LEU
B
315
28.946
59.657
168.848
1.00
37.41
6


ATOM
1353
C
LEU
B
315
28.891
55.897
166.814
1.00
36.36
6


ATOM
1354
O
LEU
B
315
28.367
56.195
165.740
1.00
36.68
8


ATOM
1355
N
VAL
B
316
29.778
54.917
166.926
1.00
36.57
7


ATOM
1356
CA
VAL
B
316
30.230
54.213
165.745
1.00
36.73
6


ATOM
1357
CB
VAL
B
316
30.966
52.955
166.109
1.00
36.55
6


ATOM
1358
CG1
VAL
B
316
30.926
51.962
164.967
1.00
36.31
6


ATOM
1359
CG2
VAL
B
316
32.380
53.315
166.424
1.00
37.11
6


ATOM
1360
C
VAL
B
316
29.029
53.896
164.898
1.00
37.24
6


ATOM
1361
O
VAL
B
316
29.011
54.104
163.699
1.00
37.65
8


ATOM
1362
N
GLU
B
317
27.998
53.440
165.563
1.00
38.10
7


ATOM
1363
CA
GLU
B
317
26.768
53.058
164.935
1.00
39.28
6


ATOM
1364
CB
GLU
B
317
25.879
52.501
166.052
1.00
40.02
6


ATOM
1365
CG
GLU
B
317
24.424
52.724
165.968
1.00
43.02
6


ATOM
1366
CD
GLU
B
317
23.772
51.699
165.094
1.00
47.74
6


ATOM
1367
OE1
GLU
B
317
23.839
51.855
163.833
1.00
48.28
8


ATOM
1368
OE2
GLU
B
317
23.190
50.745
165.686
1.00
49.58
8


ATOM
1369
C
GLU
B
317
26.175
54.263
164.210
1.00
39.25
6


ATOM
1370
O
GLU
B
317
25.852
54.185
163.039
1.00
39.21
8


ATOM
1371
N
LYS
B
318
26.073
55.392
164.895
1.00
39.68
7


ATOM
1372
CA
LYS
B
318
25.515
56.578
164.276
1.00
39.94
6


ATOM
1373
CB
LYS
B
318
25.435
57.738
165.264
1.00
39.65
6


ATOM
1374
CG
LYS
B
318
24.500
58.824
164.817
1.00
37.85
6


ATOM
1375
CD
LYS
B
318
23.204
58.230
164.265
1.00
37.22
6


ATOM
1376
CE
LYS
B
318
22.189
57.915
165.345
1.00
36.18
6


ATOM
1377
NZ
LYS
B
318
20.828
57.948
164.797
1.00
34.71
7


ATOM
1378
C
LYS
B
318
26.353
56.988
163.084
1.00
40.75
6


ATOM
1379
O
LYS
B
318
25.801
57.388
162.052
1.00
41.41
8


ATOM
1380
N
LYS
B
319
27.676
56.901
163.219
1.00
40.96
7


ATOM
1381
CA
LYS
B
319
28.539
57.290
162.119
1.00
41.60
6


ATOM
1382
CB
LYS
B
319
30.021
57.099
162.449
1.00
41.63
6


ATOM
1383
CG
LYS
B
319
30.963
57.401
161.257
1.00
43.27
6


ATOM
1384
CD
LYS
B
319
32.170
56.481
161.236
1.00
45.22
6


ATOM
1385
CE
LYS
B
319
31.757
54.999
161.468
1.00
48.29
6


ATOM
1386
NZ
LYS
B
319
32.876
53.968
161.456
1.00
47.72
7


ATOM
1387
C
LYS
B
319
28.155
56.493
160.875
1.00
41.79
6


ATOM
1388
O
LYS
B
319
27.875
57.075
159.825
1.00
41.47
8


ATOM
1389
N
GLU
B
320
28.125
55.170
161.014
1.00
42.08
7


ATOM
1390
CA
GLU
B
320
27.737
54.291
159.933
1.00
43.06
6


ATOM
1391
CB
GLU
B
320
27.365
52.929
160.478
1.00
43.77
6


ATOM
1392
CG
GLU
B
320
28.104
51.755
159.898
1.00
46.62
6


ATOM
1393
CD
GLU
B
320
29.072
51.175
160.914
1.00
49.77
6


ATOM
1394
OE1
GLU
B
320
28.739
50.121
161.520
1.00
50.16
8


ATOM
1395
OE2
GLU
B
320
30.142
51.803
161.122
1.00
50.83
8


ATOM
1396
C
GLU
B
320
26.493
54.846
159.286
1.00
43.02
6


ATOM
1397
O
GLU
B
320
26.498
55.150
158.093
1.00
43.25
8


ATOM
1398
N
TYR
B
321
25.433
54.974
160.094
1.00
42.82
7


ATOM
1399
CA
TYR
B
321
24.137
55.488
159.661
1.00
42.60
6


ATOM
1400
CB
TYR
B
321
23.237
55.840
160.865
1.00
42.18
6


ATOM
1401
CG
TYR
B
321
21.916
56.473
160.451
1.00
41.79
6


ATOM
1402
CD1
TYR
B
321
20.853
55.683
160.002
1.00
41.67
6


ATOM
1403
CE1
TYR
B
321
19.657
56.244
159.588
1.00
40.71
6


ATOM
1404
CZ
TYR
B
321
19.510
57.608
159.620
1.00
40.89
6


ATOM
1405
OH
TYR
B
321
18.328
58.152
159.211
1.00
41.16
8


ATOM
1406
CE2
TYR
B
321
20.535
58.425
160.063
1.00
41.25
6


ATOM
1407
CD2
TYR
B
321
21.739
57.854
160.472
1.00
41.59
6


ATOM
1408
C
TYR
B
321
24.294
56.714
158.776
1.00
42.94
6


ATOM
1409
O
TYR
B
321
23.783
56.758
157.663
1.00
43.06
8


ATOM
1410
N
LEU
B
322
25.001
57.714
159.274
1.00
43.24
7


ATOM
1411
CA
LEU
B
322
25.145
58.939
158.529
1.00
43.79
6


ATOM
1412
CB
LEU
B
322
25.827
60.003
159.383
1.00
43.47
6


ATOM
1413
CG
LEU
B
322
25.009
60.537
160.555
1.00
42.53
6


ATOM
1414
CD1
LEU
B
322
25.768
61.620
161.279
1.00
42.81
6


ATOM
1415
CD2
LEU
B
322
23.693
61.086
160.081
1.00
40.92
6


ATOM
1416
C
LEU
B
322
25.875
58.728
157.202
1.00
44.86
6


ATOM
1417
O
LEU
B
322
25.481
59.307
156.194
1.00
44.52
8


ATOM
1418
N
GLN
B
323
26.926
57.892
157.205
1.00
46.48
7


ATOM
1419
CA
GLN
B
323
27.697
57.580
155.979
1.00
47.79
6


ATOM
1420
CB
GLN
B
323
28.802
56.528
156.221
1.00
47.19
6


ATOM
1421
CG
GLN
B
323
30.225
57.111
156.362
1.00
48.44
6


ATOM
1422
CD
GLN
B
323
31.124
56.369
157.418
1.00
49.39
6


ATOM
1423
OE1
GLN
B
323
30.678
55.439
158.104
1.00
51.03
8


ATOM
1424
NE2
GLN
B
323
32.393
56.801
157.537
1.00
50.41
7


ATOM
1425
C
GLN
B
323
26.705
57.119
154.926
1.00
48.27
6


ATOM
1426
O
GLN
B
323
26.694
57.634
153.813
1.00
48.13
8


ATOM
1427
N
GLU
B
324
25.836
56.191
155.315
1.00
49.48
7


ATOM
1428
CA
GLU
B
324
24.833
55.651
154.421
1.00
51.23
6


ATOM
1429
CB
GLU
B
324
24.071
54.495
155.085
1.00
51.47
6


ATOM
1430
CG
GLU
B
324
24.853
53.157
155.036
1.00
55.79
6


ATOM
1431
CD
GLU
B
324
24.664
52.230
156.281
1.00
61.40
6


ATOM
1432
OE1
GLU
B
324
23.517
51.783
156.517
1.00
63.47
8


ATOM
1433
OE2
GLU
B
324
25.662
51.916
157.008
1.00
63.09
8


ATOM
1434
C
GLU
B
324
23.915
56.756
153.920
1.00
51.64
6


ATOM
1435
O
GLU
B
324
23.775
56.938
152.725
1.00
51.92
8


ATOM
1436
N
GLN
B
325
23.328
57.532
154.817
1.00
52.64
7


ATOM
1437
CA
GLN
B
325
22.469
58.641
154.385
1.00
53.72
6


ATOM
1438
CB
GLN
B
325
21.969
59.474
155.575
1.00
53.99
6


ATOM
1439
CG
GLN
B
325
21.073
58.723
156.566
1.00
54.63
6


ATOM
1440
CD
GLN
B
325
19.893
58.030
155.898
1.00
55.76
6


ATOM
1441
OE1
GLN
B
325
20.054
56.980
155.270
1.00
56.31
8


ATOM
1442
NE2
GLN
B
325
18.699
58.610
156.037
1.00
56.03
7


ATOM
1443
C
GLN
B
325
23.163
59.535
153.363
1.00
54.30
6


ATOM
1444
O
GLN
B
325
22.559
59.921
152.378
1.00
54.30
8


ATOM
1445
N
LEU
B
326
24.437
59.836
153.596
1.00
55.35
7


ATOM
1446
CA
LEU
B
326
25.209
60.661
152.684
1.00
56.25
6


ATOM
1447
CB
LEU
B
326
26.532
61.085
153.335
1.00
55.97
6


ATOM
1448
CG
LEU
B
326
27.162
62.464
153.081
1.00
55.52
6


ATOM
1449
CD1
LEU
B
326
28.034
62.470
151.815
1.00
56.45
6


ATOM
1450
CD2
LEU
B
326
26.136
63.607
153.065
1.00
54.51
6


ATOM
1451
C
LEU
B
326
25.442
59.945
151.349
1.00
57.39
6


ATOM
1452
O
LEU
B
326
25.482
60.602
150.311
1.00
57.73
8


ATOM
1453
N
GLU
B
327
25.591
58.615
151.368
1.00
58.58
7


ATOM
1454
CA
GLU
B
327
25.681
57.845
150.128
1.00
60.00
6


ATOM
1455
CB
GLU
B
327
25.895
56.361
150.384
1.00
60.00
6


ATOM
1456
CG
GLU
B
327
27.175
55.802
149.812
1.00
61.00
6


ATOM
1457
CD
GLU
B
327
28.338
55.861
150.796
1.00
62.50
6


ATOM
1458
OE1
GLU
B
327
28.151
55.517
151.986
1.00
62.43
8


ATOM
1459
OE2
GLU
B
327
29.454
56.235
150.369
1.00
63.52
8


ATOM
1460
C
GLU
B
327
24.409
58.020
149.333
1.00
61.06
6


ATOM
1461
O
GLU
B
327
24.414
58.680
148.303
1.00
61.52
8


ATOM
1462
N
GLN
B
328
23.315
57.444
149.822
1.00
62.40
7


ATOM
1463
CA
GLN
B
328
21.985
57.593
149.206
1.00
64.02
6


ATOM
1464
CB
GLN
B
328
20.867
57.357
150.218
1.00
63.91
6


ATOM
1465
CG
GLN
B
328
21.114
56.248
151.184
1.00
66.20
6


ATOM
1466
CD
GLN
B
328
20.677
54.907
150.664
1.00
68.96
6


ATOM
1467
OE1
GLN
B
328
19.941
54.187
151.341
1.00
70.32
8


ATOM
1468
NE2
GLN
B
328
21.124
54.551
149.458
1.00
70.02
7


ATOM
1469
C
GLN
B
328
21.719
58.972
148.641
1.00
64.74
6


ATOM
1470
O
GLN
B
328
21.246
59.118
147.522
1.00
64.97
8


ATOM
1471
N
LEU
B
329
21.984
59.994
149.434
1.00
65.70
7


ATOM
1472
CA
LEU
B
329
21.604
61.304
149.014
1.00
66.60
6


ATOM
1473
CB
LEU
B
329
21.557
62.268
150.171
1.00
66.23
6


ATOM
1474
CG
LEU
B
329
20.183
62.885
150.362
1.00
65.38
6


ATOM
1475
CD1
LEU
B
329
20.363
64.258
150.964
1.00
65.09
6


ATOM
1476
CD2
LEU
B
329
19.409
62.954
149.059
1.00
64.54
6


ATOM
1477
C
LEU
B
329
22.526
61.804
147.940
1.00
67.86
6


ATOM
1478
O
LEU
B
329
22.055
62.411
146.998
1.00
68.16
8


ATOM
1479
N
GLN
B
330
23.826
61.538
148.048
1.00
69.76
7


ATOM
1480
CA
GLN
B
330
24.759
61.993
147.000
1.00
71.11
6


ATOM
1481
CB
GLN
B
330
26.235
61.977
147.457
1.00
71.23
6


ATOM
1482
CG
GLN
B
330
27.277
62.386
146.364
1.00
71.34
6


ATOM
1483
CD
GLN
B
330
27.436
63.910
146.110
1.00
72.70
6


ATOM
1484
OE1
GLN
B
330
26.486
64.694
146.202
1.00
72.75
8


ATOM
1485
NE2
GLN
B
330
28.657
64.311
145.758
1.00
72.57
7


ATOM
1486
C
GLN
B
330
24.529
61.234
145.688
1.00
72.02
6


ATOM
1487
O
GLN
B
330
24.907
61.710
144.618
1.00
72.08
8


ATOM
1488
N
ARG
B
331
23.877
60.075
145.796
1.00
73.20
7


ATOM
1489
CA
ARG
B
331
23.396
59.278
144.664
1.00
74.46
6


ATOM
1490
CB
ARG
B
331
22.900
57.933
145.202
1.00
74.10
6


ATOM
1491
CG
ARG
B
331
22.662
56.817
144.190
1.00
73.35
6


ATOM
1492
CD
ARG
B
331
23.767
55.737
144.203
1.00
71.89
6


ATOM
1493
NE
ARG
B
331
24.413
55.522
145.512
1.00
70.93
7


ATOM
1494
CZ
ARG
B
331
23.920
54.808
146.534
1.00
70.02
6


ATOM
1495
NH1
ARG
B
331
22.732
54.214
146.450
1.00
69.16
7


ATOM
1496
NH2
ARG
B
331
24.627
54.694
147.661
1.00
69.42
7


ATOM
1497
C
ARG
B
331
22.234
59.979
143.952
1.00
75.75
6


ATOM
1498
O
ARG
B
331
22.019
59.796
142.751
1.00
75.92
8


ATOM
1499
N
GLU
B
332
21.480
60.768
144.710
1.00
77.22
7


ATOM
1500
CA
GLU
B
332
20.285
61.423
144.196
1.00
78.93
6


ATOM
1501
CB
GLU
B
332
19.255
61.603
145.307
1.00
78.98
6


ATOM
1502
CG
GLU
B
332
17.982
60.814
145.106
1.00
79.82
6


ATOM
1503
CD
GLU
B
332
18.197
59.315
145.070
1.00
81.26
6


ATOM
1504
OE1
GLU
B
332
19.313
58.863
144.735
1.00
82.51
8


ATOM
1505
OE2
GLU
B
332
17.238
58.578
145.374
1.00
81.73
8


ATOM
1506
C
GLU
B
332
20.572
62.750
143.537
1.00
79.91
6


ATOM
1507
O
GLU
B
332
20.049
63.048
142.467
1.00
80.09
8


ATOM
1508
N
PHE
B
333
21.394
63.552
144.192
1.00
81.19
7


ATOM
1509
CA
PHE
B
333
21.881
64.787
143.616
1.00
82.52
6


ATOM
1510
CB
PHE
B
333
22.660
65.545
144.693
1.00
82.67
6


ATOM
1511
CG
PHE
B
333
22.895
66.997
144.395
1.00
82.82
6


ATOM
1512
CD1
PHE
B
333
21.834
67.895
144.333
1.00
83.07
6


ATOM
1513
CE1
PHE
B
333
22.063
69.251
144.063
1.00
83.67
6


ATOM
1514
CZ
PHE
B
333
23.374
69.720
143.879
1.00
83.48
6


ATOM
1515
CE2
PHE
B
333
24.447
68.831
143.971
1.00
83.81
6


ATOM
1516
CD2
PHE
B
333
24.199
67.477
144.233
1.00
83.48
6


ATOM
1517
C
PHE
B
333
22.742
64.461
142.373
1.00
83.46
6


ATOM
1518
O
PHE
B
333
23.175
65.362
141.652
1.00
83.74
8


ATOM
1519
N
ASN
B
334
22.943
63.161
142.123
1.00
84.37
7


ATOM
1520
CA
ASN
B
334
23.702
62.630
140.982
1.00
85.16
6


ATOM
1521
CB
ASN
B
334
24.441
61.368
141.419
1.00
84.80
6


ATOM
1522
CG
ASN
B
334
25.913
61.583
141.580
1.00
84.10
6


ATOM
1523
OD1
ASN
B
334
26.356
62.574
142.157
1.00
83.22
8


ATOM
1524
ND2
ASN
B
334
26.693
60.648
141.066
1.00
83.61
7


ATOM
1525
C
ASN
B
334
22.847
62.236
139.784
1.00
86.03
6


ATOM
1526
O
ASN
B
334
23.217
62.462
138.628
1.00
86.13
8


ATOM
1527
N
LYS
B
335
21.724
61.592
140.079
1.00
87.20
7


ATOM
1528
CA
LYS
B
335
20.778
61.156
139.059
1.00
88.31
6


ATOM
1529
CB
LYS
B
335
19.863
60.053
139.602
1.00
88.28
6


ATOM
1530
CG
LYS
B
335
20.587
58.736
139.795
1.00
88.75
6


ATOM
1531
CD
LYS
B
335
19.748
57.698
140.506
1.00
88.96
6


ATOM
1532
CE
LYS
B
335
20.604
56.470
140.773
1.00
89.05
6


ATOM
1533
NZ
LYS
B
335
19.804
55.314
141.231
1.00
89.30
7


ATOM
1534
C
LYS
B
335
19.951
62.334
138.596
1.00
88.96
6


ATOM
1535
O
LYS
B
335
19.738
62.522
137.400
1.00
89.13
8


ATOM
1536
N
LEU
B
336
19.494
63.132
139.553
1.00
89.86
7


ATOM
1537
CA
LEU
B
336
18.760
64.355
139.241
1.00
90.67
6


ATOM
1538
CB
LEU
B
336
17.674
64.642
140.290
1.00
90.69
6


ATOM
1539
CG
LEU
B
336
16.579
63.599
140.557
1.00
90.76
6


ATOM
1540
CD1
LEU
B
336
17.083
62.455
141.459
1.00
90.39
6


ATOM
1541
CD2
LEU
B
336
15.329
64.258
141.157
1.00
90.48
6


ATOM
1542
C
LEU
B
336
19.731
65.539
139.093
1.00
91.31
6


ATOM
1543
O
LEU
B
336
19.348
66.702
139.314
1.00
91.36
8


ATOM
1544
N
LYS
B
337
20.976
65.211
138.710
1.00
91.90
7


ATOM
1545
CA
LYS
B
337
22.073
66.165
138.429
1.00
92.33
6


ATOM
1546
CB
LYS
B
337
23.207
65.473
137.638
1.00
92.29
6


ATOM
1547
CG
LYS
B
337
24.150
66.407
136.861
1.00
91.99
6


ATOM
1548
CD
LYS
B
337
25.549
65.828
136.753
1.00
91.67
6


ATOM
1549
CE
LYS
B
337
26.487
66.799
136.059
1.00
91.01
6


ATOM
1550
NZ
LYS
B
337
27.893
66.364
136.238
1.00
90.54
7


ATOM
1551
C
LYS
B
337
21.618
67.421
137.693
1.00
92.66
6


ATOM
1552
O
LYS
B
337
20.773
67.391
136.792
1.00
92.93
8


ATOM
1553
OXT
LYS
B
337
22.071
68.516
138.044
1.00
92.86
8


ATOM
1554
N
SER
C
12
−1.952
44.539
167.423
1.00
71.74
7


ATOM
1555
CA
SER
C
12
−0.990
44.950
168.497
1.00
71.74
6


ATOM
1556
CB
SER
C
12
−1.061
44.018
169.724
1.00
71.76
6


ATOM
1557
OG
SER
C
12
−1.010
42.643
169.376
1.00
71.83
8


ATOM
1558
C
SER
C
12
0.451
45.129
167.996
1.00
71.46
6


ATOM
1559
O
SER
C
12
1.281
45.739
168.676
1.00
71.38
8


ATOM
1560
N
ASP
C
13
0.744
44.617
166.802
1.00
70.95
7


ATOM
1561
CA
ASP
C
13
2.040
44.881
166.179
1.00
70.31
6


ATOM
1562
CB
ASP
C
13
2.528
43.701
165.325
1.00
70.52
6


ATOM
1563
CG
ASP
C
13
2.379
43.951
163.829
1.00
71.36
6


ATOM
1564
OD1
ASP
C
13
3.405
44.260
163.173
1.00
72.42
8


ATOM
1565
OD2
ASP
C
13
1.242
43.854
163.316
1.00
71.46
8


ATOM
1566
C
ASP
C
13
1.993
46.220
165.411
1.00
69.34
6


ATOM
1567
O
ASP
C
13
2.891
46.555
164.630
1.00
69.13
8


ATOM
1568
N
LEU
C
14
0.937
46.992
165.655
1.00
67.97
7


ATOM
1569
CA
LEU
C
14
0.971
48.400
165.329
1.00
66.48
6


ATOM
1570
CB
LEU
C
14
−0.312
49.109
165.753
1.00
66.48
6


ATOM
1571
CG
LEU
C
14
−1.547
48.779
164.907
1.00
66.37
6


ATOM
1572
CD1
LEU
C
14
−2.667
49.803
165.128
1.00
66.16
6


ATOM
1573
CD2
LEU
C
14
−1.188
48.672
163.425
1.00
65.71
6


ATOM
1574
C
LEU
C
14
2.192
49.005
166.015
1.00
65.59
6


ATOM
1575
O
LEU
C
14
2.867
49.857
165.434
1.00
65.73
8


ATOM
1576
N
GLY
C
15
2.495
48.528
167.228
1.00
64.28
7


ATOM
1577
CA
GLY
C
15
3.707
48.922
167.961
1.00
62.51
6


ATOM
1578
C
GLY
C
15
5.000
48.830
167.164
1.00
61.28
6


ATOM
1579
O
GLY
C
15
5.773
49.790
167.092
1.00
61.06
8


ATOM
1580
N
LYS
C
16
5.218
47.667
166.556
1.00
60.20
7


ATOM
1581
CA
LYS
C
16
6.383
47.391
165.704
1.00
58.94
6


ATOM
1582
CB
LYS
C
16
6.287
45.951
165.173
1.00
59.00
6


ATOM
1583
CG
LYS
C
16
7.571
45.351
164.641
1.00
58.67
6


ATOM
1584
CD
LYS
C
16
7.319
43.995
164.003
1.00
58.85
6


ATOM
1585
CE
LYS
C
16
8.627
43.253
163.747
1.00
58.98
6


ATOM
1586
NZ
LYS
C
16
8.498
42.206
162.684
1.00
58.97
7


ATOM
1587
C
LYS
C
16
6.487
48.367
164.532
1.00
58.25
6


ATOM
1588
O
LYS
C
16
7.588
48.699
164.087
1.00
57.71
8


ATOM
1589
N
LYS
C
17
5.333
48.809
164.028
1.00
57.78
7


ATOM
1590
CA
LYS
C
17
5.305
49.741
162.893
1.00
57.39
6


ATOM
1591
CB
LYS
C
17
4.036
49.581
162.040
1.00
57.41
6


ATOM
1592
CG
LYS
C
17
3.897
48.204
161.356
1.00
57.84
6


ATOM
1593
CD
LYS
C
17
5.118
47.816
160.502
1.00
58.71
6


ATOM
1594
CE
LYS
C
17
5.162
46.309
160.230
1.00
58.37
6


ATOM
1595
NZ
LYS
C
17
4.216
45.921
159.145
1.00
58.82
7


ATOM
1596
C
LYS
C
17
5.536
51.188
163.326
1.00
56.83
6


ATOM
1597
O
LYS
C
17
6.221
51.951
162.624
1.00
56.52
8


ATOM
1598
N
LEU
C
18
4.989
51.548
164.487
1.00
56.14
7


ATOM
1599
CA
LEU
C
18
5.225
52.861
165.056
1.00
55.66
6


ATOM
1600
CB
LEU
C
18
4.340
53.090
166.279
1.00
55.42
6


ATOM
1601
CG
LEU
C
18
4.553
54.349
167.124
1.00
55.02
6


ATOM
1602
CD1
LEU
C
18
4.482
55.612
166.308
1.00
54.24
6


ATOM
1603
CD2
LEU
C
18
3.530
54.396
168.245
1.00
55.55
6


ATOM
1604
C
LEU
C
18
6.708
53.051
165.374
1.00
55.70
6


ATOM
1605
O
LEU
C
18
7.263
54.126
165.137
1.00
55.84
8


ATOM
1606
N
LEU
C
19
7.355
52.005
165.876
1.00
55.62
7


ATOM
1607
CA
LEU
C
19
8.794
52.071
166.112
1.00
55.90
6


ATOM
1608
CB
LEU
C
19
9.318
50.749
166.673
1.00
55.85
6


ATOM
1609
CG
LEU
C
19
8.833
50.292
168.046
1.00
55.50
6


ATOM
1610
CD1
LEU
C
19
9.421
48.932
168.370
1.00
54.93
6


ATOM
1611
CD2
LEU
C
19
9.190
51.306
169.121
1.00
55.56
6


ATOM
1612
C
LEU
C
19
9.548
52.432
164.832
1.00
56.28
6


ATOM
1613
O
LEU
C
19
10.344
53.369
164.809
1.00
55.98
8


ATOM
1614
N
GLU
C
20
9.257
51.687
163.769
1.00
57.01
7


ATOM
1615
CA
GLU
C
20
9.865
51.875
162.451
1.00
57.78
6


ATOM
1616
CB
GLU
C
20
9.246
50.909
161.444
1.00
58.21
6


ATOM
1617
CG
GLU
C
20
10.291
50.122
160.691
1.00
61.13
6


ATOM
1618
CD
GLU
C
20
10.938
49.067
161.591
1.00
64.71
6


ATOM
1619
OE1
GLU
C
20
10.166
48.359
162.306
1.00
67.07
8


ATOM
1620
OE2
GLU
C
20
12.198
48.961
161.594
1.00
65.04
8


ATOM
1621
C
GLU
C
20
9.654
53.271
161.920
1.00
57.24
6


ATOM
1622
O
GLU
C
20
10.573
53.887
161.387
1.00
57.00
8


ATOM
1623
N
ALA
C
21
8.417
53.742
162.055
1.00
56.95
7


ATOM
1624
CA
ALA
C
21
8.016
55.050
161.577
1.00
56.58
6


ATOM
1625
CB
ALA
C
21
6.532
55.255
161.805
1.00
56.47
6


ATOM
1626
C
ALA
C
21
8.814
56.123
162.286
1.00
56.42
6


ATOM
1627
O
ALA
C
21
9.279
57.072
161.663
1.00
56.26
8


ATOM
1628
N
ALA
C
22
8.982
55.950
163.592
1.00
56.46
7


ATOM
1629
CA
ALA
C
22
9.727
56.895
164.413
1.00
56.50
6


ATOM
1630
CB
ALA
C
22
9.552
56.573
165.871
1.00
56.37
6


ATOM
1631
C
ALA
C
22
11.215
56.959
164.048
1.00
56.64
6


ATOM
1632
O
ALA
C
22
11.783
58.044
163.981
1.00
56.54
8


ATOM
1633
N
ARG
C
23
11.847
55.807
163.818
1.00
56.79
7


ATOM
1634
CA
ARG
C
23
13.231
55.792
163.356
1.00
57.25
6


ATOM
1635
CB
ARG
C
23
13.777
54.367
163.242
1.00
56.85
6


ATOM
1636
CG
ARG
C
23
15.239
54.303
162.751
1.00
58.13
6


ATOM
1637
CD
ARG
C
23
15.775
52.885
162.469
1.00
58.74
6


ATOM
1638
NE
ARG
C
23
15.285
51.911
163.446
1.00
62.17
7


ATOM
1639
CZ
ARG
C
23
14.436
50.919
163.168
1.00
63.14
6


ATOM
1640
NH1
ARG
C
23
13.995
50.731
161.925
1.00
62.45
7


ATOM
1641
NH2
ARG
C
23
14.032
50.101
164.136
1.00
63.69
7


ATOM
1642
C
ARG
C
23
13.326
56.481
161.999
1.00
57.16
6


ATOM
1643
O
ARG
C
23
14.251
57.261
161.752
1.00
57.07
8


ATOM
1644
N
ALA
C
24
12.354
56.198
161.130
1.00
57.36
7


ATOM
1645
CA
ALA
C
24
12.414
56.612
159.727
1.00
57.41
6


ATOM
1646
CB
ALA
C
24
11.484
55.778
158.891
1.00
57.20
6


ATOM
1647
C
ALA
C
24
12.125
58.087
159.520
1.00
57.61
6


ATOM
1648
O
ALA
C
24
12.657
58.694
158.596
1.00
57.82
8


ATOM
1649
N
GLY
C
25
11.294
58.666
160.375
1.00
57.82
7


ATOM
1650
CA
GLY
C
25
10.952
60.070
160.234
1.00
58.27
6


ATOM
1651
C
GLY
C
25
9.623
60.268
159.540
1.00
58.64
6


ATOM
1652
O
GLY
C
25
9.217
61.399
159.285
1.00
58.45
8


ATOM
1653
N
GLN
C
26
8.943
59.162
159.250
1.00
59.21
7


ATOM
1654
CA
GLN
C
26
7.611
59.185
158.649
1.00
60.13
6


ATOM
1655
CB
GLN
C
26
7.119
57.767
158.323
1.00
60.19
6


ATOM
1656
CG
GLN
C
26
8.167
56.748
157.894
1.00
61.44
6


ATOM
1657
CD
GLN
C
26
8.851
57.093
156.578
1.00
63.51
6


ATOM
1658
OE1
GLN
C
26
8.441
58.014
155.864
1.00
64.05
8


ATOM
1659
NE2
GLN
C
26
9.903
56.340
156.244
1.00
64.54
7


ATOM
1660
C
GLN
C
26
6.585
59.845
159.567
1.00
60.63
6


ATOM
1661
O
GLN
C
26
5.865
59.160
160.290
1.00
60.50
8


ATOM
1662
N
ASP
C
27
6.531
61.175
159.518
1.00
61.51
7


ATOM
1663
CA
ASP
C
27
5.556
61.999
160.249
1.00
62.24
6


ATOM
1664
CB
ASP
C
27
5.597
63.443
159.730
1.00
62.61
6


ATOM
1665
CG
ASP
C
27
6.743
64.249
160.313
1.00
64.07
6


ATOM
1666
OD1
ASP
C
27
7.926
63.820
160.213
1.00
64.69
8


ATOM
1667
OD2
ASP
C
27
6.442
65.333
160.862
1.00
65.47
8


ATOM
1668
C
ASP
C
27
4.132
61.526
160.079
1.00
62.22
6


ATOM
1669
O
ASP
C
27
3.412
61.327
161.053
1.00
62.46
8


ATOM
1670
N
ASP
C
28
3.716
61.394
158.826
1.00
62.23
7


ATOM
1671
CA
ASP
C
28
2.347
61.002
158.519
1.00
62.39
6


ATOM
1672
CB
ASP
C
28
2.028
61.172
157.033
1.00
62.62
6


ATOM
1673
CG
ASP
C
28
3.254
60.999
156.139
1.00
64.05
6


ATOM
1674
OD1
ASP
C
28
3.126
61.345
154.938
1.00
65.74
8


ATOM
1675
OD2
ASP
C
28
4.330
60.537
156.617
1.00
63.80
8


ATOM
1676
C
ASP
C
28
2.057
59.585
158.972
1.00
62.04
6


ATOM
1677
O
ASP
C
28
0.972
59.318
159.467
1.00
62.18
8


ATOM
1678
N
GLU
C
29
3.028
58.687
158.818
1.00
61.72
7


ATOM
1679
CA
GLU
C
29
2.859
57.302
159.265
1.00
61.35
6


ATOM
1680
CB
GLU
C
29
4.040
56.414
158.873
1.00
61.74
6


ATOM
1681
CG
GLU
C
29
4.126
56.080
157.383
1.00
63.75
6


ATOM
1682
CD
GLU
C
29
3.125
55.029
156.933
1.00
65.79
6


ATOM
1683
OE1
GLU
C
29
3.146
54.693
155.724
1.00
66.39
8


ATOM
1684
OE2
GLU
C
29
2.330
54.547
157.778
1.00
66.31
8


ATOM
1685
C
GLU
C
29
2.690
57.258
160.763
1.00
60.50
6


ATOM
1686
O
GLU
C
29
1.881
56.492
161.271
1.00
60.56
8


ATOM
1687
N
VAL
C
30
3.460
58.089
161.462
1.00
59.42
7


ATOM
1688
CA
VAL
C
30
3.371
58.194
162.913
1.00
58.17
6


ATOM
1689
CB
VAL
C
30
4.442
59.179
163.501
1.00
58.09
6


ATOM
1690
CG1
VAL
C
30
4.045
59.695
164.872
1.00
57.33
6


ATOM
1691
CG2
VAL
C
30
5.827
58.525
163.546
1.00
57.29
6


ATOM
1692
C
VAL
C
30
1.944
58.582
163.282
1.00
57.74
6


ATOM
1693
O
VAL
C
30
1.274
57.837
163.991
1.00
57.46
8


ATOM
1694
N
ARG
C
31
1.464
59.708
162.755
1.00
57.35
7


ATOM
1695
CA
ARG
C
31
0.131
60.184
163.124
1.00
57.25
6


ATOM
1696
CB
ARG
C
31
−0.098
61.660
162.782
1.00
57.15
6


ATOM
1697
CG
ARG
C
31
−0.165
62.548
164.037
1.00
57.68
6


ATOM
1698
CD
ARG
C
31
−0.448
64.000
163.708
1.00
57.91
6


ATOM
1699
NE
ARG
C
31
0.750
64.831
163.549
1.00
59.50
7


ATOM
1700
CZ
ARG
C
31
1.586
64.805
162.507
1.00
60.09
6


ATOM
1701
NH1
ARG
C
31
1.404
63.960
161.503
1.00
60.61
7


ATOM
1702
NH2
ARG
C
31
2.627
65.626
162.472
1.00
60.03
7


ATOM
1703
C
ARG
C
31
−1.009
59.287
162.654
1.00
56.82
6


ATOM
1704
O
ARG
C
31
−2.057
59.243
163.300
1.00
56.57
8


ATOM
1705
N
ILE
C
32
−0.782
58.563
161.556
1.00
56.62
7


ATOM
1706
CA
ILE
C
32
−1.696
57.509
161.084
1.00
56.34
6


ATOM
1707
CB
ILE
C
32
−1.263
56.912
159.696
1.00
56.30
6


ATOM
1708
CG1
ILE
C
32
−1.784
57.773
158.537
1.00
55.84
6


ATOM
1709
CD
ILE
C
32
−3.260
57.581
158.203
1.00
55.29
6


ATOM
1710
CG2
ILE
C
32
−1.709
55.439
159.534
1.00
55.88
6


ATOM
1711
C
ILE
C
32
−1.766
56.394
162.114
1.00
56.32
6


ATOM
1712
O
ILE
C
32
−2.838
55.893
162.428
1.00
56.45
8


ATOM
1713
N
LEU
C
33
−0.610
56.015
162.642
1.00
56.35
7


ATOM
1714
CA
LEU
C
33
−0.535
54.953
163.633
1.00
56.29
6


ATOM
1715
CB
LEU
C
33
0.906
54.426
163.731
1.00
56.21
6


ATOM
1716
CG
LEU
C
33
1.262
53.436
162.601
1.00
55.63
6


ATOM
1717
CD1
LEU
C
33
2.609
53.700
161.948
1.00
55.89
6


ATOM
1718
CD2
LEU
C
33
1.187
52.001
163.075
1.00
54.90
6


ATOM
1719
C
LEU
C
33
−1.094
55.425
164.978
1.00
56.42
6


ATOM
1720
O
LEU
C
33
−1.673
54.644
165.738
1.00
56.16
8


ATOM
1721
N
MET
C
34
−0.935
56.719
165.244
1.00
56.80
7


ATOM
1722
CA
MET
C
34
−1.564
57.353
166.391
1.00
57.23
6


ATOM
1723
CB
MET
C
34
−1.148
58.823
166.504
1.00
57.51
6


ATOM
1724
CG
MET
C
34
0.330
59.035
166.799
1.00
58.59
6


ATOM
1725
SD
MET
C
34
0.875
58.571
168.463
1.00
61.62
16


ATOM
1726
CE
MET
C
34
0.026
57.005
168.760
1.00
61.15
6


ATOM
1727
C
MET
C
34
−3.078
57.235
166.301
1.00
57.18
6


ATOM
1728
O
MET
C
34
−3.704
56.781
167.249
1.00
57.49
8


ATOM
1729
N
ALA
C
35
−3.658
57.623
165.162
1.00
56.93
7


ATOM
1730
CA
ALA
C
35
−5.112
57.553
164.971
1.00
56.54
6


ATOM
1731
CB
ALA
C
35
−5.526
58.186
163.655
1.00
56.60
6


ATOM
1732
C
ALA
C
35
−5.677
56.129
165.093
1.00
56.34
6


ATOM
1733
O
ALA
C
35
−6.784
55.951
165.605
1.00
56.61
8


ATOM
1734
N
ASN
C
36
−4.916
55.130
164.633
1.00
55.85
7


ATOM
1735
CA
ASN
C
36
−5.286
53.706
164.775
1.00
55.21
6


ATOM
1736
CB
ASN
C
36
−4.566
52.822
163.738
1.00
55.03
6


ATOM
1737
CG
ASN
C
36
−5.116
52.978
162.327
1.00
54.58
6


ATOM
1738
OD1
ASN
C
36
−6.290
53.287
162.121
1.00
54.61
8


ATOM
1739
ND2
ASN
C
36
−4.260
52.746
161.344
1.00
53.98
7


ATOM
1740
C
ASN
C
36
−4.992
53.166
166.169
1.00
55.03
6


ATOM
1741
O
ASN
C
36
−5.064
51.961
166.398
1.00
55.13
8


ATOM
1742
N
GLY
C
37
−4.629
54.066
167.080
1.00
54.85
7


ATOM
1743
CA
GLY
C
37
−4.318
53.731
168.472
1.00
54.31
6


ATOM
1744
C
GLY
C
37
−3.069
52.912
168.758
1.00
53.85
6


ATOM
1745
O
GLY
C
37
−3.061
52.150
169.717
1.00
53.84
8


ATOM
1746
N
ALA
C
38
−2.012
53.056
167.957
1.00
53.56
7


ATOM
1747
CA
ALA
C
38
−0.754
52.363
168.269
1.00
53.25
6


ATOM
1748
CB
ALA
C
38
0.274
52.552
167.173
1.00
53.22
6


ATOM
1749
C
ALA
C
38
−0.213
52.844
169.617
1.00
52.99
6


ATOM
1750
O
ALA
C
38
−0.430
53.998
170.006
1.00
53.06
8


ATOM
1751
N
ASP
C
39
0.459
51.952
170.338
1.00
52.56
7


ATOM
1752
CA
ASP
C
39
0.933
52.289
171.674
1.00
52.44
6


ATOM
1753
CB
ASP
C
39
1.229
51.038
172.504
1.00
52.59
6


ATOM
1754
CG
ASP
C
39
1.752
51.377
173.896
1.00
53.05
6


ATOM
1755
OD1
ASP
C
39
1.594
52.540
174.345
1.00
53.09
8


ATOM
1756
OD2
ASP
C
39
2.323
50.478
174.545
1.00
54.03
8


ATOM
1757
C
ASP
C
39
2.162
53.189
171.632
1.00
52.15
6


ATOM
1758
O
ASP
C
39
3.220
52.781
171.164
1.00
52.36
8


ATOM
1759
N
VAL
C
40
2.011
54.402
172.160
1.00
51.52
7


ATOM
1760
CA
VAL
C
40
3.059
55.413
172.123
1.00
50.83
6


ATOM
1761
CB
VAL
C
40
2.538
56.763
172.686
1.00
50.85
6


ATOM
1762
CG1
VAL
C
40
2.557
56.769
174.208
1.00
50.64
6


ATOM
1763
CG2
VAL
C
40
3.333
57.925
172.128
1.00
50.55
6


ATOM
1764
C
VAL
C
40
4.329
54.939
172.848
1.00
50.52
6


ATOM
1765
O
VAL
C
40
5.417
55.490
172.651
1.00
50.47
8


ATOM
1766
N
ASN
C
41
4.198
53.894
173.656
1.00
50.07
7


ATOM
1767
CA
ASN
C
41
5.341
53.409
174.415
1.00
49.98
6


ATOM
1768
CB
ASN
C
41
5.033
53.442
175.899
1.00
49.79
6


ATOM
1769
CG
ASN
C
41
4.863
54.828
176.407
1.00
49.55
6


ATOM
1770
OD1
ASN
C
41
5.432
55.782
175.872
1.00
48.90
8


ATOM
1771
ND2
ASN
C
41
4.065
54.962
177.452
1.00
50.65
7


ATOM
1772
C
ASN
C
41
5.892
52.037
174.048
1.00
50.14
6


ATOM
1773
O
ASN
C
41
6.725
51.497
174.773
1.00
50.29
8


ATOM
1774
N
ALA
C
42
5.445
51.465
172.933
1.00
50.32
7


ATOM
1775
CA
ALA
C
42
6.014
50.200
172.442
1.00
50.41
6


ATOM
1776
CB
ALA
C
42
5.638
49.977
170.966
1.00
50.21
6


ATOM
1777
C
ALA
C
42
7.545
50.147
172.630
1.00
50.47
6


ATOM
1778
O
ALA
C
42
8.247
51.123
172.333
1.00
50.77
8


ATOM
1779
N
ASN
C
43
8.041
49.022
173.149
1.00
50.10
7


ATOM
1780
CA
ASN
C
43
9.482
48.745
173.242
1.00
49.71
6


ATOM
1781
CB
ASN
C
43
9.781
47.955
174.519
1.00
49.84
6


ATOM
1782
CG
ASN
C
43
9.809
48.813
175.762
1.00
50.26
6


ATOM
1783
OD1
ASN
C
43
9.439
49.988
175.754
1.00
50.77
8


ATOM
1784
ND2
ASN
C
43
10.248
48.216
176.855
1.00
51.24
7


ATOM
1785
C
ASN
C
43
9.972
47.902
172.073
1.00
49.26
6


ATOM
1786
O
ASN
C
43
9.260
47.013
171.627
1.00
49.60
8


ATOM
1787
N
ASP
C
44
11.185
48.140
171.586
1.00
48.62
7


ATOM
1788
CA
ASP
C
44
11.832
47.114
170.761
1.00
48.21
6


ATOM
1789
CB
ASP
C
44
12.734
47.698
169.669
1.00
48.44
6


ATOM
1790
CG
ASP
C
44
13.835
48.586
170.212
1.00
49.72
6


ATOM
1791
OD1
ASP
C
44
14.211
48.491
171.404
1.00
51.69
8


ATOM
1792
OD2
ASP
C
44
14.342
49.393
169.416
1.00
51.27
8


ATOM
1793
C
ASP
C
44
12.579
46.146
171.678
1.00
47.54
6


ATOM
1794
O
ASP
C
44
12.401
46.196
172.893
1.00
47.46
8


ATOM
1795
N
ARG
C
45
13.411
45.275
171.106
1.00
46.84
7


ATOM
1796
CA
ARG
C
45
14.098
44.232
171.876
1.00
46.16
6


ATOM
1797
CB
ARG
C
45
14.910
43.307
170.961
1.00
45.97
6


ATOM
1798
CG
ARG
C
45
14.248
43.071
169.581
1.00
47.44
6


ATOM
1799
CD
ARG
C
45
15.153
42.409
168.501
1.00
47.20
6


ATOM
1800
NE
ARG
C
45
16.577
42.752
168.638
1.00
48.72
7


ATOM
1801
CZ
ARG
C
45
17.141
43.922
168.308
1.00
48.46
6


ATOM
1802
NH1
ARG
C
45
16.420
44.932
167.804
1.00
48.74
7


ATOM
1803
NH2
ARG
C
45
18.448
44.081
168.495
1.00
47.64
7


ATOM
1804
C
ARG
C
45
14.995
44.846
172.928
1.00
45.41
6


ATOM
1805
O
ARG
C
45
15.149
44.278
174.001
1.00
45.32
8


ATOM
1806
N
LYS
C
46
15.566
46.014
172.626
1.00
44.92
7


ATOM
1807
CA
LYS
C
46
16.421
46.746
173.578
1.00
44.68
6


ATOM
1808
CB
LYS
C
46
17.748
47.177
172.952
1.00
44.75
6


ATOM
1809
CG
LYS
C
46
17.631
47.766
171.562
1.00
46.50
6


ATOM
1810
CD
LYS
C
46
18.134
46.785
170.516
1.00
49.83
6


ATOM
1811
CE
LYS
C
46
19.623
46.473
170.710
1.00
50.97
6


ATOM
1812
NZ
LYS
C
46
20.447
47.715
170.596
1.00
52.53
7


ATOM
1813
C
LYS
C
46
15.758
47.930
174.281
1.00
44.08
6


ATOM
1814
O
LYS
C
46
16.408
48.874
174.671
1.00
44.20
8


ATOM
1815
N
GLY
C
47
14.458
47.864
174.468
1.00
43.74
7


ATOM
1816
CA
GLY
C
47
13.803
48.769
175.393
1.00
43.31
6


ATOM
1817
C
GLY
C
47
13.578
50.170
174.884
1.00
43.07
6


ATOM
1818
O
GLY
C
47
13.007
50.996
175.598
1.00
43.23
8


ATOM
1819
N
ASN
C
48
14.023
50.439
173.660
1.00
42.69
7


ATOM
1820
CA
ASN
C
48
13.699
51.687
172.973
1.00
42.51
6


ATOM
1821
CB
ASN
C
48
14.237
51.656
171.566
1.00
42.50
6


ATOM
1822
CG
ASN
C
48
15.677
51.917
171.523
1.00
44.06
6


ATOM
1823
OD1
ASN
C
48
16.142
52.888
172.102
1.00
46.77
8


ATOM
1824
ND2
ASN
C
48
16.420
51.048
170.861
1.00
45.28
7


ATOM
1825
C
ASN
C
48
12.227
51.894
172.825
1.00
42.06
6


ATOM
1826
O
ASN
C
48
11.511
50.955
172.527
1.00
42.35
8


ATOM
1827
N
THR
C
49
11.772
53.125
173.011
1.00
41.66
7


ATOM
1828
CA
THR
C
49
10.414
53.483
172.640
1.00
41.37
6


ATOM
1829
CB
THR
C
49
9.635
54.175
173.777
1.00
41.48
6


ATOM
1830
OG1
THR
C
49
10.065
55.540
173.896
1.00
42.25
8


ATOM
1831
CG2
THR
C
49
9.805
53.426
175.097
1.00
41.49
6


ATOM
1832
C
THR
C
49
10.491
54.419
171.450
1.00
41.10
6


ATOM
1833
O
THR
C
49
11.548
54.980
171.178
1.00
41.19
8


ATOM
1834
N
PRO
C
50
9.364
54.630
170.753
1.00
40.93
7


ATOM
1835
CA
PRO
C
50
9.374
55.551
169.619
1.00
40.59
6


ATOM
1836
CB
PRO
C
50
7.880
55.812
169.378
1.00
40.88
6


ATOM
1837
CG
PRO
C
50
7.164
55.255
170.619
1.00
40.89
6


ATOM
1838
CD
PRO
C
50
8.011
54.100
170.997
1.00
41.10
6


ATOM
1839
C
PRO
C
50
10.077
56.863
169.965
1.00
40.26
6


ATOM
1840
O
PRO
C
50
10.877
57.361
169.168
1.00
40.04
8


ATOM
1841
N
LEU
C
51
9.786
57.393
171.156
1.00
39.87
7


ATOM
1842
CA
LEU
C
51
10.417
58.623
171.619
1.00
39.69
6


ATOM
1843
CB
LEU
C
51
9.870
59.057
172.986
1.00
39.87
6


ATOM
1844
CG
LEU
C
51
10.407
60.401
173.504
1.00
39.23
6


ATOM
1845
CD1
LEU
C
51
9.846
61.554
172.699
1.00
38.27
6


ATOM
1846
CD2
LEU
C
51
10.123
60.589
174.990
1.00
39.36
6


ATOM
1847
C
LEU
C
51
11.944
58.512
171.630
1.00
39.60
6


ATOM
1848
O
LEU
C
51
12.637
59.418
171.147
1.00
39.45
8


ATOM
1849
N
HIS
C
52
12.463
57.405
172.154
1.00
39.46
7


ATOM
1850
CA
HIS
C
52
13.887
57.133
171.997
1.00
39.80
6


ATOM
1851
CB
HIS
C
52
14.246
55.715
172.419
1.00
39.79
6


ATOM
1852
CG
HIS
C
52
14.312
55.531
173.891
1.00
41.55
6


ATOM
1853
ND1
HIS
C
52
13.290
54.955
174.613
1.00
43.60
7


ATOM
1854
CE1
HIS
C
52
13.622
54.922
175.893
1.00
44.57
6


ATOM
1855
NE2
HIS
C
52
14.819
55.468
176.028
1.00
44.57
7


ATOM
1856
CD2
HIS
C
52
15.266
55.869
174.790
1.00
43.67
6


ATOM
1857
C
HIS
C
52
14.287
57.320
170.543
1.00
39.55
6


ATOM
1858
O
HIS
C
52
15.045
58.229
170.207
1.00
39.55
8


ATOM
1859
N
LEU
C
53
13.761
56.466
169.675
1.00
39.33
7


ATOM
1860
CA
LEU
C
53
14.267
56.414
168.321
1.00
39.42
6


ATOM
1861
CB
LEU
C
53
13.504
55.413
167.475
1.00
39.20
6


ATOM
1862
CG
LEU
C
53
13.756
53.932
167.676
1.00
38.67
6


ATOM
1863
CD1
LEU
C
53
12.764
53.424
168.623
1.00
39.69
6


ATOM
1864
CD2
LEU
C
53
13.567
53.218
166.372
1.00
39.89
6


ATOM
1865
C
LEU
C
53
14.174
57.786
167.696
1.00
39.86
6


ATOM
1866
O
LEU
C
53
15.091
58.214
166.998
1.00
40.33
8


ATOM
1867
N
ALA
C
54
13.068
58.480
167.963
1.00
39.99
7


ATOM
1868
CA
ALA
C
54
12.844
59.798
167.391
1.00
40.11
6


ATOM
1869
CB
ALA
C
54
11.461
60.273
167.701
1.00
40.38
6


ATOM
1870
C
ALA
C
54
13.884
60.779
167.916
1.00
40.33
6


ATOM
1871
O
ALA
C
54
14.332
61.665
167.179
1.00
40.23
8


ATOM
1872
N
ALA
C
55
14.269
60.610
169.187
1.00
40.49
7


ATOM
1873
CA
ALA
C
55
15.409
61.341
169.761
1.00
40.76
6


ATOM
1874
CB
ALA
C
55
15.544
61.055
171.245
1.00
40.30
6


ATOM
1875
C
ALA
C
55
16.695
60.944
169.027
1.00
41.05
6


ATOM
1876
O
ALA
C
55
17.443
61.797
168.525
1.00
41.30
8


ATOM
1877
N
ASP
C
56
16.923
59.641
168.938
1.00
40.97
7


ATOM
1878
CA
ASP
C
56
18.115
59.131
168.319
1.00
41.27
6


ATOM
1879
CB
ASP
C
56
18.031
57.617
168.216
1.00
41.53
6


ATOM
1880
CG
ASP
C
56
19.385
56.977
168.127
1.00
42.42
6


ATOM
1881
OD1
ASP
C
56
19.959
56.818
167.028
1.00
42.45
8


ATOM
1882
OD2
ASP
C
56
19.885
56.634
169.199
1.00
45.53
8


ATOM
1883
C
ASP
C
56
18.407
59.714
166.929
1.00
41.32
6


ATOM
1884
O
ASP
C
56
19.572
59.880
166.565
1.00
41.35
8


ATOM
1885
N
TYR
C
57
17.374
60.008
166.148
1.00
41.31
7


ATOM
1886
CA
TYR
C
57
17.594
60.320
164.751
1.00
41.75
6


ATOM
1887
CB
TYR
C
57
16.847
59.320
163.884
1.00
41.69
6


ATOM
1888
CG
TYR
C
57
17.393
57.915
163.917
1.00
41.54
6


ATOM
1889
CD1
TYR
C
57
17.100
57.057
164.970
1.00
41.80
6


ATOM
1890
CE1
TYR
C
57
17.587
55.772
165.001
1.00
41.87
6


ATOM
1891
CZ
TYR
C
57
18.370
55.322
163.959
1.00
42.37
6


ATOM
1892
OH
TYR
C
57
18.869
54.046
163.989
1.00
42.86
8


ATOM
1893
CE2
TYR
C
57
18.665
56.144
162.897
1.00
41.95
6


ATOM
1894
CD2
TYR
C
57
18.171
57.432
162.882
1.00
41.62
6


ATOM
1895
C
TYR
C
57
17.119
61.717
164.433
1.00
42.35
6


ATOM
1896
O
TYR
C
57
16.438
61.933
163.426
1.00
42.49
8


ATOM
1897
N
ASP
C
58
17.524
62.683
165.252
1.00
42.97
7


ATOM
1898
CA
ASP
C
58
16.711
63.901
165.447
1.00
43.79
6


ATOM
1899
CB
ASP
C
58
17.505
65.184
165.822
1.00
43.91
6


ATOM
1900
CG
ASP
C
58
18.422
65.676
164.743
1.00
43.35
6


ATOM
1901
OD1
ASP
C
58
18.631
64.954
163.766
1.00
43.95
8


ATOM
1902
OD2
ASP
C
58
18.966
66.792
164.902
1.00
42.91
8


ATOM
1903
C
ASP
C
58
15.562
64.167
164.470
1.00
44.21
6


ATOM
1904
O
ASP
C
58
15.736
64.651
163.373
1.00
43.85
8


ATOM
1905
N
HIS
C
59
14.377
63.799
164.923
1.00
45.34
7


ATOM
1906
CA
HIS
C
59
13.156
64.100
164.244
1.00
46.35
6


ATOM
1907
CB
HIS
C
59
12.435
62.809
163.885
1.00
46.42
6


ATOM
1908
CG
HIS
C
59
13.191
61.955
162.915
1.00
47.08
6


ATOM
1909
ND1
HIS
C
59
13.490
62.370
161.634
1.00
47.74
7


ATOM
1910
CE1
HIS
C
59
14.156
61.415
161.012
1.00
47.94
6


ATOM
1911
NE2
HIS
C
59
14.297
60.395
161.840
1.00
47.52
7


ATOM
1912
CD2
HIS
C
59
13.702
60.707
163.036
1.00
47.53
6


ATOM
1913
C
HIS
C
59
12.350
64.948
165.201
1.00
46.86
6


ATOM
1914
O
HIS
C
59
11.447
64.464
165.867
1.00
47.16
8


ATOM
1915
N
LEU
C
60
12.711
66.221
165.269
1.00
47.53
7


ATOM
1916
CA
LEU
C
60
12.121
67.163
166.206
1.00
48.37
6


ATOM
1917
CB
LEU
C
60
12.542
68.582
165.803
1.00
48.14
6


ATOM
1918
CG
LEU
C
60
12.455
69.824
166.697
1.00
47.18
6


ATOM
1919
CD1
LEU
C
60
11.120
69.957
167.439
1.00
47.43
6


ATOM
1920
CD2
LEU
C
60
13.598
69.867
167.669
1.00
46.68
6


ATOM
1921
C
LEU
C
60
10.588
67.061
166.273
1.00
49.28
6


ATOM
1922
O
LEU
C
60
10.006
66.900
167.346
1.00
49.51
8


ATOM
1923
N
GLU
C
61
9.943
67.163
165.122
1.00
50.22
7


ATOM
1924
CA
GLU
C
61
8.487
67.168
165.047
1.00
51.57
6


ATOM
1925
CB
GLU
C
61
8.009
67.441
163.600
1.00
52.19
6


ATOM
1926
CG
GLU
C
61
8.695
66.590
162.476
1.00
56.17
6


ATOM
1927
CD
GLU
C
61
10.241
66.686
162.433
1.00
60.23
6


ATOM
1928
OE1
GLU
C
61
10.920
65.656
162.655
1.00
61.20
8


ATOM
1929
OE2
GLU
C
61
10.775
67.787
162.176
1.00
61.91
8


ATOM
1930
C
GLU
C
61
7.906
65.874
165.619
1.00
51.11
6


ATOM
1931
O
GLU
C
61
7.076
65.913
166.533
1.00
51.38
8


ATOM
1932
N
ILE
C
62
8.377
64.741
165.104
1.00
50.55
7


ATOM
1933
CA
ILE
C
62
7.938
63.430
165.563
1.00
50.11
6


ATOM
1934
CB
ILE
C
62
8.709
62.290
164.837
1.00
50.17
6


ATOM
1935
CG1
ILE
C
62
8.206
62.175
163.394
1.00
50.18
6


ATOM
1936
CD
ILE
C
62
9.263
61.858
162.399
1.00
49.48
6


ATOM
1937
CG2
ILE
C
62
8.540
60.943
165.537
1.00
49.42
6


ATOM
1938
C
ILE
C
62
8.036
63.347
167.080
1.00
50.05
6


ATOM
1939
O
ILE
C
62
7.117
62.864
167.725
1.00
50.34
8


ATOM
1940
N
VAL
C
63
9.125
63.863
167.643
1.00
49.92
7


ATOM
1941
CA
VAL
C
63
9.305
63.931
169.095
1.00
49.85
6


ATOM
1942
CB
VAL
C
63
10.677
64.575
169.468
1.00
49.52
6


ATOM
1943
CG1
VAL
C
63
10.713
65.024
170.909
1.00
49.03
6


ATOM
1944
CG2
VAL
C
63
11.786
63.608
169.208
1.00
48.80
6


ATOM
1945
C
VAL
C
63
8.119
64.671
169.743
1.00
50.52
6


ATOM
1946
O
VAL
C
63
7.530
64.189
170.723
1.00
50.37
8


ATOM
1947
N
GLU
C
64
7.752
65.816
169.171
1.00
51.25
7


ATOM
1948
CA
GLU
C
64
6.645
66.602
169.701
1.00
52.42
6


ATOM
1949
CB
GLU
C
64
6.544
67.935
168.975
1.00
52.78
6


ATOM
1950
CG
GLU
C
64
7.551
68.957
169.447
1.00
55.48
6


ATOM
1951
CD
GLU
C
64
7.202
70.364
168.980
1.00
59.27
6


ATOM
1952
OE1
GLU
C
64
7.506
70.711
167.809
1.00
60.55
8


ATOM
1953
OE2
GLU
C
64
6.625
71.126
169.791
1.00
60.61
8


ATOM
1954
C
GLU
C
64
5.315
65.857
169.614
1.00
52.49
6


ATOM
1955
O
GLU
C
64
4.544
65.821
170.581
1.00
52.52
8


ATOM
1956
N
VAL
C
65
5.064
65.264
168.448
1.00
52.51
7


ATOM
1957
CA
VAL
C
65
3.887
64.431
168.204
1.00
52.43
6


ATOM
1958
CB
VAL
C
65
3.974
63.766
166.814
1.00
52.30
6


ATOM
1959
CG1
VAL
C
65
2.683
63.040
166.475
1.00
52.45
6


ATOM
1960
CG2
VAL
C
65
4.292
64.798
165.760
1.00
52.20
6


ATOM
1961
C
VAL
C
65
3.739
63.333
169.256
1.00
52.50
6


ATOM
1962
O
VAL
C
65
2.639
63.079
169.753
1.00
52.43
8


ATOM
1963
N
LEU
C
66
4.858
62.688
169.577
1.00
52.62
7


ATOM
1964
CA
LEU
C
66
4.887
61.605
170.549
1.00
53.09
6


ATOM
1965
CB
LEU
C
66
6.240
60.897
170.535
1.00
53.01
6


ATOM
1966
CG
LEU
C
66
6.584
60.033
169.313
1.00
53.28
6


ATOM
1967
CD1
LEU
C
66
8.042
59.561
169.363
1.00
53.18
6


ATOM
1968
CD2
LEU
C
66
5.627
58.853
169.152
1.00
52.89
6


ATOM
1969
C
LEU
C
66
4.584
62.101
171.956
1.00
53.60
6


ATOM
1970
O
LEU
C
66
3.863
61.442
172.722
1.00
53.72
8


ATOM
1971
N
LEU
C
67
5.136
63.264
172.291
1.00
53.88
7


ATOM
1972
CA
LEU
C
67
4.866
63.898
173.573
1.00
53.90
6


ATOM
1973
CB
LEU
C
67
5.821
65.058
173.784
1.00
53.68
6


ATOM
1974
CG
LEU
C
67
7.252
64.554
173.916
1.00
53.65
6


ATOM
1975
CD1
LEU
C
67
8.249
65.684
173.740
1.00
54.14
6


ATOM
1976
CD2
LEU
C
67
7.444
63.849
175.248
1.00
53.33
6


ATOM
1977
C
LEU
C
67
3.414
64.361
173.681
1.00
53.98
6


ATOM
1978
O
LEU
C
67
2.801
64.239
174.740
1.00
54.09
8


ATOM
1979
N
LYS
C
68
2.866
64.875
172.583
1.00
53.92
7


ATOM
1980
CA
LYS
C
68
1.463
65.256
172.543
1.00
53.97
6


ATOM
1981
CB
LYS
C
68
1.088
65.955
171.232
1.00
54.03
6


ATOM
1982
CG
LYS
C
68
1.240
67.471
171.258
1.00
54.50
6


ATOM
1983
CD
LYS
C
68
0.865
68.082
169.910
1.00
54.47
6


ATOM
1984
CE
LYS
C
68
1.161
69.584
169.846
1.00
55.14
6


ATOM
1985
NZ
LYS
C
68
2.534
69.914
169.359
1.00
54.89
7


ATOM
1986
C
LYS
C
68
0.569
64.052
172.756
1.00
53.51
6


ATOM
1987
O
LYS
C
68
−0.495
64.194
173.321
1.00
53.64
8


ATOM
1988
N
HIS
C
69
0.990
62.871
172.312
1.00
53.14
7


ATOM
1989
CA
HIS
C
69
0.193
61.652
172.502
1.00
52.98
6


ATOM
1990
CB
HIS
C
69
0.344
60.706
171.301
1.00
52.96
6


ATOM
1991
CG
HIS
C
69
−0.534
61.052
170.133
1.00
53.77
6


ATOM
1992
ND1
HIS
C
69
−1.806
60.537
169.976
1.00
54.15
7


ATOM
1993
CE1
HIS
C
69
−2.341
61.012
168.864
1.00
53.78
6


ATOM
1994
NE2
HIS
C
69
−1.457
61.804
168.284
1.00
54.43
7


ATOM
1995
CD2
HIS
C
69
−0.316
61.843
169.054
1.00
54.46
6


ATOM
1996
C
HIS
C
69
0.543
60.940
173.821
1.00
52.86
6


ATOM
1997
O
HIS
C
69
0.061
59.835
174.103
1.00
52.83
8


ATOM
1998
N
GLY
C
70
1.389
61.587
174.618
1.00
52.62
7


ATOM
1999
CA
GLY
C
70
1.705
61.132
175.960
1.00
52.17
6


ATOM
2000
C
GLY
C
70
2.706
60.000
176.022
1.00
52.07
6


ATOM
2001
O
GLY
C
70
2.515
59.064
176.796
1.00
52.16
8


ATOM
2002
N
ALA
C
71
3.768
60.070
175.214
1.00
51.85
7


ATOM
2003
CA
ALA
C
71
4.919
59.175
175.378
1.00
51.40
6


ATOM
2004
CB
ALA
C
71
5.917
59.372
174.254
1.00
51.45
6


ATOM
2005
C
ALA
C
71
5.577
59.476
176.716
1.00
51.14
6


ATOM
2006
O
ALA
C
71
5.672
60.639
177.103
1.00
51.39
8


ATOM
2007
N
ASP
C
72
6.008
58.436
177.428
1.00
50.69
7


ATOM
2008
CA
ASP
C
72
6.809
58.612
178.652
1.00
50.23
6


ATOM
2009
CB
ASP
C
72
7.092
57.264
179.335
1.00
50.46
6


ATOM
2010
CG
ASP
C
72
7.960
57.394
180.593
1.00
51.08
6


ATOM
2011
OD1
ASP
C
72
7.967
58.462
181.256
1.00
51.83
8


ATOM
2012
OD2
ASP
C
72
8.626
56.393
180.932
1.00
52.53
8


ATOM
2013
C
ASP
C
72
8.120
59.284
178.289
1.00
49.60
6


ATOM
2014
O
ASP
C
72
8.918
58.726
177.537
1.00
49.62
8


ATOM
2015
N
VAL
C
73
8.325
60.484
178.820
1.00
48.85
7


ATOM
2016
CA
VAL
C
73
9.497
61.290
178.504
1.00
48.29
6


ATOM
2017
CB
VAL
C
73
9.284
62.768
178.932
1.00
48.25
6


ATOM
2018
CG1
VAL
C
73
8.763
62.854
180.348
1.00
48.02
6


ATOM
2019
CG2
VAL
C
73
10.551
63.580
178.783
1.00
47.81
6


ATOM
2020
C
VAL
C
73
10.769
60.708
179.117
1.00
48.13
6


ATOM
2021
O
VAL
C
73
11.842
60.843
178.562
1.00
48.26
8


ATOM
2022
N
ASN
C
74
10.639
60.041
180.250
1.00
47.86
7


ATOM
2023
CA
ASN
C
74
11.794
59.533
180.950
1.00
47.63
6


ATOM
2024
CB
ASN
C
74
11.687
59.891
182.428
1.00
47.90
6


ATOM
2025
CG
ASN
C
74
11.536
61.366
182.652
1.00
47.99
6


ATOM
2026
OD1
ASN
C
74
12.484
62.137
182.466
1.00
48.86
8


ATOM
2027
ND2
ASN
C
74
10.341
61.776
183.054
1.00
47.63
7


ATOM
2028
C
ASN
C
74
11.935
58.034
180.799
1.00
47.36
6


ATOM
2029
O
ASN
C
74
12.514
57.367
181.656
1.00
47.46
8


ATOM
2030
N
ALA
C
75
11.398
57.487
179.723
1.00
46.92
7


ATOM
2031
CA
ALA
C
75
11.521
56.056
179.515
1.00
46.93
6


ATOM
2032
CB
ALA
C
75
10.782
55.633
178.265
1.00
46.96
6


ATOM
2033
C
ALA
C
75
13.011
55.686
179.434
1.00
47.10
6


ATOM
2034
O
ALA
C
75
13.784
56.348
178.737
1.00
47.54
8


ATOM
2035
N
HIS
C
76
13.428
54.670
180.182
1.00
46.78
7


ATOM
2036
CA
HIS
C
76
14.778
54.157
180.049
1.00
46.55
6


ATOM
2037
CB
HIS
C
76
15.323
53.684
181.393
1.00
47.13
6


ATOM
2038
CG
HIS
C
76
15.153
54.671
182.521
1.00
50.18
6


ATOM
2039
ND1
HIS
C
76
16.207
55.395
183.051
1.00
52.42
7


ATOM
2040
CE1
HIS
C
76
15.769
56.154
184.043
1.00
51.73
6


ATOM
2041
NE2
HIS
C
76
14.471
55.947
184.183
1.00
52.15
7


ATOM
2042
CD2
HIS
C
76
14.063
55.014
183.255
1.00
51.95
6


ATOM
2043
C
HIS
C
76
14.728
52.997
179.061
1.00
46.10
6


ATOM
2044
O
HIS
C
76
13.739
52.266
178.994
1.00
45.88
8


ATOM
2045
N
ASP
C
77
15.778
52.838
178.265
1.00
45.73
7


ATOM
2046
CA
ASP
C
77
15.915
51.638
177.448
1.00
45.27
6


ATOM
2047
CB
ASP
C
77
16.885
51.884
176.299
1.00
45.75
6


ATOM
2048
CG
ASP
C
77
18.305
52.212
176.782
1.00
48.00
6


ATOM
2049
OD1
ASP
C
77
18.547
52.181
178.006
1.00
49.64
8


ATOM
2050
OD2
ASP
C
77
19.187
52.499
175.936
1.00
51.11
8


ATOM
2051
C
ASP
C
77
16.426
50.560
178.392
1.00
44.35
6


ATOM
2052
O
ASP
C
77
16.435
50.769
179.600
1.00
43.90
8


ATOM
2053
N
ASN
C
78
16.880
49.432
177.852
1.00
43.82
7


ATOM
2054
CA
ASN
C
78
17.356
48.320
178.684
1.00
43.36
6


ATOM
2055
CB
ASN
C
78
17.477
47.028
177.872
1.00
43.33
6


ATOM
2056
CG
ASN
C
78
16.122
46.486
177.390
1.00
45.05
6


ATOM
2057
OD1
ASN
C
78
15.049
46.672
178.005
1.00
45.62
8


ATOM
2058
ND2
ASN
C
78
16.181
45.775
176.285
1.00
47.40
7


ATOM
2059
C
ASN
C
78
18.677
48.590
179.377
1.00
42.53
6


ATOM
2060
O
ASN
C
78
19.008
47.940
180.357
1.00
42.61
8


ATOM
2061
N
ASP
C
79
19.434
49.540
178.850
1.00
41.94
7


ATOM
2062
CA
ASP
C
79
20.707
49.933
179.436
1.00
41.54
6


ATOM
2063
CB
ASP
C
79
21.695
50.269
178.339
1.00
41.73
6


ATOM
2064
CG
ASP
C
79
22.573
49.110
177.989
1.00
43.28
6


ATOM
2065
OD1
ASP
C
79
22.293
47.957
178.428
1.00
43.10
8


ATOM
2066
OD2
ASP
C
79
23.559
49.362
177.267
1.00
45.59
8


ATOM
2067
C
ASP
C
79
20.553
51.147
180.307
1.00
41.06
6


ATOM
2068
O
ASP
C
79
21.523
51.663
180.842
1.00
41.01
8


ATOM
2069
N
GLY
C
80
19.325
51.637
180.406
1.00
40.69
7


ATOM
2070
CA
GLY
C
80
19.030
52.793
181.239
1.00
39.86
6


ATOM
2071
C
GLY
C
80
19.076
54.170
180.603
1.00
39.22
6


ATOM
2072
O
GLY
C
80
18.754
55.141
181.274
1.00
39.39
8


ATOM
2073
N
SER
C
81
19.467
54.276
179.332
1.00
38.75
7


ATOM
2074
CA
SER
C
81
19.492
55.579
178.646
1.00
38.28
6


ATOM
2075
CB
SER
C
81
20.259
55.510
177.323
1.00
37.96
6


ATOM
2076
OG
SER
C
81
21.379
54.637
177.408
1.00
38.47
8


ATOM
2077
C
SER
C
81
18.069
56.060
178.392
1.00
38.05
6


ATOM
2078
O
SER
C
81
17.218
55.303
177.896
1.00
37.96
8


ATOM
2079
N
THR
C
82
17.797
57.310
178.755
1.00
37.83
7


ATOM
2080
CA
THR
C
82
16.532
57.960
178.383
1.00
37.48
6


ATOM
2081
CB
THR
C
82
16.167
58.998
179.386
1.00
37.32
6


ATOM
2082
OG1
THR
C
82
17.237
59.947
179.439
1.00
37.28
8


ATOM
2083
CG2
THR
C
82
15.924
58.368
180.752
1.00
36.78
6


ATOM
2084
C
THR
C
82
16.705
58.704
177.070
1.00
37.70
6


ATOM
2085
O
THR
C
82
17.828
58.966
176.654
1.00
38.11
8


ATOM
2086
N
PRO
C
83
15.609
59.070
176.405
1.00
37.69
7


ATOM
2087
CA
PRO
C
83
15.815
59.867
175.195
1.00
37.86
6


ATOM
2088
CB
PRO
C
83
14.396
60.275
174.814
1.00
37.73
6


ATOM
2089
CG
PRO
C
83
13.573
59.153
175.293
1.00
37.94
6


ATOM
2090
CD
PRO
C
83
14.184
58.798
176.628
1.00
37.75
6


ATOM
2091
C
PRO
C
83
16.742
61.100
175.403
1.00
37.90
6


ATOM
2092
O
PRO
C
83
17.591
61.400
174.535
1.00
37.89
8


ATOM
2093
N
LEU
C
84
16.620
61.778
176.542
1.00
37.60
7


ATOM
2094
CA
LEU
C
84
17.541
62.866
176.845
1.00
37.49
6


ATOM
2095
CB
LEU
C
84
17.316
63.433
178.247
1.00
37.61
6


ATOM
2096
CG
LEU
C
84
17.897
64.826
178.492
1.00
37.02
6


ATOM
2097
CD1
LEU
C
84
17.428
65.798
177.435
1.00
35.89
6


ATOM
2098
CD2
LEU
C
84
17.490
65.309
179.872
1.00
38.20
6


ATOM
2099
C
LEU
C
84
18.998
62.448
176.661
1.00
37.56
6


ATOM
2100
O
LEU
C
84
19.745
63.154
175.963
1.00
37.67
8


ATOM
2101
N
HIS
C
85
19.395
61.312
177.254
1.00
37.28
7


ATOM
2102
CA
HIS
C
85
20.743
60.755
177.008
1.00
37.48
6


ATOM
2103
CB
HIS
C
85
20.898
59.343
177.594
1.00
38.12
6


ATOM
2104
CG
HIS
C
85
20.914
59.315
179.085
1.00
40.16
6


ATOM
2105
ND1
HIS
C
85
19.791
59.568
179.843
1.00
42.29
7


ATOM
2106
CE1
HIS
C
85
20.105
59.492
181.125
1.00
43.32
6


ATOM
2107
NE2
HIS
C
85
21.388
59.191
181.225
1.00
43.15
7


ATOM
2108
CD2
HIS
C
85
21.918
59.078
179.962
1.00
41.88
6


ATOM
2109
C
HIS
C
85
21.083
60.728
175.517
1.00
36.69
6


ATOM
2110
O
HIS
C
85
22.068
61.328
175.083
1.00
35.87
8


ATOM
2111
N
LEU
C
86
20.247
60.053
174.737
1.00
36.44
7


ATOM
2112
CA
LEU
C
86
20.531
59.913
173.332
1.00
36.66
6


ATOM
2113
CB
LEU
C
86
19.449
59.138
172.587
1.00
36.73
6


ATOM
2114
CG
LEU
C
86
19.408
57.605
172.678
1.00
36.84
6


ATOM
2115
CD1
LEU
C
86
20.722
57.006
173.202
1.00
36.68
6


ATOM
2116
CD2
LEU
C
86
18.274
57.188
173.578
1.00
37.43
6


ATOM
2117
C
LEU
C
86
20.722
61.262
172.696
1.00
36.94
6


ATOM
2118
O
LEU
C
86
21.746
61.502
172.047
1.00
37.14
8


ATOM
2119
N
ALA
C
87
19.752
62.152
172.894
1.00
37.20
7


ATOM
2120
CA
ALA
C
87
19.821
63.482
172.288
1.00
37.51
6


ATOM
2121
CB
ALA
C
87
18.668
64.344
172.745
1.00
37.76
6


ATOM
2122
C
ALA
C
87
21.150
64.126
172.643
1.00
37.57
6


ATOM
2123
O
ALA
C
87
21.850
64.636
171.760
1.00
37.43
8


ATOM
2124
N
ALA
C
88
21.498
64.051
173.933
1.00
37.46
7


ATOM
2125
CA
ALA
C
88
22.762
64.571
174.438
1.00
37.43
6


ATOM
2126
CB
ALA
C
88
22.902
64.283
175.905
1.00
37.42
6


ATOM
2127
C
ALA
C
88
23.946
63.995
173.674
1.00
37.29
6


ATOM
2128
O
ALA
C
88
24.728
64.750
173.093
1.00
37.65
8


ATOM
2129
N
LEU
C
89
24.066
62.671
173.656
1.00
36.76
7


ATOM
2130
CA
LEU
C
89
25.218
62.039
173.050
1.00
36.55
6


ATOM
2131
CB
LEU
C
89
25.140
60.541
173.229
1.00
36.40
6


ATOM
2132
CG
LEU
C
89
25.989
59.583
172.405
1.00
36.40
6


ATOM
2133
CD1
LEU
C
89
27.454
59.833
172.643
1.00
36.83
6


ATOM
2134
CD2
LEU
C
89
25.633
58.144
172.761
1.00
36.12
6


ATOM
2135
C
LEU
C
89
25.373
62.418
171.586
1.00
37.28
6


ATOM
2136
O
LEU
C
89
26.504
62.574
171.114
1.00
37.43
8


ATOM
2137
N
PHE
C
90
24.264
62.596
170.864
1.00
37.79
7


ATOM
2138
CA
PHE
C
90
24.385
62.963
169.444
1.00
38.27
6


ATOM
2139
CB
PHE
C
90
23.380
62.250
168.538
1.00
38.44
6


ATOM
2140
CG
PHE
C
90
23.384
60.765
168.677
1.00
39.28
6


ATOM
2141
CD1
PHE
C
90
22.235
60.096
169.066
1.00
39.62
6


ATOM
2142
CE1
PHE
C
90
22.227
58.726
169.210
1.00
38.96
6


ATOM
2143
CZ
PHE
C
90
23.369
58.008
168.974
1.00
38.72
6


ATOM
2144
CE2
PHE
C
90
24.534
58.667
168.598
1.00
39.29
6


ATOM
2145
CD2
PHE
C
90
24.538
60.035
168.453
1.00
39.56
6


ATOM
2146
C
PHE
C
90
24.282
64.438
169.185
1.00
38.58
6


ATOM
2147
O
PHE
C
90
24.317
64.843
168.026
1.00
39.24
8


ATOM
2148
N
GLY
C
91
24.138
65.241
170.232
1.00
38.69
7


ATOM
2149
CA
GLY
C
91
24.145
66.697
170.075
1.00
39.30
6


ATOM
2150
C
GLY
C
91
22.935
67.331
169.402
1.00
39.82
6


ATOM
2151
O
GLY
C
91
23.028
68.406
168.813
1.00
39.43
8


ATOM
2152
N
HIS
C
92
21.796
66.666
169.514
1.00
40.82
7


ATOM
2153
CA
HIS
C
92
20.544
67.177
168.996
1.00
42.02
6


ATOM
2154
CB
HIS
C
92
19.609
66.011
168.746
1.00
42.01
6


ATOM
2155
CG
HIS
C
92
20.167
65.003
167.796
1.00
42.13
6


ATOM
2156
ND1
HIS
C
92
19.855
63.664
167.861
1.00
42.74
7


ATOM
2157
CE1
HIS
C
92
20.490
63.021
166.897
1.00
42.66
6


ATOM
2158
NE2
HIS
C
92
21.209
63.894
166.215
1.00
41.68
7


ATOM
2159
CD2
HIS
C
92
21.029
65.139
166.760
1.00
41.95
6


ATOM
2160
C
HIS
C
92
19.920
68.200
169.945
1.00
42.92
6


ATOM
2161
O
HIS
C
92
18.990
67.900
170.714
1.00
42.85
8


ATOM
2162
N
LEU
C
93
20.434
69.424
169.875
1.00
43.91
7


ATOM
2163
CA
LEU
C
93
20.141
70.408
170.912
1.00
45.07
6


ATOM
2164
CB
LEU
C
93
20.897
71.727
170.700
1.00
45.13
6


ATOM
2165
CG
LEU
C
93
22.425
71.701
170.509
1.00
46.93
6


ATOM
2166
CD1
LEU
C
93
23.158
70.530
171.249
1.00
47.92
6


ATOM
2167
CD2
LEU
C
93
22.805
71.706
169.024
1.00
48.28
6


ATOM
2168
C
LEU
C
93
18.668
70.656
170.980
1.00
45.47
6


ATOM
2169
O
LEU
C
93
18.025
70.358
171.969
1.00
45.32
8


ATOM
2170
N
GLU
C
94
18.138
71.177
169.891
1.00
46.32
7


ATOM
2171
CA
GLU
C
94
16.739
71.515
169.819
1.00
47.42
6


ATOM
2172
CB
GLU
C
94
16.304
71.933
168.390
1.00
47.58
6


ATOM
2173
CG
GLU
C
94
16.888
71.113
167.234
1.00
50.17
6


ATOM
2174
CD
GLU
C
94
18.385
70.793
167.392
1.00
53.61
6


ATOM
2175
OE1
GLU
C
94
18.720
69.646
167.809
1.00
54.04
8


ATOM
2176
OE2
GLU
C
94
19.214
71.694
167.108
1.00
54.33
8


ATOM
2177
C
GLU
C
94
15.896
70.408
170.457
1.00
47.47
6


ATOM
2178
O
GLU
C
94
14.964
70.715
171.197
1.00
48.02
8


ATOM
2179
N
ILE
C
95
16.254
69.140
170.261
1.00
47.32
7


ATOM
2180
CA
ILE
C
95
15.453
68.071
170.874
1.00
47.28
6


ATOM
2181
CB
ILE
C
95
15.757
66.709
170.272
1.00
47.59
6


ATOM
2182
CG1
ILE
C
95
15.358
66.718
168.785
1.00
48.24
6


ATOM
2183
CD
ILE
C
95
14.957
65.358
168.229
1.00
50.27
6


ATOM
2184
CG2
ILE
C
95
15.087
65.587
171.120
1.00
46.89
6


ATOM
2185
C
ILE
C
95
15.613
68.023
172.388
1.00
47.24
6


ATOM
2186
O
ILE
C
95
14.632
67.980
173.149
1.00
47.07
8


ATOM
2187
N
VAL
C
96
16.865
68.040
172.811
1.00
47.19
7


ATOM
2188
CA
VAL
C
96
17.189
68.213
174.202
1.00
47.32
6


ATOM
2189
CB
VAL
C
96
18.639
68.677
174.307
1.00
47.43
6


ATOM
2190
CG1
VAL
C
96
18.906
69.317
175.651
1.00
47.63
6


ATOM
2191
CG2
VAL
C
96
19.589
67.505
174.019
1.00
47.60
6


ATOM
2192
C
VAL
C
96
16.244
69.242
174.843
1.00
47.32
6


ATOM
2193
O
VAL
C
96
15.580
68.964
175.838
1.00
47.33
8


ATOM
2194
N
GLU
C
97
16.160
70.417
174.241
1.00
47.32
7


ATOM
2195
CA
GLU
C
97
15.344
71.476
174.796
1.00
47.47
6


ATOM
2196
CB
GLU
C
97
15.454
72.731
173.964
1.00
47.78
6


ATOM
2197
CG
GLU
C
97
16.871
73.053
173.589
1.00
49.63
6


ATOM
2198
CD
GLU
C
97
17.003
74.461
173.093
1.00
52.37
6


ATOM
2199
OE1
GLU
C
97
16.365
74.791
172.061
1.00
53.22
8


ATOM
2200
OE2
GLU
C
97
17.737
75.238
173.747
1.00
53.08
8


ATOM
2201
C
GLU
C
97
13.894
71.074
174.910
1.00
47.03
6


ATOM
2202
O
GLU
C
97
13.359
71.057
176.008
1.00
47.28
8


ATOM
2203
N
VAL
C
98
13.258
70.739
173.793
1.00
46.46
7


ATOM
2204
CA
VAL
C
98
11.863
70.281
173.844
1.00
46.18
6


ATOM
2205
CB
VAL
C
98
11.257
69.922
172.434
1.00
46.11
6


ATOM
2206
CG1
VAL
C
98
12.262
70.097
171.333
1.00
46.16
6


ATOM
2207
CG2
VAL
C
98
10.622
68.519
172.408
1.00
45.61
6


ATOM
2208
C
VAL
C
98
11.620
69.166
174.882
1.00
46.03
6


ATOM
2209
O
VAL
C
98
10.575
69.159
175.564
1.00
46.08
8


ATOM
2210
N
LEU
C
99
12.583
68.251
175.014
1.00
45.44
7


ATOM
2211
CA
LEU
C
99
12.486
67.196
176.014
1.00
44.79
6


ATOM
2212
CB
LEU
C
99
13.623
66.204
175.860
1.00
44.41
6


ATOM
2213
CG
LEU
C
99
13.490
65.159
174.761
1.00
43.50
6


ATOM
2214
CD1
LEU
C
99
14.792
64.418
174.654
1.00
43.91
6


ATOM
2215
CD2
LEU
C
99
12.369
64.187
175.061
1.00
42.42
6


ATOM
2216
C
LEU
C
99
12.467
67.774
177.422
1.00
44.79
6


ATOM
2217
O
LEU
C
99
11.629
67.394
178.244
1.00
44.36
8


ATOM
2218
N
LEU
C
100
13.380
68.708
177.684
1.00
44.88
7


ATOM
2219
CA
LEU
C
100
13.417
69.424
178.953
1.00
45.06
6


ATOM
2220
CB
LEU
C
100
14.531
70.459
178.946
1.00
44.71
6


ATOM
2221
CG
LEU
C
100
15.903
69.824
178.840
1.00
43.97
6


ATOM
2222
CD1
LEU
C
100
16.958
70.863
178.570
1.00
43.81
6


ATOM
2223
CD2
LEU
C
100
16.195
69.073
180.109
1.00
43.51
6


ATOM
2224
C
LEU
C
100
12.099
70.113
179.206
1.00
45.56
6


ATOM
2225
O
LEU
C
100
11.518
69.970
180.277
1.00
44.98
8


ATOM
2226
N
LYS
C
101
11.642
70.851
178.191
1.00
46.67
7


ATOM
2227
CA
LYS
C
101
10.376
71.586
178.223
1.00
48.03
6


ATOM
2228
CB
LYS
C
101
10.035
72.188
176.844
1.00
47.97
6


ATOM
2229
CG
LYS
C
101
8.770
73.083
176.818
1.00
48.91
6


ATOM
2230
CD
LYS
C
101
8.161
73.219
175.416
1.00
49.16
6


ATOM
2231
CE
LYS
C
101
8.738
74.396
174.640
1.00
51.06
6


ATOM
2232
NZ
LYS
C
101
8.521
74.238
173.174
1.00
51.85
7


ATOM
2233
C
LYS
C
101
9.256
70.669
178.683
1.00
48.34
6


ATOM
2234
O
LYS
C
101
8.460
71.038
179.533
1.00
48.37
8


ATOM
2235
N
HIS
C
102
9.211
69.467
178.121
1.00
49.10
7


ATOM
2236
CA
HIS
C
102
8.221
68.474
178.518
1.00
49.76
6


ATOM
2237
CB
HIS
C
102
7.949
67.504
177.364
1.00
50.06
6


ATOM
2238
CG
HIS
C
102
7.093
68.069
176.277
1.00
50.98
6


ATOM
2239
ND1
HIS
C
102
5.836
67.577
175.990
1.00
51.82
7


ATOM
2240
CE1
HIS
C
102
5.322
68.253
174.980
1.00
52.14
6


ATOM
2241
NE2
HIS
C
102
6.199
69.165
174.602
1.00
52.60
7


ATOM
2242
CD2
HIS
C
102
7.317
69.070
175.395
1.00
51.82
6


ATOM
2243
C
HIS
C
102
8.653
67.694
179.765
1.00
49.77
6


ATOM
2244
O
HIS
C
102
8.142
66.603
180.022
1.00
49.90
8


ATOM
2245
N
GLY
C
103
9.608
68.242
180.516
1.00
49.76
7


ATOM
2246
CA
GLY
C
103
9.953
67.728
181.839
1.00
49.69
6


ATOM
2247
C
GLY
C
103
10.832
66.494
181.890
1.00
49.55
6


ATOM
2248
O
GLY
C
103
10.753
65.719
182.844
1.00
49.94
8


ATOM
2249
N
ALA
C
104
11.670
66.293
180.880
1.00
49.09
7


ATOM
2250
CA
ALA
C
104
12.710
65.275
180.983
1.00
48.39
6


ATOM
2251
CB
ALA
C
104
13.644
65.325
179.774
1.00
48.65
6


ATOM
2252
C
ALA
C
104
13.489
65.504
182.276
1.00
47.83
6


ATOM
2253
O
ALA
C
104
13.787
66.640
182.645
1.00
47.75
8


ATOM
2254
N
ASP
C
105
13.786
64.424
182.976
1.00
47.34
7


ATOM
2255
CA
ASP
C
105
14.571
64.512
184.181
1.00
47.34
6


ATOM
2256
CB
ASP
C
105
14.344
63.246
185.000
1.00
47.94
6


ATOM
2257
CG
ASP
C
105
14.988
63.300
186.374
1.00
49.66
6


ATOM
2258
OD1
ASP
C
105
15.249
64.414
186.894
1.00
52.12
8


ATOM
2259
OD2
ASP
C
105
15.219
62.204
186.939
1.00
51.07
8


ATOM
2260
C
ASP
C
105
16.042
64.658
183.803
1.00
46.72
6


ATOM
2261
O
ASP
C
105
16.634
63.731
183.271
1.00
46.93
8


ATOM
2262
N
VAL
C
106
16.624
65.824
184.059
1.00
45.97
7


ATOM
2263
CA
VAL
C
106
18.026
66.081
183.721
1.00
45.49
6


ATOM
2264
CB
VAL
C
106
18.409
67.567
183.938
1.00
45.52
6


ATOM
2265
CG1
VAL
C
106
17.467
68.211
184.952
1.00
46.22
6


ATOM
2266
CG2
VAL
C
106
19.879
67.735
184.373
1.00
44.70
6


ATOM
2267
C
VAL
C
106
18.923
65.178
184.554
1.00
45.38
6


ATOM
2268
O
VAL
C
106
20.049
64.828
184.147
1.00
46.06
8


ATOM
2269
N
ASN
C
107
18.411
64.772
185.707
1.00
44.49
7


ATOM
2270
CA
ASN
C
107
19.209
63.989
186.635
1.00
43.88
6


ATOM
2271
CB
ASN
O
107
18.873
64.376
188.060
1.00
43.93
6


ATOM
2272
CG
ASN
C
107
19.599
65.601
188.465
1.00
44.00
6


ATOM
2273
OD1
ASN
C
107
20.613
65.960
187.840
1.00
43.75
8


ATOM
2274
ND2
ASN
C
107
19.095
66.284
189.484
1.00
43.61
7


ATOM
2275
C
ASN
C
107
19.138
62.498
186.457
1.00
43.34
6


ATOM
2276
O
ASN
C
107
19.879
61.745
187.096
1.00
43.48
8


ATOM
2277
N
ALA
C
108
18.242
62.069
185.586
1.00
42.63
7


ATOM
2278
CA
ALA
C
108
18.106
60.659
185.321
1.00
42.04
6


ATOM
2279
CB
ALA
C
108
16.959
60.410
184.365
1.00
42.24
6


ATOM
2280
C
ALA
C
108
19.431
60.101
184.785
1.00
41.75
6


ATOM
2281
O
ALA
C
108
20.115
60.735
183.940
1.00
41.66
8


ATOM
2282
N
GLN
C
109
19.794
58.932
185.314
1.00
41.20
7


ATOM
2283
CA
GLN
C
109
21.062
58.275
184.975
1.00
40.82
6


ATOM
2284
CB
GLN
C
109
22.000
58.258
186.195
1.00
40.78
6


ATOM
2285
CG
GLN
C
109
21.313
58.553
187.533
1.00
40.28
6


ATOM
2286
CD
GLN
C
109
22.289
58.666
188.701
1.00
40.51
6


ATOM
2287
OE1
GLN
C
109
21.885
58.969
189.822
1.00
41.49
8


ATOM
2288
NE2
GLN
C
109
23.570
58.425
188.446
1.00
39.36
7


ATOM
2289
C
GLN
C
109
20.919
56.877
184.344
1.00
40.48
6


ATOM
2290
O
GLN
C
109
20.026
56.110
184.692
1.00
40.71
8


ATOM
2291
N
ASP
C
110
21.795
56.565
183.397
1.00
40.06
7


ATOM
2292
CA
ASP
C
110
21.796
55.249
182.768
1.00
40.04
6


ATOM
2293
CB
ASP
C
110
22.547
55.289
181.444
1.00
40.23
6


ATOM
2294
CG
ASP
C
110
23.968
55.778
181.604
1.00
41.63
6


ATOM
2295
OD1
ASP
C
110
24.624
55.436
182.623
1.00
41.18
8


ATOM
2296
OD2
ASP
C
110
24.427
56.512
180.699
1.00
44.25
8


ATOM
2297
C
ASP
C
110
22.457
54.264
183.708
1.00
39.48
6


ATOM
2298
O
ASP
C
110
22.767
54.617
184.831
1.00
39.47
8


ATOM
2299
N
LYS
C
111
22.701
53.050
183.227
1.00
39.02
7


ATOM
2300
CA
LYS
C
111
23.208
51.961
184.056
1.00
38.58
6


ATOM
2301
CB
LYS
C
111
23.100
50.624
183.310
1.00
38.76
6


ATOM
2302
CG
LYS
C
111
24.258
50.323
182.325
1.00
38.60
6


ATOM
2303
CD
LYS
C
111
23.978
49.119
181.451
1.00
38.59
6


ATOM
2304
CE
LYS
C
111
25.226
48.269
181.331
1.00
40.61
6


ATOM
2305
NZ
LYS
C
111
25.109
47.136
180.357
1.00
41.56
7


ATOM
2306
C
LYS
C
111
24.640
52.172
184.538
1.00
38.35
6


ATOM
2307
O
LYS
C
111
25.102
51.443
185.401
1.00
38.35
8


ATOM
2308
N
PHE
C
112
25.348
53.149
183.975
1.00
38.15
7


ATOM
2309
CA
PHE
C
112
26.703
53.482
184.442
1.00
37.88
6


ATOM
2310
CB
PHE
C
112
27.620
53.815
183.260
1.00
37.96
6


ATOM
2311
CG
PHE
C
112
27.489
52.868
182.115
1.00
38.22
6


ATOM
2312
CD1
PHE
C
112
28.258
51.693
182.073
1.00
38.38
6


ATOM
2313
CE1
PHE
C
112
28.140
50.791
181.017
1.00
37.81
6


ATOM
2314
CZ
PHE
C
112
27.231
51.065
179.991
1.00
38.60
6


ATOM
2315
CE2
PHE
C
112
26.448
52.238
180.028
1.00
38.16
6


ATOM
2316
CD2
PHE
C
112
26.584
53.126
181.087
1.00
37.86
6


ATOM
2317
C
PHE
C
112
26.663
54.669
185.391
1.00
37.69
6


ATOM
2318
O
PHE
C
112
27.697
55.160
185.820
1.00
37.50
8


ATOM
2319
N
GLY
C
113
25.457
55.138
185.687
1.00
37.67
7


ATOM
2320
CA
GLY
C
113
25.254
56.335
186.484
1.00
37.58
6


ATOM
2321
C
GLY
C
113
25.480
57.664
185.775
1.00
37.44
6


ATOM
2322
O
GLY
C
113
25.557
58.708
186.437
1.00
37.78
8


ATOM
2323
N
LYS
C
114
25.589
57.643
184.448
1.00
37.00
7


ATOM
2324
CA
LYS
C
114
25.865
58.872
183.709
1.00
36.88
6


ATOM
2325
CB
LYS
C
114
26.584
58.582
182.405
1.00
36.44
6


ATOM
2326
CG
LYS
C
114
28.069
58.312
182.607
1.00
35.94
6


ATOM
2327
CD
LYS
C
114
28.843
58.493
181.312
1.00
34.40
6


ATOM
2328
CE
LYS
C
114
30.312
58.304
181.512
1.00
31.77
6


ATOM
2329
NZ
LYS
C
114
30.881
59.495
182.125
1.00
32.45
7


ATOM
2330
C
LYS
C
114
24.594
59.628
183.435
1.00
37.41
6


ATOM
2331
O
LYS
C
114
23.572
59.024
183.129
1.00
37.84
8


ATOM
2332
N
THR
C
115
24.649
60.946
183.559
1.00
38.00
7


ATOM
2333
CA
THR
C
115
23.508
61.796
183.233
1.00
38.74
6


ATOM
2334
CB
THR
C
115
23.352
62.921
184.254
1.00
38.86
6


ATOM
2335
OG1
THR
C
115
24.568
63.696
184.316
1.00
38.00
8


ATOM
2336
CG2
THR
C
115
23.046
62.324
185.617
1.00
38.98
6


ATOM
2337
C
THR
C
115
23.806
62.443
181.907
1.00
39.20
6


ATOM
2338
O
THR
C
115
24.978
62.489
181.501
1.00
39.29
8


ATOM
2339
N
ALA
C
116
22.780
62.973
181.239
1.00
39.35
7


ATOM
2340
CA
ALA
C
116
23.035
63.736
180.007
1.00
39.41
6


ATOM
2341
CB
ALA
C
116
21.764
64.388
179.475
1.00
39.66
6


ATOM
2342
C
ALA
C
116
24.153
64.776
180.192
1.00
39.29
6


ATOM
2343
O
ALA
C
116
25.015
64.906
179.324
1.00
39.10
8


ATOM
2344
N
PHE
C
117
24.158
65.484
181.328
1.00
39.22
7


ATOM
2345
CA
PHE
C
117
25.224
66.456
181.584
1.00
38.99
6


ATOM
2346
CB
PHE
C
117
25.097
67.146
182.938
1.00
38.75
6


ATOM
2347
CG
PHE
C
117
26.283
68.037
183.270
1.00
38.22
6


ATOM
2348
CD1
PHE
C
117
26.400
69.308
182.712
1.00
38.91
6


ATOM
2349
CE1
PHE
C
117
27.491
70.132
183.002
1.00
37.81
6


ATOM
2350
CZ
PHE
C
117
28.461
69.687
183.846
1.00
37.25
6


ATOM
2351
CE2
PHE
C
117
28.357
68.422
184.402
1.00
36.91
6


ATOM
2352
CD2
PHE
C
117
27.280
67.606
184.117
1.00
36.76
6


ATOM
2353
C
PHE
C
117
26.605
65.836
181.478
1.00
38.96
6


ATOM
2354
O
PHE
C
117
27.509
66.407
180.878
1.00
38.81
8


ATOM
2355
N
ASP
C
118
26.775
64.675
182.078
1.00
39.07
7


ATOM
2356
CA
ASP
C
118
28.040
64.010
181.963
1.00
39.54
6


ATOM
2357
CB
ASP
C
118
28.014
62.700
182.722
1.00
39.96
6


ATOM
2358
CG
ASP
C
118
27.830
62.904
184.201
1.00
41.79
6


ATOM
2359
OD1
ASP
C
118
28.352
63.903
184.749
1.00
43.06
8


ATOM
2360
OD2
ASP
C
118
27.162
62.055
184.819
1.00
44.49
8


ATOM
2361
C
ASP
C
118
28.344
63.801
180.493
1.00
39.20
6


ATOM
2362
O
ASP
C
118
29.375
64.262
179.996
1.00
39.16
8


ATOM
2363
N
ILE
C
119
27.416
63.149
179.795
1.00
38.64
7


ATOM
2364
CA
ILE
C
119
27.554
62.852
178.376
1.00
37.94
6


ATOM
2365
CB
ILE
C
119
26.228
62.367
177.807
1.00
37.56
6


ATOM
2366
CG1
ILE
C
119
26.032
60.908
178.186
1.00
37.32
6


ATOM
2367
CD
ILE
C
119
24.761
60.289
177.639
1.00
38.02
6


ATOM
2368
CG2
ILE
C
119
26.216
62.493
176.324
1.00
37.65
6


ATOM
2369
C
ILE
C
119
28.085
64.050
177.593
1.00
37.90
6


ATOM
2370
O
ILE
C
119
29.060
63.939
176.865
1.00
37.62
8


ATOM
2371
N
SER
C
120
27.462
65.203
177.783
1.00
38.22
7


ATOM
2372
CA
SER
C
120
27.850
66.417
177.067
1.00
38.94
6


ATOM
2373
CB
SER
C
120
26.886
67.539
177.388
1.00
39.23
6


ATOM
2374
OG
SER
C
120
26.699
67.588
178.792
1.00
41.18
8


ATOM
2375
C
SER
C
120
29.254
66.859
177.409
1.00
39.07
6


ATOM
2376
O
SER
C
120
29.989
67.304
176.533
1.00
38.94
8


ATOM
2377
N
ILE
C
121
29.610
66.749
178.690
1.00
39.44
7


ATOM
2378
CA
ILE
C
121
30.978
66.975
179.130
1.00
39.57
6


ATOM
2379
CB
ILE
C
121
31.075
66.847
180.642
1.00
39.30
6


ATOM
2380
CG1
ILE
C
121
30.477
68.094
181.284
1.00
39.30
6


ATOM
2381
CD
ILE
C
121
31.284
69.375
181.037
1.00
40.20
6


ATOM
2382
CG2
ILE
C
121
32.510
66.589
181.080
1.00
39.02
6


ATOM
2383
C
ILE
C
121
31.905
65.987
178.444
1.00
40.03
6


ATOM
2384
O
ILE
C
121
32.908
66.398
177.863
1.00
39.94
8


ATOM
2385
N
ASP
C
122
31.532
64.702
178.487
1.00
40.70
7


ATOM
2386
CA
ASP
C
122
32.362
63.612
177.955
1.00
41.46
6


ATOM
2387
CB
ASP
C
122
31.785
62.216
178.227
1.00
41.47
6


ATOM
2388
CG
ASP
C
122
31.816
61.860
179.689
1.00
42.33
6


ATOM
2389
OD1
ASP
C
122
30.866
61.206
180.158
1.00
42.98
8


ATOM
2390
OD2
ASP
C
122
32.774
62.265
180.380
1.00
43.75
8


ATOM
2391
C
ASP
C
122
32.645
63.766
176.492
1.00
41.62
6


ATOM
2392
O
ASP
C
122
33.742
63.464
176.064
1.00
42.05
8


ATOM
2393
N
ASN
C
123
31.694
64.222
175.698
1.00
41.91
7


ATOM
2394
CA
ASN
C
123
32.099
64.491
174.336
1.00
42.51
6


ATOM
2395
CB
ASN
C
123
31.347
63.674
173.255
1.00
42.56
6


ATOM
2396
CG
ASN
C
123
29.843
63.874
173.264
1.00
43.22
6


ATOM
2397
OD1
ASN
C
123
29.340
64.932
173.640
1.00
44.53
8


ATOM
2398
ND2
ASN
C
123
29.111
62.853
172.813
1.00
42.66
7


ATOM
2399
C
ASN
C
123
32.275
65.959
174.052
1.00
42.84
6


ATOM
2400
O
ASN
C
123
32.102
66.416
172.940
1.00
42.80
8


ATOM
2401
N
GLY
C
124
32.651
66.679
175.099
1.00
43.71
7


ATOM
2402
CA
GLY
C
124
33.152
68.041
174.979
1.00
44.95
6


ATOM
2403
C
GLY
C
124
32.221
69.059
174.367
1.00
45.71
6


ATOM
2404
O
GLY
C
124
32.664
70.095
173.931
1.00
45.65
8


ATOM
2405
N
ASN
C
125
30.928
68.768
174.344
1.00
46.94
7


ATOM
2406
CA
ASN
C
125
29.949
69.669
173.763
1.00
48.04
6


ATOM
2407
CB
ASN
C
125
28.818
68.855
173.107
1.00
47.86
6


ATOM
2408
CG
ASN
C
125
27.621
69.699
172.724
1.00
47.75
6


ATOM
2409
OD1
ASN
C
125
27.572
70.908
172.967
1.00
47.92
8


ATOM
2410
ND2
ASN
C
125
26.634
69.057
172.130
1.00
47.94
7


ATOM
2411
C
ASN
C
125
29.452
70.600
174.855
1.00
49.07
6


ATOM
2412
O
ASN
C
125
28.439
70.322
175.504
1.00
49.36
8


ATOM
2413
N
GLU
C
126
30.168
71.699
175.082
1.00
50.61
7


ATOM
2414
CA
GLU
C
126
29.826
72.527
176.249
1.00
52.32
6


ATOM
2415
CB
GLU
C
126
31.051
73.125
176.981
1.00
52.16
6


ATOM
2416
CG
GLU
C
126
31.394
74.555
176.620
1.00
53.52
6


ATOM
2417
CD
GLU
C
126
31.956
74.696
175.214
1.00
54.93
6


ATOM
2418
OE1
GLU
C
126
33.174
74.947
175.105
1.00
56.03
8


ATOM
2419
OE2
GLU
C
126
31.194
74.558
174.225
1.00
55.11
8


ATOM
2420
C
GLU
C
126
28.656
73.503
176.041
1.00
52.80
6


ATOM
2421
O
GLU
C
126
28.088
73.983
177.017
1.00
52.93
8


ATOM
2422
N
ASP
C
127
28.272
73.756
174.790
1.00
53.62
7


ATOM
2423
CA
ASP
C
127
27.014
74.453
174.526
1.00
54.39
6


ATOM
2424
CB
ASP
C
127
26.756
74.617
173.019
1.00
54.71
6


ATOM
2425
CG
ASP
C
127
27.574
75.748
172.397
1.00
55.52
6


ATOM
2426
OD1
ASP
C
127
28.495
76.257
173.079
1.00
56.85
8


ATOM
2427
OD2
ASP
C
127
27.299
76.123
171.228
1.00
56.04
8


ATOM
2428
C
ASP
C
127
25.885
73.680
175.198
1.00
54.69
6


ATOM
2429
O
ASP
C
127
25.122
74.261
175.976
1.00
54.92
8


ATOM
2430
N
LEU
C
128
25.826
72.372
174.916
1.00
54.90
7


ATOM
2431
CA
LEU
C
128
24.866
71.444
175.511
1.00
55.09
6


ATOM
2432
CB
LEU
C
128
25.130
70.034
175.003
1.00
55.04
6


ATOM
2433
CG
LEU
C
128
23.934
69.114
174.773
1.00
55.63
6


ATOM
2434
CD1
LEU
C
128
23.960
67.946
175.733
1.00
56.08
6


ATOM
2435
CD2
LEU
C
128
22.609
69.862
174.847
1.00
55.55
6


ATOM
2436
C
LEU
C
128
24.962
71.466
177.017
1.00
55.27
6


ATOM
2437
O
LEU
C
128
23.951
71.587
177.706
1.00
55.36
8


ATOM
2438
N
ALA
C
129
26.190
71.371
177.515
1.00
55.68
7


ATOM
2439
CA
ALA
C
129
26.460
71.434
178.948
1.00
56.41
6


ATOM
2440
CB
ALA
C
129
27.951
71.398
179.205
1.00
56.27
6


ATOM
2441
C
ALA
C
129
25.827
72.660
179.617
1.00
57.01
6


ATOM
2442
O
ALA
C
129
25.137
72.537
180.628
1.00
56.94
8


ATOM
2443
N
GLU
C
130
26.047
73.838
179.044
1.00
57.83
7


ATOM
2444
CA
GLU
C
130
25.456
75.049
179.591
1.00
58.73
6


ATOM
2445
CB
GLU
C
130
26.062
76.299
178.962
1.00
59.17
6


ATOM
2446
CG
GLU
C
130
27.411
76.674
179.549
1.00
61.40
6


ATOM
2447
CD
GLU
C
130
28.456
76.967
178.470
1.00
63.99
6


ATOM
2448
OE1
GLU
C
130
28.172
77.803
177.569
1.00
64.68
8


ATOM
2449
OE2
GLU
C
130
29.556
76.352
178.530
1.00
64.72
8


ATOM
2450
C
GLU
C
130
23.941
75.083
179.478
1.00
58.52
6


ATOM
2451
O
GLU
C
130
23.293
75.738
180.285
1.00
58.74
8


ATOM
2452
N
ILE
C
131
23.360
74.396
178.500
1.00
58.47
7


ATOM
2453
CA
ILE
C
131
21.909
74.401
178.437
1.00
58.57
6


ATOM
2454
CB
ILE
C
131
21.297
74.127
177.020
1.00
58.50
6


ATOM
2455
CG1
ILE
C
131
20.574
72.781
176.978
1.00
58.29
6


ATOM
2456
CD
ILE
C
131
19.296
72.819
176.189
1.00
58.30
6


ATOM
2457
CG2
ILE
C
131
22.318
74.297
175.893
1.00
57.78
6


ATOM
2458
C
ILE
C
131
21.381
73.441
179.484
1.00
58.97
6


ATOM
2459
O
ILE
C
131
20.226
73.514
179.878
1.00
59.06
8


ATOM
2460
N
LEU
C
132
22.240
72.554
179.955
1.00
59.62
7


ATOM
2461
CA
LEU
C
132
21.829
71.635
181.000
1.00
60.65
6


ATOM
2462
CB
LEU
C
132
22.459
70.253
180.777
1.00
60.38
6


ATOM
2463
CG
LEU
C
132
21.629
69.320
179.874
1.00
59.60
6


ATOM
2464
CD1
LEU
C
132
22.475
68.387
179.014
1.00
58.29
6


ATOM
2465
CD2
LEU
C
132
20.582
68.533
180.681
1.00
58.81
6


ATOM
2466
C
LEU
C
132
22.082
72.199
182.405
1.00
61.76
6


ATOM
2467
O
LEU
C
132
21.358
71.881
183.351
1.00
61.82
8


ATOM
2468
N
GLN
C
133
23.098
73.055
182.517
1.00
63.20
7


ATOM
2469
CA
GLN
C
133
23.368
73.828
183.734
1.00
64.65
6


ATOM
2470
CB
GLN
C
133
24.693
74.594
183.616
1.00
64.54
6


ATOM
2471
CG
GLN
C
133
25.919
73.732
183.599
1.00
64.14
6


ATOM
2472
CD
GLN
C
133
25.929
72.737
184.724
1.00
63.49
6


ATOM
2473
OE1
GLN
C
133
26.983
72.435
185.288
1.00
63.65
8


ATOM
2474
NE2
GLN
C
133
24.752
72.214
185.065
1.00
62.66
7


ATOM
2475
C
GLN
C
133
22.278
74.850
183.999
1.00
66.11
6


ATOM
2476
O
GLN
C
133
21.960
75.145
185.151
1.00
66.37
8


ATOM
2477
N
LYS
C
134
21.724
75.397
182.918
1.00
67.89
7


ATOM
2478
CA
LYS
C
134
20.731
76.469
182.977
1.00
69.50
6


ATOM
2479
CB
LYS
C
134
20.417
76.969
181.553
1.00
69.38
6


ATOM
2480
CG
LYS
C
134
20.526
78.476
181.327
1.00
69.23
6


ATOM
2481
CD
LYS
C
134
21.972
78.904
181.070
1.00
68.71
6


ATOM
2482
CE
LYS
C
134
22.099
79.745
179.806
1.00
68.48
6


ATOM
2483
NZ
LYS
C
134
21.155
80.901
179.749
1.00
68.07
7


ATOM
2484
C
LYS
C
134
19.446
76.001
183.677
1.00
70.74
6


ATOM
2485
O
LYS
C
134
18.473
76.771
183.775
1.00
71.11
8


ATOM
2486
N
LEU
C
135
19.453
74.751
184.166
1.00
72.01
7


ATOM
2487
CA
LEU
C
135
18.269
74.145
184.794
1.00
73.28
6


ATOM
2488
CB
LEU
C
135
17.948
72.771
184.192
1.00
73.24
6


ATOM
2489
CG
LEU
C
135
17.071
72.844
182.931
1.00
74.03
6


ATOM
2490
CD1
LEU
C
135
17.255
71.594
182.093
1.00
74.85
6


ATOM
2491
CD2
LEU
C
135
15.572
73.129
183.211
1.00
73.66
6


ATOM
2492
C
LEU
C
135
18.312
74.031
186.308
1.00
74.01
6


ATOM
2493
O
LEU
C
135
19.358
73.744
186.890
1.00
74.20
8


ATOM
2494
N
ASN
C
136
17.153
74.312
186.913
1.00
74.92
7


ATOM
2495
CA
ASN
C
136
16.761
73.874
188.252
1.00
75.40
6


ATOM
2496
CB
ASN
C
136
15.236
73.729
188.280
1.00
75.53
6


ATOM
2497
CG
ASN
C
136
14.652
73.218
186.927
1.00
76.44
6


ATOM
2498
OD1
ASN
C
136
13.745
73.849
186.366
1.00
77.16
8


ATOM
2499
ND2
ASN
C
136
15.175
72.081
186.411
1.00
76.82
7


ATOM
2500
C
ASN
C
136
17.384
72.536
188.634
1.00
75.59
6


ATOM
2501
O
ASN
C
136
17.386
71.574
187.845
1.00
75.85
8


ATOM
2502
N
SER
D
12
57.072
76.469
149.223
1.00
71.66
7


ATOM
2503
CA
SER
D
12
57.218
75.497
150.357
1.00
72.01
6


ATOM
2504
CB
SER
D
12
58.177
76.071
151.421
1.00
72.13
6


ATOM
2505
OG
SER
D
12
59.438
76.408
150.868
1.00
72.16
8


ATOM
2506
C
SER
D
12
55.865
75.183
151.012
1.00
71.64
6


ATOM
2507
O
SER
D
12
55.631
74.080
151.579
1.00
71.37
8


ATOM
2508
N
ASP
D
13
55.004
76.196
150.919
1.00
71.06
7


ATOM
2509
CA
ASP
D
13
53.670
76.236
151.512
1.00
70.55
6


ATOM
2510
CB
ASP
D
13
53.358
77.731
151.756
1.00
71.06
6


ATOM
2511
CG
ASP
D
13
52.015
77.989
152.458
1.00
72.21
6


ATOM
2512
OD1
ASP
D
13
52.045
78.420
153.649
1.00
73.06
8


ATOM
2513
OD2
ASP
D
13
50.947
77.817
151.802
1.00
71.77
8


ATOM
2514
C
ASP
D
13
52.684
75.523
150.545
1.00
69.48
6


ATOM
2515
O
ASP
D
13
51.462
75.430
150.785
1.00
69.05
8


ATOM
2516
N
LEU
D
14
53.254
75.029
149.441
1.00
68.09
7


ATOM
2517
CA
LEU
D
14
52.637
74.008
148.609
1.00
66.41
6


ATOM
2518
CB
LEU
D
14
53.666
73.437
147.636
1.00
66.29
6


ATOM
2519
CG
LEU
D
14
53.966
74.228
146.369
1.00
65.59
6


ATOM
2520
CD1
LEU
D
14
55.222
73.727
145.680
1.00
65.76
6


ATOM
2521
CD2
LEU
D
14
52.808
74.103
145.452
1.00
64.98
6


ATOM
2522
C
LEU
D
14
52.107
72.890
149.493
1.00
65.51
6


ATOM
2523
O
LEU
D
14
50.976
72.463
149.319
1.00
65.77
8


ATOM
2524
N
GLY
D
15
52.923
72.435
150.449
1.00
64.23
7


ATOM
2525
CA
GLY
D
15
52.501
71.453
151.460
1.00
62.41
6


ATOM
2526
C
GLY
D
15
51.178
71.709
152.174
1.00
61.18
6


ATOM
2527
O
GLY
D
15
50.329
70.828
152.243
1.00
60.79
8


ATOM
2528
N
LYS
D
16
50.994
72.918
152.698
1.00
60.20
7


ATOM
2529
CA
LYS
D
16
49.745
73.272
153.382
1.00
58.81
6


ATOM
2530
CB
LYS
D
16
49.862
74.629
154.071
1.00
58.79
6


ATOM
2531
CG
LYS
D
16
48.662
75.033
154.922
1.00
58.52
6


ATOM
2532
CD
LYS
D
16
48.936
76.320
155.708
1.00
58.76
6


ATOM
2533
CE
LYS
D
16
47.724
76.754
156.535
1.00
58.71
6


ATOM
2534
NZ
LYS
D
16
48.103
77.727
157.589
1.00
57.71
7


ATOM
2535
C
LYS
D
16
48.557
73.242
152.438
1.00
58.00
6


ATOM
2536
O
LYS
D
16
47.454
72.947
152.846
1.00
57.61
8


ATOM
2537
N
LYS
D
17
48.796
73.536
151.172
1.00
57.54
7


ATOM
2538
CA
LYS
D
17
47.756
73.458
150.144
1.00
57.33
6


ATOM
2539
CB
LYS
D
17
48.242
74.157
148.854
1.00
57.47
6


ATOM
2540
CG
LYS
D
17
48.360
75.682
148.918
1.00
57.59
6


ATOM
2541
CD
LYS
D
17
47.077
76.337
148.462
1.00
58.43
6


ATOM
2542
CE
LYS
D
17
46.732
77.561
149.310
1.00
60.29
6


ATOM
2543
NZ
LYS
D
17
46.653
78.874
148.554
1.00
61.03
7


ATOM
2544
C
LYS
D
17
47.346
71.995
149.843
1.00
56.68
6


ATOM
2545
O
LYS
D
17
46.162
71.648
149.756
1.00
56.26
8


ATOM
2546
N
LEU
D
18
48.348
71.147
149.677
1.00
56.01
7


ATOM
2547
CA
LEU
D
18
48.114
69.750
149.427
1.00
55.59
6


ATOM
2548
CB
LEU
D
18
49.432
69.015
149.255
1.00
55.04
6


ATOM
2549
CG
LEU
D
18
49.290
67.529
148.944
1.00
54.58
6


ATOM
2550
CD1
LEU
D
18
48.236
67.250
147.865
1.00
54.03
6


ATOM
2551
CD2
LEU
D
18
50.633
66.931
148.538
1.00
55.07
6


ATOM
2552
C
LEU
D
18
47.297
69.128
150.550
1.00
55.76
6


ATOM
2553
O
LEU
D
18
46.322
68.403
150.297
1.00
55.89
8


ATOM
2554
N
LEU
D
19
47.683
69.423
151.787
1.00
55.74
7


ATOM
2555
CA
LEU
D
19
46.954
68.918
152.937
1.00
55.74
6


ATOM
2556
CB
LEU
D
19
47.542
69.451
154.244
1.00
55.23
6


ATOM
2557
CG
LEU
D
19
48.845
68.723
154.600
1.00
54.59
6


ATOM
2558
CD1
LEU
D
19
49.729
69.448
155.607
1.00
53.41
6


ATOM
2559
CD2
LEU
D
19
48.542
67.307
155.067
1.00
54.86
6


ATOM
2560
C
LEU
D
19
45.485
69.257
152.784
1.00
56.26
6


ATOM
2561
O
LEU
D
19
44.638
68.355
152.778
1.00
55.97
8


ATOM
2562
N
GLU
D
20
45.202
70.547
152.588
1.00
56.94
7


ATOM
2563
CA
GLU
D
20
43.822
71.035
152.464
1.00
58.02
6


ATOM
2564
CB
GLU
D
20
43.769
72.578
152.421
1.00
57.73
6


ATOM
2565
CG
GLU
D
20
44.234
73.253
153.754
1.00
60.07
6


ATOM
2566
CD
GLU
D
20
44.638
74.769
153.653
1.00
61.13
6


ATOM
2567
OE1
GLU
D
20
45.124
75.269
152.589
1.00
64.85
8


ATOM
2568
OE2
GLU
D
20
44.488
75.469
154.684
1.00
64.45
8


ATOM
2569
C
GLU
D
20
43.065
70.370
151.300
1.00
57.32
6


ATOM
2570
O
GLU
D
20
41.883
70.032
151.434
1.00
57.14
8


ATOM
2571
N
ALA
D
21
43.762
70.136
150.189
1.00
56.99
7


ATOM
2572
CA
ALA
D
21
43.118
69.578
149.017
1.00
56.48
6


ATOM
2573
CB
ALA
D
21
43.973
69.769
147.815
1.00
56.52
6


ATOM
2574
C
ALA
D
21
42.822
68.118
149.263
1.00
56.48
6


ATOM
2575
O
ALA
D
21
41.782
67.619
148.845
1.00
56.37
8


ATOM
2576
N
ALA
D
22
43.723
67.439
149.971
1.00
56.56
7


ATOM
2577
CA
ALA
D
22
43.479
66.051
150.345
1.00
56.55
6


ATOM
2578
CB
ALA
D
22
44.715
65.424
150.925
1.00
56.59
6


ATOM
2579
C
ALA
D
22
42.276
65.909
151.288
1.00
56.59
6


ATOM
2580
O
ALA
D
22
41.430
65.070
151.049
1.00
56.50
8


ATOM
2581
N
ARG
D
23
42.173
66.740
152.325
1.00
56.73
7


ATOM
2582
CA
ARG
D
23
40.974
66.729
153.182
1.00
57.41
6


ATOM
2583
CB
ARG
D
23
41.049
67.803
154.286
1.00
57.14
6


ATOM
2584
CG
ARG
D
23
39.795
67.850
155.195
1.00
57.96
6


ATOM
2585
CD
ARG
D
23
39.749
69.085
156.109
1.00
59.45
6


ATOM
2586
NE
ARG
D
23
40.494
68.922
157.373
1.00
64.37
7


ATOM
2587
CZ
ARG
D
23
41.731
69.385
157.623
1.00
65.22
6


ATOM
2588
NH1
ARG
D
23
42.439
70.068
156.707
1.00
64.16
7


ATOM
2589
NH2
ARG
D
23
42.272
69.151
158.812
1.00
64.98
7


ATOM
2590
C
ARG
D
23
39.690
66.928
152.364
1.00
57.10
6


ATOM
2591
O
ARG
D
23
38.664
66.275
152.587
1.00
56.90
8


ATOM
2592
N
ALA
D
24
39.770
67.836
151.408
1.00
57.16
7


ATOM
2593
CA
ALA
D
24
38.597
68.296
150.720
1.00
57.23
6


ATOM
2594
CB
ALA
D
24
38.868
69.626
150.087
1.00
57.24
6


ATOM
2595
C
ALA
D
24
38.113
67.306
149.687
1.00
57.52
6


ATOM
2596
O
ALA
D
24
36.926
67.254
149.399
1.00
57.76
8


ATOM
2597
N
GLY
D
25
39.019
66.515
149.131
1.00
57.87
7


ATOM
2598
CA
GLY
D
25
38.652
65.638
148.028
1.00
58.24
6


ATOM
2599
C
GLY
D
25
38.828
66.258
146.647
1.00
58.65
6


ATOM
2600
O
GLY
D
25
38.422
65.671
145.653
1.00
58.41
8


ATOM
2601
N
GLN
D
26
39.449
67.431
146.576
1.00
59.14
7


ATOM
2602
CA
GLN
D
26
39.786
68.038
145.304
1.00
60.00
6


ATOM
2603
CB
GLN
D
26
40.098
69.505
145.513
1.00
60.16
6


ATOM
2604
CG
GLN
D
26
39.250
70.142
146.605
1.00
61.63
6


ATOM
2605
CD
GLN
D
26
37.923
70.738
146.128
1.00
64.20
6


ATOM
2606
OE1
GLN
D
26
37.344
70.323
145.114
1.00
65.91
8


ATOM
2607
NE2
GLN
D
26
37.427
71.719
146.879
1.00
64.88
7


ATOM
2608
C
GLN
D
26
40.932
67.292
144.596
1.00
60.60
6


ATOM
2609
O
GLN
D
26
42.117
67.608
144.765
1.00
60.40
8


ATOM
2610
N
ASP
D
27
40.549
66.291
143.799
1.00
61.48
7


ATOM
2611
CA
ASP
D
27
41.500
65.421
143.102
1.00
62.13
6


ATOM
2612
CB
ASP
D
27
40.830
64.190
142.480
1.00
62.51
6


ATOM
2613
CG
ASP
D
27
39.481
63.858
143.110
1.00
64.47
6


ATOM
2614
OD1
ASP
D
27
39.342
62.777
143.749
1.00
66.51
8


ATOM
2615
OD2
ASP
D
27
38.549
64.682
142.952
1.00
66.12
8


ATOM
2616
C
ASP
D
27
42.302
66.159
142.045
1.00
62.16
6


ATOM
2617
O
ASP
D
27
43.477
65.864
141.879
1.00
62.57
8


ATOM
2618
N
ASP
D
28
41.694
67.103
141.335
1.00
61.96
7


ATOM
2619
CA
ASP
D
28
42.454
67.896
140.390
1.00
62.30
6


ATOM
2620
CB
ASP
D
28
41.548
68.786
139.591
1.00
62.90
6


ATOM
2621
CG
ASP
D
28
40.866
68.041
138.496
1.00
65.47
6


ATOM
2622
OD1
ASP
D
28
41.244
66.857
138.274
1.00
67.62
8


ATOM
2623
OD2
ASP
D
28
39.951
68.633
137.867
1.00
66.86
8


ATOM
2624
C
ASP
D
28
43.452
68.759
141.077
1.00
61.98
6


ATOM
2625
O
ASP
D
28
44.583
68.863
140.629
1.00
62.11
8


ATOM
2626
N
GLU
D
29
43.011
69.392
142.159
1.00
61.73
7


ATOM
2627
CA
GLU
D
29
43.860
70.228
142.999
1.00
61.32
6


ATOM
2628
CB
GLU
D
29
43.061
70.738
144.204
1.00
61.59
6


ATOM
2629
CG
GLU
D
29
42.714
72.205
144.181
1.00
63.74
6


ATOM
2630
CD
GLU
D
29
43.975
73.058
144.244
1.00
68.32
6


ATOM
2631
OE1
GLU
D
29
44.634
73.193
143.176
1.00
69.59
8


ATOM
2632
OE2
GLU
D
29
44.318
73.579
145.350
1.00
69.36
8


ATOM
2633
C
GLU
D
29
45.073
69.437
143.467
1.00
60.51
6


ATOM
2634
O
GLU
D
29
46.201
69.941
143.456
1.00
60.69
8


ATOM
2635
N
VAL
D
30
44.832
68.188
143.858
1.00
59.25
7


ATOM
2636
CA
VAL
D
30
45.892
67.313
144.306
1.00
58.04
6


ATOM
2637
CB
VAL
D
30
45.315
65.986
144.832
1.00
57.79
6


ATOM
2638
CG1
VAL
D
30
46.428
65.005
145.224
1.00
57.27
6


ATOM
2639
CG2
VAL
D
30
44.446
66.260
146.021
1.00
57.41
6


ATOM
2640
C
VAL
D
30
46.896
67.106
143.176
1.00
57.60
6


ATOM
2641
O
VAL
D
30
48.079
67.355
143.333
1.00
57.42
8


ATOM
2642
N
ARG
D
31
46.386
66.695
142.031
1.00
57.24
7


ATOM
2643
CA
ARG
D
31
47.159
66.392
140.843
1.00
57.14
6


ATOM
2644
CB
ARG
D
31
46.153
66.085
139.757
1.00
57.14
6


ATOM
2645
CG
ARG
D
31
46.359
64.798
139.064
1.00
58.78
6


ATOM
2646
CD
ARG
D
31
45.099
64.491
138.286
1.00
61.86
6


ATOM
2647
NE
ARG
D
31
44.077
63.782
139.076
1.00
63.51
7


ATOM
2648
CZ
ARG
D
31
42.771
63.758
138.777
1.00
63.63
6


ATOM
2649
NH1
ARG
D
31
42.294
64.425
137.725
1.00
62.62
7


ATOM
2650
NH2
ARG
D
31
41.927
63.072
139.540
1.00
64.17
7


ATOM
2651
C
ARG
D
31
47.989
67.576
140.385
1.00
56.73
6


ATOM
2652
O
ARG
D
31
49.127
67.430
139.911
1.00
56.39
8


ATOM
2653
N
ILE
D
32
47.373
68.749
140.512
1.00
56.50
7


ATOM
2654
CA
ILE
D
32
47.971
70.008
140.126
1.00
56.15
6


ATOM
2655
CB
ILE
D
32
46.921
71.142
140.059
1.00
56.07
6


ATOM
2656
CG1
ILE
D
32
45.991
70.962
138.858
1.00
55.42
6


ATOM
2657
CD
ILE
D
32
44.830
71.940
138.839
1.00
55.57
6


ATOM
2658
CG2
ILE
D
32
47.590
72.487
139.926
1.00
56.57
6


ATOM
2659
C
ILE
D
32
49.106
70.337
141.083
1.00
56.23
6


ATOM
2660
O
ILE
D
32
50.166
70.757
140.646
1.00
56.54
8


ATOM
2661
N
LEU
D
33
48.898
70.118
142.379
1.00
56.26
7


ATOM
2662
CA
LEU
D
33
49.977
70.265
143.370
1.00
56.10
6


ATOM
2663
CB
LEU
D
33
49.409
70.214
144.767
1.00
55.63
6


ATOM
2664
CG
LEU
D
33
48.540
71.432
144.996
1.00
55.06
6


ATOM
2665
CD1
LEU
D
33
47.580
71.158
146.123
1.00
56.17
6


ATOM
2666
CD2
LEU
D
33
49.414
72.611
145.297
1.00
53.85
6


ATOM
2667
C
LEU
D
33
51.102
69.244
143.206
1.00
56.15
6


ATOM
2668
O
LEU
D
33
52.262
69.548
143.385
1.00
56.01
8


ATOM
2669
N
MET
D
34
50.748
68.031
142.841
1.00
56.56
7


ATOM
2670
CA
MET
D
34
51.736
67.056
142.472
1.00
57.10
6


ATOM
2671
CB
MET
D
34
51.065
65.756
142.042
1.00
57.30
6


ATOM
2672
CG
MET
D
34
50.190
65.176
143.142
1.00
58.41
6


ATOM
2673
SD
MET
D
34
51.150
64.520
144.521
1.00
62.08
16


ATOM
2674
CE
MET
D
34
51.913
65.938
145.301
1.00
60.18
6


ATOM
2675
C
MET
D
34
52.602
67.611
141.369
1.00
57.05
6


ATOM
2676
O
MET
D
34
53.819
67.665
141.512
1.00
57.43
8


ATOM
2677
N
ALA
D
35
51.969
68.044
140.284
1.00
56.82
7


ATOM
2678
CA
ALA
D
35
52.677
68.571
139.123
1.00
56.49
6


ATOM
2679
CB
ALA
D
35
51.696
69.124
138.129
1.00
56.34
6


ATOM
2680
C
ALA
D
35
53.673
69.646
139.523
1.00
56.33
6


ATOM
2681
O
ALA
D
35
54.782
69.673
139.000
1.00
56.69
8


ATOM
2682
N
ASN
D
36
53.268
70.510
140.458
1.00
55.73
7


ATOM
2683
CA
ASN
D
36
54.103
71.565
141.007
1.00
54.98
6


ATOM
2684
CB
ASN
D
36
53.235
72.595
141.649
1.00
54.62
6


ATOM
2685
CG
ASN
D
36
52.666
73.508
140.666
1.00
55.34
6


ATOM
2686
OD1
ASN
D
36
53.399
74.244
140.014
1.00
57.80
8


ATOM
2687
ND2
ASN
D
36
51.347
73.483
140.519
1.00
54.88
7


ATOM
2688
C
ASN
D
36
55.042
71.098
142.067
1.00
54.87
6


ATOM
2689
O
ASN
D
36
55.607
71.921
142.786
1.00
55.18
8


ATOM
2690
N
GLY
D
37
55.171
69.782
142.192
1.00
54.57
7


ATOM
2691
CA
GLY
D
37
56.092
69.159
143.128
1.00
54.08
6


ATOM
2692
C
GLY
D
37
55.829
69.345
144.613
1.00
53.79
6


ATOM
2693
O
GLY
D
37
56.765
69.369
145.391
1.00
53.85
8


ATOM
2694
N
ALA
D
38
54.568
69.469
145.019
1.00
53.57
7


ATOM
2695
CA
ALA
D
38
54.216
69.541
146.440
1.00
53.06
6


ATOM
2696
CB
ALA
D
38
52.723
69.626
146.618
1.00
52.86
6


ATOM
2697
C
ALA
D
38
54.738
68.300
147.118
1.00
52.85
6


ATOM
2698
O
ALA
D
38
54.835
67.247
146.473
1.00
53.01
8


ATOM
2699
N
ASP
D
39
55.081
68.425
148.401
1.00
52.44
7


ATOM
2700
CA
ASP
D
39
55.623
67.309
149.166
1.00
52.26
6


ATOM
2701
CB
ASP
D
39
56.372
67.809
150.393
1.00
52.02
6


ATOM
2702
CG
ASP
D
39
56.714
66.686
151.388
1.00
53.04
6


ATOM
2703
OD1
ASP
D
39
56.710
65.472
151.040
1.00
52.47
8


ATOM
2704
OD2
ASP
D
39
57.001
67.037
152.548
1.00
54.96
8


ATOM
2705
C
ASP
D
39
54.522
66.343
149.591
1.00
52.11
6


ATOM
2706
O
ASP
D
39
53.676
66.690
150.427
1.00
52.33
8


ATOM
2707
N
VAL
D
40
54.568
65.123
149.046
1.00
51.38
7


ATOM
2708
CA
VAL
D
40
53.517
64.135
149.254
1.00
50.70
6


ATOM
2709
CB
VAL
D
40
53.732
62.874
148.342
1.00
50.57
6


ATOM
2710
CG1
VAL
D
40
54.702
61.950
148.948
1.00
50.64
6


ATOM
2711
CG2
VAL
D
40
52.451
62.121
148.097
1.00
50.05
6


ATOM
2712
C
VAL
D
40
53.422
63.785
150.741
1.00
50.44
6


ATOM
2713
O
VAL
D
40
52.436
63.206
151.196
1.00
50.33
8


ATOM
2714
N
ASN
D
41
54.433
64.173
151.506
1.00
50.12
7


ATOM
2715
CA
ASN
D
41
54.445
63.833
152.919
1.00
50.06
6


ATOM
2716
CB
ASN
D
41
55.639
62.941
153.247
1.00
49.98
6


ATOM
2717
CG
ASN
D
41
55.477
61.547
152.697
1.00
49.62
6


ATOM
2718
OD1
ASN
D
41
54.365
61.091
152.439
1.00
50.47
8


ATOM
2719
ND2
ASN
D
41
56.584
60.865
152.502
1.00
49.83
7


ATOM
2720
C
ASN
D
41
54.339
64.973
153.900
1.00
50.08
6


ATOM
2721
O
ASN
D
41
54.575
64.801
155.088
1.00
50.24
8


ATOM
2722
N
ALA
D
42
53.955
66.136
153.412
1.00
50.00
7


ATOM
2723
CA
ALA
D
42
53.717
67.262
154.284
1.00
50.36
6


ATOM
2724
CB
ALA
D
42
52.917
68.259
153.525
1.00
50.44
6


ATOM
2725
C
ALA
D
42
52.970
66.859
155.581
1.00
50.66
6


ATOM
2726
O
ALA
D
42
51.997
66.086
155.496
1.00
51.10
8


ATOM
2727
N
ASN
D
43
53.412
67.351
156.758
1.00
50.17
7


ATOM
2728
CA
ASN
D
43
52.612
67.199
158.000
1.00
49.75
6


ATOM
2729
CB
ASN
D
43
53.467
66.907
159.219
1.00
50.10
6


ATOM
2730
CG
ASN
D
43
54.285
65.667
159.078
1.00
51.24
6


ATOM
2731
OD1
ASN
D
43
54.319
65.069
158.000
1.00
53.03
8


ATOM
2732
ND2
ASN
D
43
54.980
65.269
160.166
1.00
51.07
7


ATOM
2733
C
ASN
D
43
51.822
68.432
158.347
1.00
49.34
6


ATOM
2734
O
ASN
D
43
52.269
69.538
158.073
1.00
49.80
8


ATOM
2735
N
ASP
D
44
50.665
68.249
158.975
1.00
48.59
7


ATOM
2736
CA
ASP
D
44
49.991
69.351
159.642
1.00
48.29
6


ATOM
2737
CB
ASP
D
44
48.491
69.140
159.620
1.00
48.73
6


ATOM
2738
CG
ASP
D
44
48.062
67.918
160.408
1.00
51.34
6


ATOM
2739
OD1
ASP
D
44
48.877
67.308
161.140
1.00
53.22
8


ATOM
2740
OD2
ASP
D
44
46.876
67.563
160.298
1.00
54.79
8


ATOM
2741
C
ASP
D
44
50.535
69.382
161.065
1.00
47.49
6


ATOM
2742
O
ASP
D
44
51.431
68.616
161.372
1.00
47.43
8


ATOM
2743
N
ARG
D
45
50.023
70.233
161.952
1.00
46.84
7


ATOM
2744
CA
ARG
D
45
50.706
70.332
163.251
1.00
46.04
6


ATOM
2745
CB
ARG
D
45
50.417
71.600
164.059
1.00
45.97
6


ATOM
2746
CG
ARG
D
45
49.075
71.701
164.644
1.00
45.40
6


ATOM
2747
CD
ARG
D
45
49.037
72.816
165.619
1.00
43.85
6


ATOM
2748
NE
ARG
D
45
48.817
72.309
166.953
1.00
43.16
7


ATOM
2749
CZ
ARG
D
45
47.688
71.747
167.369
1.00
43.41
6


ATOM
2750
NH1
ARG
D
45
46.667
71.579
166.555
1.00
44.48
7


ATOM
2751
NH2
ARG
D
45
47.579
71.329
168.613
1.00
44.79
7


ATOM
2752
C
ARG
D
45
50.540
69.121
164.093
1.00
45.37
6


ATOM
2753
O
ARG
D
45
51.354
68.888
164.962
1.00
45.16
8


ATOM
2754
N
LYS
D
46
49.511
68.332
163.832
1.00
44.85
7


ATOM
2755
CA
LYS
D
46
49.412
67.077
164.535
1.00
44.82
6


ATOM
2756
CB
LYS
D
46
48.093
66.936
165.275
1.00
44.58
6


ATOM
2757
CG
LYS
D
46
47.004
67.704
164.632
1.00
47.35
6


ATOM
2758
CD
LYS
D
46
45.649
67.019
164.834
1.00
52.56
6


ATOM
2759
CE
LYS
D
46
44.959
67.475
166.138
1.00
53.29
6


ATOM
2760
NZ
LYS
D
46
45.855
67.391
167.329
1.00
53.75
7


ATOM
2761
C
LYS
D
46
49.759
65.878
163.643
1.00
44.52
6


ATOM
2762
O
LYS
D
46
49.085
64.841
163.681
1.00
44.87
8


ATOM
2763
N
GLY
D
47
50.838
66.033
162.867
1.00
44.00
7


ATOM
2764
CA
GLY
D
47
51.527
64.936
162.185
1.00
43.24
6


ATOM
2765
C
GLY
D
47
50.797
64.191
161.082
1.00
43.13
6


ATOM
2766
O
GLY
D
47
51.317
63.211
160.536
1.00
43.35
8


ATOM
2767
N
ASN
D
48
49.592
64.630
160.750
1.00
42.76
7


ATOM
2768
CA
ASN
D
48
48.877
64.046
159.643
1.00
42.83
6


ATOM
2769
CB
ASN
D
48
47.467
64.600
159.611
1.00
43.56
6


ATOM
2770
CG
ASN
D
48
46.596
64.019
160.720
1.00
47.03
6


ATOM
2771
OD1
ASN
D
48
46.662
62.790
161.032
1.00
50.61
8


ATOM
2772
ND2
ASN
D
48
45.782
64.886
161.344
1.00
48.47
7


ATOM
2773
C
ASN
D
48
49.568
64.303
158.325
1.00
42.22
6


ATOM
2774
O
ASN
D
48
50.169
65.342
158.144
1.00
42.65
8


ATOM
2775
N
THR
D
49
49.513
63.347
157.416
1.00
41.68
7


ATOM
2776
CA
THR
D
49
49.959
63.581
156.057
1.00
41.50
6


ATOM
2777
CB
THR
D
49
50.777
62.403
155.517
1.00
41.96
6


ATOM
2778
OG1
THR
D
49
49.956
61.221
155.443
1.00
41.45
8


ATOM
2779
CG2
THR
D
49
52.039
62.166
156.362
1.00
42.52
6


ATOM
2780
C
THR
D
49
48.743
63.717
155.162
1.00
41.13
6


ATOM
2781
O
THR
D
49
47.621
63.473
155.591
1.00
41.16
8


ATOM
2782
N
PRO
D
50
48.956
64.100
153.905
1.00
40.74
7


ATOM
2783
CA
PRO
D
50
47.848
64.047
152.975
1.00
40.47
6


ATOM
2784
CB
PRO
D
50
48.507
64.273
151.632
1.00
40.26
6


ATOM
2785
CG
PRO
D
50
49.719
65.051
151.962
1.00
40.72
6


ATOM
2786
CD
PRO
D
50
50.190
64.592
153.281
1.00
40.54
6


ATOM
2787
C
PRO
D
50
47.216
62.675
152.978
1.00
40.30
6


ATOM
2788
O
PRO
D
50
45.981
62.588
152.989
1.00
40.43
8


ATOM
2789
N
LEU
D
51
48.031
61.613
152.991
1.00
39.72
7


ATOM
2790
CA
LEU
D
51
47.459
60.272
152.922
1.00
39.50
6


ATOM
2791
CB
LEU
D
51
48.498
59.178
152.655
1.00
39.61
6


ATOM
2792
CG
LEU
D
51
48.005
57.711
152.693
1.00
39.41
6


ATOM
2793
CD1
LEU
D
51
47.220
57.340
151.464
1.00
38.04
6


ATOM
2794
CD2
LEU
D
51
49.126
56.692
152.932
1.00
39.18
6


ATOM
2795
C
LEU
D
51
46.615
59.971
154.154
1.00
39.58
6


ATOM
2796
O
LEU
D
51
45.551
59.383
154.022
1.00
39.70
8


ATOM
2797
N
HIS
D
52
47.063
60.389
155.334
1.00
39.49
7


ATOM
2798
CA
HIS
D
52
46.198
60.367
156.501
1.00
39.72
6


ATOM
2799
CB
HIS
D
52
46.792
61.139
157.664
1.00
39.89
6


ATOM
2800
CG
HIS
D
52
47.821
60.384
158.438
1.00
42.02
6


ATOM
2801
ND1
HIS
D
52
49.143
60.777
158.500
1.00
43.64
7


ATOM
2802
CE1
HIS
D
52
49.815
59.933
159.261
1.00
44.05
6


ATOM
2803
NE2
HIS
D
52
48.978
59.005
159.694
1.00
43.73
7


ATOM
2804
CD2
HIS
D
52
47.724
59.267
159.197
1.00
43.38
6


ATOM
2805
C
HIS
D
52
44.871
61.017
156.172
1.00
39.71
6


ATOM
2806
O
HIS
D
52
43.827
60.372
156.258
1.00
39.97
8


ATOM
2807
N
LEU
D
53
44.886
62.292
155.795
1.00
39.54
7


ATOM
2808
CA
LEU
D
53
43.622
63.000
155.682
1.00
39.69
6


ATOM
2809
CB
LEU
D
53
43.801
64.482
155.395
1.00
39.80
6


ATOM
2810
CG
LEU
D
53
44.704
65.268
156.330
1.00
40.31
6


ATOM
2811
CD1
LEU
D
53
44.856
66.684
155.821
1.00
41.23
6


ATOM
2812
CD2
LEU
D
53
44.162
65.251
157.754
1.00
41.39
6


ATOM
2813
C
LEU
D
53
42.760
62.368
154.626
1.00
39.96
6


ATOM
2814
O
LEU
D
53
41.546
62.239
154.817
1.00
40.69
8


ATOM
2815
N
ALA
D
54
43.370
61.949
153.526
1.00
39.83
7


ATOM
2816
CA
ALA
D
54
42.590
61.323
152.474
1.00
40.18
6


ATOM
2817
CB
ALA
D
54
43.438
61.085
151.280
1.00
40.73
6


ATOM
2818
C
ALA
D
54
41.937
60.022
152.963
1.00
40.43
6


ATOM
2819
O
ALA
D
54
40.779
59.734
152.637
1.00
40.45
8


ATOM
2820
N
ALA
D
55
42.675
59.247
153.755
1.00
40.53
7


ATOM
2821
CA
ALA
D
55
42.098
58.085
154.427
1.00
40.76
6


ATOM
2822
CB
ALA
D
55
43.144
57.367
155.255
1.00
40.58
6


ATOM
2823
C
ALA
D
55
40.962
58.548
155.312
1.00
41.05
6


ATOM
2824
O
ALA
D
55
39.850
58.050
155.209
1.00
41.23
8


ATOM
2825
N
ASP
D
56
41.256
59.528
156.161
1.00
41.19
7


ATOM
2826
CA
ASP
D
56
40.314
60.038
157.130
1.00
41.51
6


ATOM
2827
CB
ASP
D
56
40.938
61.226
157.874
1.00
41.73
6


ATOM
2828
CG
ASP
D
56
40.240
61.512
159.199
1.00
43.95
6


ATOM
2829
OD1
ASP
D
56
39.016
61.797
159.198
1.00
46.40
8


ATOM
2830
OD2
ASP
D
56
40.905
61.454
160.260
1.00
46.26
8


ATOM
2831
C
ASP
D
56
38.942
60.394
156.534
1.00
41.43
6


ATOM
2832
O
ASP
D
56
37.928
60.204
157.200
1.00
41.20
8


ATOM
2833
N
TYR
D
57
38.917
60.882
155.286
1.00
41.74
7


ATOM
2834
CA
TYR
D
57
37.680
61.416
154.640
1.00
42.19
6


ATOM
2835
CB
TYR
D
57
37.930
62.869
154.209
1.00
41.96
6


ATOM
2836
CG
TYR
D
57
38.023
63.787
155.379
1.00
41.76
6


ATOM
2837
CD1
TYR
D
57
39.115
63.738
156.230
1.00
41.22
6


ATOM
2838
CE1
TYR
D
57
39.200
64.562
157.336
1.00
41.61
6


ATOM
2839
CZ
TYR
D
57
38.186
65.460
157.601
1.00
42.46
6


ATOM
2840
OH
TYR
D
57
38.294
66.277
158.703
1.00
43.34
8


ATOM
2841
CE2
TYR
D
57
37.072
65.531
156.773
1.00
42.25
6


ATOM
2842
CD2
TYR
D
57
36.998
64.685
155.668
1.00
42.19
6


ATOM
2843
C
TYR
D
57
37.206
60.585
153.433
1.00
42.47
6


ATOM
2844
O
TYR
D
57
36.822
61.132
152.411
1.00
42.33
8


ATOM
2845
N
ASP
D
58
37.185
59.267
153.587
1.00
43.05
7


ATOM
2846
CA
ASP
D
58
37.600
58.402
152.491
1.00
43.89
6


ATOM
2847
CB
ASP
D
58
37.034
56.984
152.575
1.00
43.92
6


ATOM
2848
CG
ASP
D
58
35.583
56.954
152.365
1.00
44.00
6


ATOM
2849
OD1
ASP
D
58
35.018
58.054
152.376
1.00
44.16
8


ATOM
2850
OD2
ASP
D
58
35.015
55.863
152.174
1.00
44.65
8


ATOM
2851
C
ASP
D
58
37.481
59.024
151.103
1.00
44.35
6


ATOM
2852
O
ASP
D
58
36.404
59.294
150.583
1.00
43.98
8


ATOM
2853
N
HIS
D
59
38.656
59.241
150.541
1.00
45.45
7


ATOM
2854
CA
HIS
D
59
38.826
59.765
149.223
1.00
46.45
6


ATOM
2855
CB
HIS
D
59
39.527
61.111
149.332
1.00
46.36
6


ATOM
2856
CG
HIS
D
59
38.633
62.201
149.837
1.00
47.07
6


ATOM
2857
ND1
HIS
D
59
37.352
62.387
149.369
1.00
47.38
7


ATOM
2858
CE1
HIS
D
59
36.801
63.417
149.986
1.00
47.75
6


ATOM
2859
NE2
HIS
D
59
37.680
63.913
150.835
1.00
47.98
7


ATOM
2860
CD2
HIS
D
59
38.835
63.170
150.761
1.00
48.40
6


ATOM
2861
C
HIS
D
59
39.661
58.742
148.492
1.00
46.98
6


ATOM
2862
O
HIS
D
59
40.877
58.879
148.377
1.00
47.24
8


ATOM
2863
N
LEU
D
60
38.989
57.703
148.019
1.00
47.63
7


ATOM
2864
CA
LEU
D
60
39.667
56.527
147.508
1.00
48.47
6


ATOM
2865
CB
LEU
D
60
38.676
55.559
146.854
1.00
48.69
6


ATOM
2866
CG
LEU
D
60
39.214
54.183
146.452
1.00
47.75
6


ATOM
2867
CD1
LEU
D
60
39.881
53.552
147.639
1.00
47.41
6


ATOM
2868
CD2
LEU
D
60
38.104
53.270
145.940
1.00
48.12
6


ATOM
2869
C
LEU
D
60
40.709
56.889
146.497
1.00
49.37
6


ATOM
2870
O
LEU
D
60
41.850
56.479
146.629
1.00
49.75
8


ATOM
2871
N
GLU
D
61
40.306
57.645
145.479
1.00
50.35
7


ATOM
2872
CA
GLU
D
61
41.176
57.927
144.327
1.00
51.65
6


ATOM
2873
CB
GLU
D
61
40.435
58.503
143.096
1.00
52.16
6


ATOM
2874
CG
GLU
D
61
39.328
59.530
143.409
1.00
57.83
6


ATOM
2875
CD
GLU
D
61
38.344
59.058
144.527
1.00
64.50
6


ATOM
2876
OE1
GLU
D
61
38.537
59.433
145.741
1.00
65.38
8


ATOM
2877
OE2
GLU
D
61
37.403
58.284
144.178
1.00
66.25
8


ATOM
2878
C
GLU
D
61
42.343
58.770
144.764
1.00
51.09
6


ATOM
2879
O
GLU
D
61
43.487
58.403
144.476
1.00
51.37
8


ATOM
2880
N
ILE
D
62
42.076
59.847
145.509
1.00
50.59
7


ATOM
2881
CA
ILE
D
62
43.175
60.640
146.082
1.00
50.05
6


ATOM
2882
CB
ILE
D
62
42.717
61.735
147.046
1.00
49.93
6


ATOM
2883
CG1
ILE
D
62
41.946
62.832
146.297
1.00
49.95
6


ATOM
2884
CD
ILE
D
62
41.808
64.172
147.092
1.00
49.66
6


ATOM
2885
CG2
ILE
D
62
43.924
62.312
147.791
1.00
48.28
6


ATOM
2886
C
ILE
D
62
44.175
59.747
146.815
1.00
50.09
6


ATOM
2887
O
ILE
D
62
45.391
59.902
146.649
1.00
50.31
8


ATOM
2888
N
VAL
D
63
43.668
58.800
147.601
1.00
49.72
7


ATOM
2889
CA
VAL
D
63
44.549
57.879
148.292
1.00
49.62
6


ATOM
2890
CB
VAL
D
63
43.788
56.814
149.086
1.00
49.10
6


ATOM
2891
CG1
VAL
D
63
44.723
55.739
149.554
1.00
48.31
6


ATOM
2892
CG2
VAL
D
63
43.131
57.425
150.267
1.00
48.71
6


ATOM
2893
C
VAL
D
63
45.472
57.232
147.280
1.00
50.33
6


ATOM
2894
O
VAL
D
63
46.689
57.192
147.472
1.00
50.30
8


ATOM
2895
N
GLU
D
64
44.901
56.765
146.178
1.00
51.16
7


ATOM
2896
CA
GLU
D
64
45.698
56.058
145.197
1.00
52.39
6


ATOM
2897
CB
GLU
D
64
44.801
55.356
144.206
1.00
52.50
6


ATOM
2898
CG
GLU
D
64
45.290
53.947
143.915
1.00
55.95
6


ATOM
2899
CD
GLU
D
64
44.135
52.950
143.750
1.00
60.39
6


ATOM
2900
OE1
GLU
D
64
42.954
53.396
143.883
1.00
60.76
8


ATOM
2901
OE2
GLU
D
64
44.416
51.734
143.493
1.00
61.33
8


ATOM
2902
C
GLU
D
64
46.721
56.977
144.510
1.00
52.50
6


ATOM
2903
O
GLU
D
64
47.905
56.620
144.337
1.00
52.42
8


ATOM
2904
N
VAL
D
65
46.263
58.176
144.163
1.00
52.54
7


ATOM
2905
CA
VAL
D
65
47.125
59.190
143.589
1.00
52.40
6


ATOM
2906
CB
VAL
D
65
46.357
60.472
143.341
1.00
52.04
6


ATOM
2907
CG1
VAL
D
65
47.193
61.419
142.502
1.00
52.15
6


ATOM
2908
CG2
VAL
D
65
45.076
60.159
142.633
1.00
52.36
6


ATOM
2909
C
VAL
D
65
48.324
59.474
144.487
1.00
52.53
6


ATOM
2910
O
VAL
D
65
49.448
59.577
144.001
1.00
52.55
8


ATOM
2911
N
LEU
D
66
48.082
59.588
145.790
1.00
52.55
7


ATOM
2912
CA
LEU
D
66
49.143
59.858
146.743
1.00
53.00
6


ATOM
2913
CB
LEU
D
66
48.532
60.018
148.107
1.00
52.74
6


ATOM
2914
CG
LEU
D
66
47.829
61.338
148.317
1.00
53.72
6


ATOM
2915
CD1
LEU
D
66
46.841
61.194
149.482
1.00
55.52
6


ATOM
2916
CD2
LEU
D
66
48.835
62.454
148.564
1.00
52.65
6


ATOM
2917
C
LEU
D
66
50.176
58.735
146.799
1.00
53.53
6


ATOM
2918
O
LEU
D
66
51.393
58.957
146.875
1.00
53.43
8


ATOM
2919
N
LEU
D
67
49.665
57.513
146.770
1.00
53.94
7


ATOM
2920
CA
LEU
D
67
50.513
56.359
146.841
1.00
54.00
6


ATOM
2921
CB
LEU
D
67
49.678
55.106
147.103
1.00
54.17
6


ATOM
2922
CG
LEU
D
67
48.995
55.003
148.479
1.00
54.11
6


ATOM
2923
CD1
LEU
D
67
47.983
53.882
148.478
1.00
54.74
6


ATOM
2924
CD2
LEU
D
67
49.991
54.797
149.624
1.00
54.00
6


ATOM
2925
C
LEU
D
67
51.307
56.268
145.558
1.00
54.02
6


ATOM
2926
O
LEU
D
67
52.473
55.913
145.612
1.00
54.06
8


ATOM
2927
N
LYS
D
68
50.679
56.622
144.428
1.00
54.02
7


ATOM
2928
CA
LYS
D
68
51.336
56.647
143.118
1.00
54.25
6


ATOM
2929
CB
LYS
D
68
50.390
57.142
142.022
1.00
54.43
6


ATOM
2930
CG
LYS
D
68
49.465
56.086
141.426
1.00
55.79
6


ATOM
2931
CD
LYS
D
68
48.256
56.748
140.659
1.00
56.44
6


ATOM
2932
CE
LYS
D
68
47.367
55.737
139.825
1.00
57.51
6


ATOM
2933
NZ
LYS
D
68
46.472
54.817
140.634
1.00
57.53
7


ATOM
2934
C
LYS
D
68
52.526
57.565
143.160
1.00
53.49
6


ATOM
2935
O
LYS
D
68
53.503
57.319
142.492
1.00
53.46
8


ATOM
2936
N
HIS
D
69
52.438
58.625
143.952
1.00
53.09
7


ATOM
2937
CA
HIS
D
69
53.504
59.614
144.009
1.00
52.93
6


ATOM
2938
CB
HIS
D
69
52.931
61.029
143.973
1.00
53.08
6


ATOM
2939
CG
HIS
D
69
52.352
61.391
142.650
1.00
53.21
6


ATOM
2940
ND1
HIS
D
69
53.114
61.461
141.506
1.00
53.80
7


ATOM
2941
CE1
HIS
D
69
52.343
61.772
140.481
1.00
53.87
6


ATOM
2942
NE2
HIS
D
69
51.104
61.892
140.919
1.00
54.69
7


ATOM
2943
CD2
HIS
D
69
51.083
61.660
142.274
1.00
54.11
6


ATOM
2944
C
HIS
D
69
54.387
59.398
145.225
1.00
52.81
6


ATOM
2945
O
HIS
D
69
55.193
60.258
145.610
1.00
52.71
8


ATOM
2946
N
GLY
D
70
54.204
58.237
145.835
1.00
52.60
7


ATOM
2947
CA
GLY
D
70
55.108
57.749
146.853
1.00
52.10
6


ATOM
2948
C
GLY
D
70
54.890
58.330
148.222
1.00
51.92
6


ATOM
2949
O
GLY
D
70
55.850
58.600
148.922
1.00
52.00
8


ATOM
2950
N
ALA
D
71
53.635
58.531
148.615
1.00
51.78
7


ATOM
2951
CA
ALA
D
71
53.336
58.858
150.004
1.00
51.36
6


ATOM
2952
CB
ALA
D
71
51.844
59.052
150.195
1.00
51.20
6


ATOM
2953
C
ALA
D
71
53.832
57.700
150.858
1.00
51.12
6


ATOM
2954
O
ALA
D
71
53.669
56.542
150.476
1.00
51.47
8


ATOM
2955
N
ASP
D
72
54.465
57.997
151.987
1.00
50.60
7


ATOM
2956
CA
ASP
D
72
54.756
56.961
152.970
1.00
50.14
6


ATOM
2957
CB
ASP
D
72
55.608
57.529
154.093
1.00
50.09
6


ATOM
2958
CG
ASP
D
72
55.697
56.599
155.271
1.00
51.04
6


ATOM
2959
OD1
ASP
D
72
54.796
55.751
155.420
1.00
52.00
8


ATOM
2960
OD2
ASP
D
72
56.671
56.693
156.045
1.00
52.95
8


ATOM
2961
C
ASP
D
72
53.450
56.360
153.535
1.00
49.61
6


ATOM
2962
O
ASP
D
72
52.676
57.051
154.208
1.00
49.73
8


ATOM
2963
N
VAL
D
73
53.217
55.077
153.266
1.00
48.82
7


ATOM
2964
CA
VAL
D
73
51.958
54.439
153.652
1.00
48.30
6


ATOM
2965
CB
VAL
D
73
51.732
53.077
152.950
1.00
48.21
6


ATOM
2966
CG1
VAL
D
73
52.632
52.002
153.532
1.00
47.33
6


ATOM
2967
CG2
VAL
D
73
50.278
52.653
153.073
1.00
47.25
6


ATOM
2968
C
VAL
D
73
51.809
54.244
155.158
1.00
48.27
6


ATOM
2969
O
VAL
D
73
50.706
54.279
155.681
1.00
48.46
8


ATOM
2970
N
ASN
D
74
52.915
54.013
155.848
1.00
48.08
7


ATOM
2971
CA
ASN
D
74
52.874
53.768
157.288
1.00
47.92
6


ATOM
2972
CB
ASN
D
74
53.873
52.686
157.667
1.00
48.30
6


ATOM
2973
CG
ASN
D
74
53.529
51.373
157.083
1.00
48.84
6


ATOM
2974
OD1
ASN
D
74
52.379
50.958
157.106
1.00
51.13
8


ATOM
2975
ND2
ASN
D
74
54.521
50.702
156.540
1.00
49.72
7


ATOM
2976
C
ASN
D
74
53.184
55.019
158.102
1.00
47.63
6


ATOM
2977
O
ASN
D
74
53.726
54.936
159.221
1.00
47.50
8


ATOM
2978
N
ALA
D
75
52.866
56.178
157.540
1.00
46.96
7


ATOM
2979
CA
ALA
D
75
53.193
57.397
158.215
1.00
46.80
6


ATOM
2980
CB
ALA
D
75
52.831
58.567
157.342
1.00
46.83
6


ATOM
2981
C
ALA
D
75
52.403
57.393
159.513
1.00
46.91
6


ATOM
2982
O
ALA
D
75
51.207
57.064
159.490
1.00
47.21
8


ATOM
2983
N
HIS
D
76
53.077
57.688
160.633
1.00
46.60
7


ATOM
2984
CA
HIS
D
76
52.419
57.883
161.926
1.00
46.36
6


ATOM
2985
CB
HIS
D
76
53.392
57.508
163.031
1.00
46.65
6


ATOM
2986
CG
HIS
D
76
53.740
56.055
163.071
1.00
48.58
6


ATOM
2987
ND1
HIS
D
76
53.021
55.135
163.807
1.00
50.60
7


ATOM
2988
CE1
HIS
D
76
53.551
53.933
163.661
1.00
49.68
6


ATOM
2989
NE2
HIS
D
76
54.590
54.038
162.854
1.00
51.06
7


ATOM
2990
CD2
HIS
D
76
54.733
55.356
162.474
1.00
50.44
6


ATOM
2991
C
HIS
D
76
52.033
59.364
162.068
1.00
45.97
6


ATOM
2992
O
HIS
D
76
52.771
60.222
161.613
1.00
45.86
8


ATOM
2993
N
ASP
D
77
50.885
59.690
162.667
1.00
45.68
7


ATOM
2994
CA
ASP
D
77
50.619
61.100
163.054
1.00
45.23
6


ATOM
2995
CB
ASP
D
77
49.129
61.412
163.245
1.00
45.55
6


ATOM
2996
CG
ASP
D
77
48.507
60.627
164.409
1.00
48.44
6


ATOM
2997
OD1
ASP
D
77
49.190
59.684
164.885
1.00
51.41
8


ATOM
2998
OD2
ASP
D
77
47.347
60.922
164.848
1.00
50.65
8


ATOM
2999
C
ASP
D
77
51.371
61.240
164.346
1.00
44.37
6


ATOM
3000
O
ASP
D
77
52.162
60.369
164.667
1.00
44.16
8


ATOM
3001
N
ASN
D
78
51.156
62.292
165.118
1.00
43.90
7


ATOM
3002
CA
ASN
D
78
51.989
62.401
166.343
1.00
43.50
6


ATOM
3003
CB
ASN
D
78
52.547
63.819
166.645
1.00
43.72
6


ATOM
3004
CG
ASN
D
78
51.574
64.922
166.295
1.00
45.22
6


ATOM
3005
OD1
ASN
D
78
51.854
66.108
166.466
1.00
44.24
8


ATOM
3006
ND2
ASN
D
78
50.399
64.528
165.812
1.00
49.16
7


ATOM
3007
C
ASN
D
78
51.416
61.709
167.552
1.00
42.45
6


ATOM
3008
O
ASN
D
78
52.060
61.656
168.579
1.00
42.53
8


ATOM
3009
N
ASP
D
79
50.233
61.139
167.389
1.00
41.68
7


ATOM
3010
CA
ASP
D
79
49.670
60.209
168.346
1.00
41.40
6


ATOM
3011
CB
ASP
D
79
48.182
60.472
168.500
1.00
41.62
6


ATOM
3012
CG
ASP
D
79
47.888
61.535
169.535
1.00
43.66
6


ATOM
3013
OD1
ASP
D
79
48.727
61.741
170.429
1.00
45.21
8


ATOM
3014
OD2
ASP
D
79
46.810
62.165
169.477
1.00
47.28
8


ATOM
3015
C
ASP
D
79
49.899
58.770
167.903
1.00
41.08
6


ATOM
3016
O
ASP
D
79
49.467
57.831
168.576
1.00
41.15
8


ATOM
3017
N
GLY
D
80
50.552
58.601
166.752
1.00
40.54
7


ATOM
3018
CA
GLY
D
80
50.996
57.294
166.299
1.00
39.71
6


ATOM
3019
C
GLY
D
80
50.060
56.566
165.382
1.00
39.20
6


ATOM
3020
O
GLY
D
80
50.347
55.449
164.991
1.00
39.64
8


ATOM
3021
N
SER
D
81
48.940
57.176
165.033
1.00
38.75
7


ATOM
3022
CA
SER
D
81
47.964
56.516
164.162
1.00
38.59
6


ATOM
3023
CB
SER
D
81
46.602
57.193
164.241
1.00
39.27
6


ATOM
3024
OG
SER
D
81
46.353
57.795
165.520
1.00
41.92
8


ATOM
3025
C
SER
D
81
48.420
56.583
162.738
1.00
37.93
6


ATOM
3026
O
SER
D
81
48.828
57.630
162.270
1.00
37.74
8


ATOM
3027
N
THR
D
82
48.364
55.453
162.055
1.00
37.77
7


ATOM
3028
CA
THR
D
82
48.639
55.399
160.623
1.00
37.54
6


ATOM
3029
CB
THR
D
82
49.116
54.041
160.249
1.00
37.08
6


ATOM
3030
OG1
THR
D
82
47.991
53.158
160.272
1.00
37.19
8


ATOM
3031
CG2
THR
D
82
50.154
53.580
161.237
1.00
36.45
6


ATOM
3032
C
THR
D
82
47.351
55.645
159.815
1.00
38.09
6


ATOM
3033
O
THR
D
82
46.215
55.645
160.374
1.00
38.23
8


ATOM
3034
N
PRO
D
83
47.498
55.881
158.495
1.00
38.05
7


ATOM
3035
CA
PRO
D
83
46.265
55.952
157.700
1.00
38.02
6


ATOM
3036
CB
PRO
D
83
46.782
56.078
156.272
1.00
38.07
6


ATOM
3037
CG
PRO
D
83
48.092
56.784
156.453
1.00
38.03
6


ATOM
3038
CD
PRO
D
83
48.691
56.149
157.677
1.00
37.77
6


ATOM
3039
C
PRO
D
83
45.423
54.697
157.886
1.00
37.86
6


ATOM
3040
O
PRO
D
83
44.215
54.808
158.095
1.00
37.83
8


ATOM
3041
N
LEU
D
84
46.067
53.529
157.879
1.00
37.61
7


ATOM
3042
CA
LEU
D
84
45.374
52.289
158.223
1.00
37.48
6


ATOM
3043
CB
LEU
D
84
46.339
51.132
158.394
1.00
37.41
6


ATOM
3044
CG
LEU
D
84
45.679
49.761
158.573
1.00
36.97
6


ATOM
3045
CD1
LEU
D
84
44.628
49.434
157.529
1.00
35.15
6


ATOM
3046
CD2
LEU
D
84
46.764
48.672
158.576
1.00
39.04
6


ATOM
3047
C
LEU
D
84
44.486
52.396
159.459
1.00
37.59
6


ATOM
3048
O
LEU
D
84
43.285
52.115
159.363
1.00
37.85
8


ATOM
3049
N
HIS
D
85
45.037
52.822
160.599
1.00
37.28
7


ATOM
3050
CA
HIS
D
85
44.171
53.056
161.778
1.00
37.54
6


ATOM
3051
CB
HIS
D
85
44.882
53.735
162.947
1.00
38.21
6


ATOM
3052
CG
HIS
D
85
46.001
52.936
163.544
1.00
40.87
6


ATOM
3053
ND1
HIS
D
85
47.314
53.057
163.124
1.00
42.17
7


ATOM
3054
CE1
HIS
D
85
48.077
52.245
163.835
1.00
42.82
6


ATOM
3055
NE2
HIS
D
85
47.311
51.603
164.703
1.00
43.90
7


ATOM
3056
CD2
HIS
D
85
46.009
52.026
164.550
1.00
43.00
6


ATOM
3057
C
HIS
D
85
42.971
53.908
161.408
1.00
36.73
6


ATOM
3058
O
HIS
D
85
41.835
53.550
161.669
1.00
36.06
8


ATOM
3059
N
LEU
D
86
43.227
55.034
160.771
1.00
36.74
7


ATOM
3060
CA
LEU
D
86
42.134
55.950
160.516
1.00
36.96
6


ATOM
3061
CB
LEU
D
86
42.615
57.268
159.872
1.00
36.99
6


ATOM
3062
CG
LEU
D
86
42.840
58.501
160.779
1.00
34.96
6


ATOM
3063
CD1
LEU
D
86
43.116
58.165
162.216
1.00
32.53
6


ATOM
3064
CD2
LEU
D
86
43.955
59.356
160.230
1.00
34.13
6


ATOM
3065
C
LEU
D
86
41.052
55.243
159.721
1.00
37.09
6


ATOM
3066
O
LEU
D
86
39.871
55.271
160.120
1.00
37.43
8


ATOM
3067
N
ALA
D
87
41.448
54.557
158.650
1.00
37.16
7


ATOM
3068
CA
ALA
D
87
40.444
53.946
157.763
1.00
37.64
6


ATOM
3069
CB
ALA
D
87
41.076
53.314
156.536
1.00
37.78
6


ATOM
3070
C
ALA
D
87
39.651
52.921
158.551
1.00
37.69
6


ATOM
3071
O
ALA
D
87
38.411
52.815
158.411
1.00
37.37
8


ATOM
3072
N
ALA
D
88
40.376
52.201
159.410
1.00
37.56
7


ATOM
3073
CA
ALA
D
88
39.749
51.188
160.243
1.00
37.61
6


ATOM
3074
CB
ALA
D
88
40.781
50.387
161.050
1.00
37.41
6


ATOM
3075
C
ALA
D
88
38.714
51.846
161.149
1.00
37.40
6


ATOM
3076
O
ALA
D
88
37.527
51.485
161.095
1.00
38.05
8


ATOM
3077
N
LEU
D
89
39.139
52.833
161.931
1.00
36.74
7


ATOM
3078
CA
LEU
D
89
38.235
53.494
162.842
1.00
36.75
6


ATOM
3079
CB
LEU
D
89
38.909
54.685
163.482
1.00
36.79
6


ATOM
3080
CG
LEU
D
89
38.059
55.434
164.505
1.00
36.19
6


ATOM
3081
CD1
LEU
D
89
37.824
54.647
165.793
1.00
34.74
6


ATOM
3082
CD2
LEU
D
89
38.754
56.719
164.804
1.00
36.48
6


ATOM
3083
C
LEU
D
89
36.952
53.951
162.170
1.00
37.38
6


ATOM
3084
O
LEU
D
89
35.858
53.746
162.709
1.00
37.43
8


ATOM
3085
N
PHE
D
90
37.081
54.544
160.986
1.00
37.87
7


ATOM
3086
CA
PHE
D
90
35.917
55.046
160.280
1.00
38.27
6


ATOM
3087
CB
PHE
D
90
36.303
56.278
159.496
1.00
38.20
6


ATOM
3088
CG
PHE
D
90
36.814
57.400
160.359
1.00
39.63
6


ATOM
3089
CD1
PHE
D
90
38.054
57.992
160.105
1.00
40.65
6


ATOM
3090
CE1
PHE
D
90
38.531
59.042
160.897
1.00
39.96
6


ATOM
3091
CZ
PHE
D
90
37.777
59.493
161.969
1.00
39.62
6


ATOM
3092
CE2
PHE
D
90
36.535
58.909
162.241
1.00
39.71
6


ATOM
3093
CD2
PHE
D
90
36.063
57.869
161.436
1.00
40.30
6


ATOM
3094
C
PHE
D
90
35.244
54.016
159.380
1.00
38.64
6


ATOM
3095
O
PHE
D
90
34.197
54.301
158.790
1.00
39.21
8


ATOM
3096
N
GLY
D
91
35.836
52.828
159.274
1.00
38.84
7


ATOM
3097
CA
GLY
D
91
35.289
51.769
158.433
1.00
39.45
6


ATOM
3098
C
GLY
D
91
35.266
52.052
156.937
1.00
40.00
6


ATOM
3099
O
GLY
D
91
34.398
51.577
156.229
1.00
39.86
8


ATOM
3100
N
HIS
D
92
36.220
52.834
156.461
1.00
40.94
7


ATOM
3101
CA
HIS
D
92
36.468
52.984
155.037
1.00
42.19
6


ATOM
3102
CB
HIS
D
92
37.366
54.189
154.806
1.00
42.71
6


ATOM
3103
CG
HIS
D
92
36.897
55.458
155.462
1.00
43.31
6


ATOM
3104
ND1
HIS
D
92
35.574
55.849
155.490
1.00
43.59
7


ATOM
3105
CE1
HIS
D
92
35.477
57.024
156.089
1.00
42.74
6


ATOM
3106
NE2
HIS
D
92
36.690
57.417
156.436
1.00
41.57
7


ATOM
3107
CD2
HIS
D
92
37.595
56.458
156.059
1.00
42.53
6


ATOM
3108
C
HIS
D
92
37.166
51.737
154.460
1.00
42.99
6


ATOM
3109
O
HIS
D
92
38.397
51.701
154.299
1.00
42.57
8


ATOM
3110
N
LEU
D
93
36.351
50.727
154.156
1.00
44.14
7


ATOM
3111
CA
LEU
D
93
36.795
49.395
153.731
1.00
45.21
6


ATOM
3112
CB
LEU
D
93
35.558
48.545
153.413
1.00
44.98
6


ATOM
3113
CG
LEU
D
93
34.916
47.793
154.584
1.00
46.49
6


ATOM
3114
CD1
LEU
D
93
35.654
46.509
154.779
1.00
48.48
6


ATOM
3115
CD2
LEU
D
93
34.850
48.546
155.950
1.00
47.77
6


ATOM
3116
C
LEU
D
93
37.727
49.446
152.516
1.00
45.79
6


ATOM
3117
O
LEU
D
93
38.927
49.136
152.619
1.00
45.73
8


ATOM
3118
N
GLU
D
94
37.168
49.864
151.379
1.00
46.38
7


ATOM
3119
CA
GLU
D
94
37.913
49.977
150.137
1.00
47.32
6


ATOM
3120
CB
GLU
D
94
37.209
50.875
149.123
1.00
47.87
6


ATOM
3121
CG
GLU
D
94
35.773
50.480
148.792
1.00
50.66
6


ATOM
3122
CD
GLU
D
94
34.732
51.000
149.811
1.00
54.51
6


ATOM
3123
OE1
GLU
D
94
35.085
51.411
150.978
1.00
55.30
8


ATOM
3124
OE2
GLU
D
94
33.541
50.987
149.409
1.00
54.82
8


ATOM
3125
C
GLU
D
94
39.265
50.566
150.401
1.00
47.27
6


ATOM
3126
O
GLU
D
94
40.253
50.051
149.909
1.00
47.63
8


ATOM
3127
N
ILE
D
95
39.325
51.642
151.181
1.00
47.25
7


ATOM
3128
CA
ILE
D
95
40.631
52.247
151.471
1.00
46.95
6


ATOM
3129
CB
ILE
D
95
40.528
53.622
152.125
1.00
46.49
6


ATOM
3130
CG1
ILE
D
95
39.704
54.544
151.232
1.00
47.00
6


ATOM
3131
CD
ILE
D
95
40.035
56.039
151.322
1.00
48.34
6


ATOM
3132
CG2
ILE
D
95
41.903
54.159
152.380
1.00
44.86
6


ATOM
3133
C
ILE
D
95
41.566
51.319
152.273
1.00
47.05
6


ATOM
3134
O
ILE
D
95
42.729
51.117
151.899
1.00
46.91
8


ATOM
3135
N
VAL
D
96
41.055
50.742
153.354
1.00
46.95
7


ATOM
3136
CA
VAL
D
96
41.851
49.807
154.114
1.00
47.05
6


ATOM
3137
CB
VAL
D
96
41.031
49.076
155.184
1.00
46.86
6


ATOM
3138
CG1
VAL
D
96
41.793
47.913
155.710
1.00
46.56
6


ATOM
3139
CG2
VAL
D
96
40.733
49.989
156.328
1.00
47.17
6


ATOM
3140
C
VAL
D
96
42.474
48.807
153.144
1.00
47.44
6


ATOM
3141
O
VAL
D
96
43.675
48.499
153.229
1.00
47.52
8


ATOM
3142
N
GLU
D
97
41.671
48.319
152.199
1.00
47.60
7


ATOM
3143
CA
GLU
D
97
42.181
47.344
151.253
1.00
47.52
6


ATOM
3144
CB
GLU
D
97
41.073
46.733
150.430
1.00
47.27
6


ATOM
3145
CG
GLU
D
97
41.194
45.235
150.425
1.00
50.37
6


ATOM
3146
CD
GLU
D
97
39.832
44.502
150.587
1.00
55.38
6


ATOM
3147
OE1
GLU
D
97
38.785
45.211
150.696
1.00
56.20
8


ATOM
3148
OE2
GLU
D
97
39.812
43.220
150.609
1.00
55.45
8


ATOM
3149
C
GLU
D
97
43.302
47.945
150.411
1.00
47.00
6


ATOM
3150
O
GLU
D
97
44.446
47.523
150.532
1.00
47.32
8


ATOM
3151
N
VAL
D
98
43.021
48.975
149.628
1.00
46.38
7


ATOM
3152
CA
VAL
D
98
44.094
49.545
148.812
1.00
46.13
6


ATOM
3153
CB
VAL
D
98
43.635
50.735
147.907
1.00
45.79
6


ATOM
3154
CG1
VAL
D
98
42.442
51.371
148.476
1.00
45.71
6


ATOM
3155
CG2
VAL
D
98
44.743
51.749
147.692
1.00
44.99
6


ATOM
3156
C
VAL
D
98
45.351
49.845
149.643
1.00
46.05
6


ATOM
3157
O
VAL
D
98
46.478
49.618
149.170
1.00
46.27
8


ATOM
3158
N
LEU
D
99
45.166
50.314
150.876
1.00
45.49
7


ATOM
3159
CA
LEU
D
99
46.320
50.560
151.757
1.00
45.07
6


ATOM
3160
CB
LEU
D
99
45.876
51.144
153.102
1.00
44.73
6


ATOM
3161
CG
LEU
D
99
45.508
52.622
153.075
1.00
43.54
6


ATOM
3162
CD1
LEU
D
99
44.580
52.958
154.231
1.00
44.41
6


ATOM
3163
CD2
LEU
D
99
46.762
53.445
153.158
1.00
42.12
6


ATOM
3164
C
LEU
D
99
47.149
49.283
151.958
1.00
44.90
6


ATOM
3165
O
LEU
D
99
48.377
49.258
151.774
1.00
44.16
8


ATOM
3166
N
LEU
D
100
46.442
48.219
152.305
1.00
44.97
7


ATOM
3167
CA
LEU
D
100
47.074
46.956
152.548
1.00
45.14
6


ATOM
3168
CB
LEU
D
100
46.018
45.915
152.916
1.00
44.84
6


ATOM
3169
CG
LEU
D
100
45.452
46.176
154.310
1.00
44.24
6


ATOM
3170
CD1
LEU
D
100
44.266
45.300
154.603
1.00
43.26
6


ATOM
3171
CD2
LEU
D
100
46.552
46.013
155.385
1.00
43.69
6


ATOM
3172
C
LEU
D
100
47.826
46.599
151.301
1.00
45.54
6


ATOM
3173
O
LEU
D
100
49.012
46.298
151.363
1.00
44.84
8


ATOM
3174
N
LYS
D
101
47.117
46.699
150.177
1.00
46.62
7


ATOM
3175
CA
LYS
D
101
47.627
46.356
148.877
1.00
47.97
6


ATOM
3176
CB
LYS
D
101
46.657
46.811
147.780
1.00
48.24
6


ATOM
3177
CG
LYS
D
101
46.956
46.186
146.374
1.00
51.29
6


ATOM
3178
CD
LYS
D
101
46.738
47.169
145.188
1.00
54.07
6


ATOM
3179
CE
LYS
D
101
45.236
47.457
144.939
1.00
56.15
6


ATOM
3180
NZ
LYS
D
101
44.935
48.939
144.795
1.00
57.79
7


ATOM
3181
C
LYS
D
101
48.960
47.041
148.710
1.00
48.35
6


ATOM
3182
O
LYS
D
101
49.917
46.452
148.233
1.00
48.54
8


ATOM
3183
N
HIS
D
102
49.037
48.289
149.126
1.00
49.10
7


ATOM
3184
CA
HIS
D
102
50.278
48.997
148.973
1.00
49.83
6


ATOM
3185
CB
HIS
D
102
50.026
50.453
148.615
1.00
50.28
6


ATOM
3186
CG
HIS
D
102
49.568
50.634
147.207
1.00
52.47
6


ATOM
3187
ND1
HIS
D
102
49.607
51.849
146.560
1.00
54.04
7


ATOM
3188
CE1
HIS
D
102
49.133
51.707
145.334
1.00
55.43
6


ATOM
3189
NE2
HIS
D
102
48.813
50.435
145.156
1.00
56.22
7


ATOM
3190
CD2
HIS
D
102
49.080
49.741
146.310
1.00
54.07
6


ATOM
3191
C
HIS
D
102
51.117
48.856
150.214
1.00
49.85
6


ATOM
3192
O
HIS
D
102
51.895
49.750
150.542
1.00
50.07
8


ATOM
3193
N
GLY
D
103
50.946
47.736
150.910
1.00
49.92
7


ATOM
3194
CA
GLY
D
103
51.864
47.331
151.990
1.00
49.79
6


ATOM
3195
C
GLY
D
103
51.776
48.053
153.329
1.00
49.60
6


ATOM
3196
O
GLY
D
103
52.767
48.136
154.057
1.00
49.71
8


ATOM
3197
N
ALA
D
104
50.594
48.585
153.643
1.00
49.21
7


ATOM
3198
CA
ALA
D
104
50.295
49.116
154.959
1.00
48.27
6


ATOM
3199
CB
ALA
D
104
48.817
49.457
155.057
1.00
48.43
6


ATOM
3200
C
ALA
D
104
50.609
48.041
155.938
1.00
47.70
6


ATOM
3201
O
ALA
D
104
50.172
46.904
155.778
1.00
47.90
8


ATOM
3202
N
ASP
D
105
51.378
48.393
156.947
1.00
47.30
7


ATOM
3203
CA
ASP
D
105
51.674
47.449
158.009
1.00
47.43
6


ATOM
3204
CB
ASP
D
105
52.836
47.943
158.859
1.00
47.65
6


ATOM
3205
CG
ASP
D
105
53.146
46.995
159.980
1.00
49.35
6


ATOM
3206
OD1
ASP
D
105
52.416
45.990
160.093
1.00
52.31
8


ATOM
3207
OD2
ASP
D
105
54.101
47.236
160.747
1.00
50.89
8


ATOM
3208
C
ASP
D
105
50.454
47.179
158.902
1.00
46.81
6


ATOM
3209
O
ASP
D
105
50.028
48.051
159.658
1.00
47.03
8


ATOM
3210
N
VAL
D
106
49.908
45.971
158.829
1.00
45.98
7


ATOM
3211
CA
VAL
D
106
48.718
45.650
159.603
1.00
45.54
6


ATOM
3212
CB
VAL
D
106
48.139
44.282
159.178
1.00
45.57
6


ATOM
3213
CG1
VAL
D
106
49.185
43.177
159.333
1.00
45.17
6


ATOM
3214
CG2
VAL
D
106
46.848
43.957
159.943
1.00
44.74
6


ATOM
3215
C
VAL
D
106
49.037
45.659
161.105
1.00
45.38
6


ATOM
3216
O
VAL
D
106
48.164
45.842
161.959
1.00
46.00
8


ATOM
3217
N
ASN
D
107
50.305
45.468
161.411
1.00
44.44
7


ATOM
3218
CA
ASN
D
107
50.727
45.272
162.769
1.00
43.82
6


ATOM
3219
CB
ASN
D
107
51.978
44.409
162.790
1.00
43.96
6


ATOM
3220
CG
ASN
D
107
51.667
42.965
162.783
1.00
43.63
6


ATOM
3221
OD1
ASN
D
107
50.552
42.559
163.102
1.00
45.40
8


ATOM
3222
ND2
ASN
D
107
52.645
42.167
162.437
1.00
42.98
7


ATOM
3223
C
ASN
D
107
51.070
46.553
163.438
1.00
43.38
6


ATOM
3224
O
ASN
D
107
51.303
46.562
164.643
1.00
43.78
8


ATOM
3225
N
ALA
D
108
51.149
47.622
162.654
1.00
42.64
7


ATOM
3226
CA
ALA
D
108
51.585
48.921
163.145
1.00
41.86
6


ATOM
3227
CB
ALA
D
108
51.520
49.926
162.033
1.00
41.89
6


ATOM
3228
C
ALA
D
108
50.684
49.337
164.275
1.00
41.55
6


ATOM
3229
O
ALA
D
108
49.448
49.162
164.186
1.00
41.65
8


ATOM
3230
N
GLN
D
109
51.286
49.864
165.344
1.00
41.02
7


ATOM
3231
CA
GLN
D
109
50.483
50.349
166.484
1.00
40.85
6


ATOM
3232
CB
GLN
D
109
50.621
49.461
167.717
1.00
40.51
6


ATOM
3233
CG
GLN
D
109
51.932
48.751
167.878
1.00
40.99
6


ATOM
3234
CD
GLN
D
109
52.040
48.087
169.243
1.00
41.68
6


ATOM
3235
OE1
GLN
D
109
52.939
48.401
170.005
1.00
42.71
8


ATOM
3236
NE2
GLN
D
109
51.097
47.199
169.575
1.00
42.04
7


ATOM
3237
C
GLN
D
109
50.641
51.825
166.851
1.00
40.50
6


ATOM
3238
O
GLN
D
109
51.721
52.374
166.752
1.00
40.77
8


ATOM
3239
N
ASP
D
110
49.548
52.461
167.260
1.00
40.06
7


ATOM
3240
CA
ASP
D
110
49.587
53.849
167.666
1.00
39.99
6


ATOM
3241
CB
ASP
D
110
48.196
54.441
167.600
1.00
40.69
6


ATOM
3242
CG
ASP
D
110
47.228
53.757
168.554
1.00
42.12
6


ATOM
3243
OD1
ASP
D
110
47.674
53.154
169.561
1.00
42.18
8


ATOM
3244
OD2
ASP
D
110
46.009
53.833
168.298
1.00
44.73
8


ATOM
3245
C
ASP
D
110
50.067
53.888
169.091
1.00
39.64
6


ATOM
3246
O
ASP
D
110
50.463
52.859
169.637
1.00
39.93
8


ATOM
3247
N
LYS
D
111
49.977
55.053
169.722
1.00
39.12
7


ATOM
3248
CA
LYS
D
111
50.610
55.272
171.027
1.00
38.69
6


ATOM
3249
CB
LYS
D
111
50.677
56.767
171.365
1.00
38.75
6


ATOM
3250
CG
LYS
D
111
49.407
57.380
171.880
1.00
38.85
6


ATOM
3251
CD
LYS
D
111
49.560
58.871
172.150
1.00
39.40
6


ATOM
3252
CE
LYS
D
111
48.660
59.273
173.329
1.00
41.93
6


ATOM
3253
NZ
LYS
D
111
48.289
60.728
173.381
1.00
43.00
7


ATOM
3254
C
LYS
D
111
49.991
54.504
172.172
1.00
38.32
6


ATOM
3255
O
LYS
D
111
50.566
54.449
173.241
1.00
38.35
8


ATOM
3256
N
PHE
D
112
48.811
53.930
171.947
1.00
38.20
7


ATOM
3257
CA
PHE
D
112
48.149
53.047
172.912
1.00
37.90
6


ATOM
3258
CB
PHE
D
112
46.650
53.254
172.835
1.00
37.59
6


ATOM
3259
CG
PHE
D
112
46.236
54.650
173.009
1.00
38.01
6


ATOM
3260
CD1
PHE
D
112
45.931
55.138
174.267
1.00
38.14
6


ATOM
3261
CE1
PHE
D
112
45.527
56.467
174.430
1.00
38.84
6


ATOM
3262
CZ
PHE
D
112
45.429
57.328
173.323
1.00
38.07
6


ATOM
3263
CE2
PHE
D
112
45.722
56.850
172.063
1.00
38.90
6


ATOM
3264
CD2
PHE
D
112
46.124
55.498
171.904
1.00
39.25
6


ATOM
3265
C
PHE
D
112
48.432
51.575
172.590
1.00
37.78
6


ATOM
3266
O
PHE
D
112
47.815
50.666
173.137
1.00
37.67
8


ATOM
3267
N
GLY
D
113
49.332
51.341
171.652
1.00
37.75
7


ATOM
3268
CA
GLY
D
113
49.599
49.997
171.200
1.00
37.64
6


ATOM
3269
C
GLY
D
113
48.435
49.293
170.528
1.00
37.60
6


ATOM
3270
O
GLY
D
113
48.449
48.061
170.443
1.00
38.12
8


ATOM
3271
N
LYS
D
114
47.436
50.040
170.049
1.00
37.15
7


ATOM
3272
CA
LYS
D
114
46.343
49.433
169.285
1.00
36.68
6


ATOM
3273
CB
LYS
D
114
45.053
50.239
169.374
1.00
36.20
6


ATOM
3274
CG
LYS
D
114
44.621
50.644
170.746
1.00
34.82
6


ATOM
3275
CD
LYS
D
114
43.126
50.756
170.808
1.00
31.61
6


ATOM
3276
CE
LYS
D
114
42.525
49.461
171.278
1.00
30.65
6


ATOM
3277
NZ
LYS
D
114
42.300
49.489
172.731
1.00
31.39
7


ATOM
3278
C
LYS
D
114
46.728
49.385
167.835
1.00
37.20
6


ATOM
3279
O
LYS
D
114
47.293
50.332
167.303
1.00
37.31
8


ATOM
3280
N
THR
D
115
46.404
48.277
167.190
1.00
38.07
7


ATOM
3281
CA
THR
D
115
46.512
48.164
165.730
1.00
38.81
6


ATOM
3282
CB
THR
D
115
47.098
46.797
165.282
1.00
39.00
6


ATOM
3283
OG1
THR
D
115
46.073
45.782
165.327
1.00
38.89
8


ATOM
3284
CG2
THR
D
115
48.278
46.395
166.150
1.00
38.82
6


ATOM
3285
C
THR
D
115
45.126
48.293
165.082
1.00
39.25
6


ATOM
3286
O
THR
D
115
44.063
48.239
165.761
1.00
39.14
8


ATOM
3287
N
ALA
D
116
45.133
48.433
163.760
1.00
39.29
7


ATOM
3288
CA
ALA
D
116
43.871
48.480
163.051
1.00
39.43
6


ATOM
3289
CB
ALA
D
116
44.100
48.402
161.581
1.00
39.57
6


ATOM
3290
C
ALA
D
116
42.962
47.341
163.529
1.00
39.35
6


ATOM
3291
O
ALA
D
116
41.785
47.556
163.872
1.00
39.21
8


ATOM
3292
N
PHE
D
117
43.529
46.143
163.602
1.00
39.13
7


ATOM
3293
CA
PHE
D
117
42.756
45.006
164.014
1.00
39.14
6


ATOM
3294
CB
PHE
D
117
43.622
43.785
164.124
1.00
39.19
6


ATOM
3295
CG
PHE
D
117
42.847
42.559
164.482
1.00
39.34
6


ATOM
3296
CD1
PHE
D
117
42.051
41.926
163.530
1.00
39.36
6


ATOM
3297
CE1
PHE
D
117
41.338
40.799
163.848
1.00
38.22
6


ATOM
3298
CZ
PHE
D
117
41.410
40.285
165.126
1.00
38.31
6


ATOM
3299
CE2
PHE
D
117
42.179
40.912
166.084
1.00
37.14
6


ATOM
3300
CD2
PHE
D
117
42.885
42.050
165.766
1.00
37.40
6


ATOM
3301
C
PHE
D
117
42.002
45.189
165.327
1.00
39.31
6


ATOM
3302
O
PHE
D
117
40.805
44.869
165.388
1.00
39.25
8


ATOM
3303
N
ASP
D
118
42.676
45.687
166.369
1.00
39.30
7


ATOM
3304
CA
ASP
D
118
41.955
45.995
167.609
1.00
39.79
6


ATOM
3305
CB
ASP
D
118
42.823
46.614
168.685
1.00
40.66
6


ATOM
3306
CG
ASP
D
118
44.248
46.129
168.638
1.00
43.93
6


ATOM
3307
OD1
ASP
D
118
44.709
45.438
169.599
1.00
46.69
8


ATOM
3308
OD2
ASP
D
118
44.905
46.448
167.623
1.00
46.66
8


ATOM
3309
C
ASP
D
118
40.834
46.964
167.314
1.00
39.28
6


ATOM
3310
O
ASP
D
118
39.685
46.656
167.624
1.00
39.00
8


ATOM
3311
N
ILE
D
119
41.165
48.111
166.695
1.00
38.74
7


ATOM
3312
CA
ILE
D
119
40.158
49.134
166.348
1.00
38.04
6


ATOM
3313
CB
ILE
D
119
40.655
50.167
165.331
1.00
37.88
6


ATOM
3314
CG1
ILE
D
119
41.790
50.981
165.904
1.00
37.76
6


ATOM
3315
CD
ILE
D
119
42.035
52.231
165.105
1.00
39.40
6


ATOM
3316
CG2
ILE
D
119
39.563
51.122
164.936
1.00
36.31
6


ATOM
3317
C
ILE
D
119
38.918
48.476
165.773
1.00
38.04
6


ATOM
3318
O
ILE
D
119
37.818
48.756
166.251
1.00
37.85
8


ATOM
3319
N
SER
D
120
39.102
47.594
164.783
1.00
38.01
7


ATOM
3320
CA
SER
D
120
37.981
46.879
164.149
1.00
38.88
6


ATOM
3321
CB
SER
D
120
38.455
45.917
163.061
1.00
38.86
6


ATOM
3322
OG
SER
D
120
39.324
44.953
163.615
1.00
40.23
8


ATOM
3323
C
SER
D
120
37.163
46.086
165.152
1.00
39.11
6


ATOM
3324
O
SER
D
120
35.920
46.130
165.142
1.00
39.19
8


ATOM
3325
N
ILE
D
121
37.860
45.359
166.020
1.00
39.36
7


ATOM
3326
CA
ILE
D
121
37.187
44.658
167.108
1.00
39.54
6


ATOM
3327
CB
ILE
D
121
38.147
43.791
167.947
1.00
39.27
6


ATOM
3328
CG1
ILE
D
121
38.940
42.817
167.067
1.00
39.46
6


ATOM
3329
CD
ILE
D
121
38.308
41.475
166.842
1.00
39.04
6


ATOM
3330
CG2
ILE
D
121
37.380
43.063
169.017
1.00
38.50
6


ATOM
3331
C
ILE
D
121
36.497
45.648
168.042
1.00
40.04
6


ATOM
3332
O
ILE
D
121
35.374
45.421
168.424
1.00
40.19
8


ATOM
3333
N
ASP
D
122
37.172
46.742
168.390
1.00
40.72
7


ATOM
3334
CA
ASP
D
122
36.672
47.688
169.376
1.00
41.41
6


ATOM
3335
CB
ASP
D
122
37.685
48.782
169.650
1.00
41.82
6


ATOM
3336
CG
ASP
D
122
38.892
48.278
170.407
1.00
44.06
6


ATOM
3337
OD1
ASP
D
122
38.835
47.186
171.051
1.00
45.13
8


ATOM
3338
OD2
ASP
D
122
39.911
48.993
170.342
1.00
46.51
8


ATOM
3339
C
ASP
D
122
35.407
48.339
168.934
1.00
41.66
6


ATOM
3340
O
ASP
D
122
34.514
48.571
169.741
1.00
42.06
8


ATOM
3341
N
ASN
D
123
35.295
48.665
167.662
1.00
42.04
7


ATOM
3342
CA
ASN
D
123
34.003
49.166
167.261
1.00
42.54
6


ATOM
3343
CB
ASN
D
123
34.075
50.565
166.638
1.00
42.09
6


ATOM
3344
CG
ASN
D
123
35.046
50.646
165.537
1.00
41.28
6


ATOM
3345
OD1
ASN
D
123
35.365
49.636
164.930
1.00
41.88
8


ATOM
3346
ND2
ASN
D
123
35.524
51.844
165.249
1.00
39.46
7


ATOM
3347
C
ASN
D
123
33.222
48.132
166.464
1.00
43.06
6


ATOM
3348
O
ASN
D
123
32.422
48.466
165.602
1.00
43.33
8


ATOM
3349
N
GLY
D
124
33.466
46.867
166.789
1.00
43.87
7


ATOM
3350
CA
GLY
D
124
32.633
45.741
166.348
1.00
45.09
6


ATOM
3351
C
GLY
D
124
32.368
45.593
164.858
1.00
45.73
6


ATOM
3352
O
GLY
D
124
31.375
45.019
164.455
1.00
45.73
8


ATOM
3353
N
ASN
D
125
33.251
46.128
164.038
1.00
46.74
7


ATOM
3354
CA
ASN
D
125
33.127
45.991
162.611
1.00
47.72
6


ATOM
3355
CB
ASN
D
125
33.801
47.166
161.910
1.00
47.53
6


ATOM
3356
CG
ASN
D
125
33.739
47.066
160.416
1.00
46.64
6


ATOM
3357
OD1
ASN
D
125
33.200
46.121
159.872
1.00
46.94
8


ATOM
3358
ND2
ASN
D
125
34.294
48.047
159.741
1.00
46.95
7


ATOM
3359
C
ASN
D
125
33.784
44.701
162.215
1.00
48.87
6


ATOM
3360
O
ASN
D
125
34.970
44.667
161.901
1.00
49.09
8


ATOM
3361
N
GLU
D
126
32.992
43.639
162.238
1.00
50.50
7


ATOM
3362
CA
GLU
D
126
33.447
42.277
161.980
1.00
52.59
6


ATOM
3363
CB
GLU
D
126
32.290
41.321
162.268
1.00
52.18
6


ATOM
3364
CG
GLU
D
126
32.679
39.846
162.309
1.00
54.34
6


ATOM
3365
CD
GLU
D
126
31.454
38.932
162.234
1.00
55.49
6


ATOM
3366
OE1
GLU
D
126
31.509
37.855
161.569
1.00
58.43
8


ATOM
3367
OE2
GLU
D
126
30.416
39.306
162.841
1.00
59.24
8


ATOM
3368
C
GLU
D
126
33.951
42.045
160.550
1.00
52.89
6


ATOM
3369
O
GLU
D
126
34.895
41.287
160.333
1.00
53.13
8


ATOM
3370
N
ASP
D
127
33.294
42.676
159.578
1.00
53.67
7


ATOM
3371
CA
ASP
D
127
33.741
42.651
158.185
1.00
54.21
6


ATOM
3372
CB
ASP
D
127
32.923
43.612
157.337
1.00
54.22
6


ATOM
3373
CG
ASP
D
127
31.630
43.013
156.867
1.00
55.59
6


ATOM
3374
OD1
ASP
D
127
31.512
41.772
156.897
1.00
58.23
8


ATOM
3375
OD2
ASP
D
127
30.722
43.770
156.457
1.00
56.87
8


ATOM
3376
C
ASP
D
127
35.191
43.043
158.060
1.00
54.52
6


ATOM
3377
O
ASP
D
127
35.989
42.266
157.555
1.00
55.01
8


ATOM
3378
N
LEU
D
128
35.516
44.253
158.515
1.00
54.66
7


ATOM
3379
CA
LEU
D
128
36.875
44.754
158.558
1.00
54.89
6


ATOM
3380
CB
LEU
D
128
36.942
46.009
159.399
1.00
55.14
6


ATOM
3381
CG
LEU
D
128
38.054
47.049
159.209
1.00
55.58
6


ATOM
3382
CD1
LEU
D
128
38.414
47.709
160.527
1.00
54.76
6


ATOM
3383
CD2
LEU
D
128
39.286
46.495
158.561
1.00
56.13
6


ATOM
3384
C
LEU
D
128
37.792
43.755
159.206
1.00
55.21
6


ATOM
3385
O
LEU
D
128
38.806
43.390
158.628
1.00
55.31
8


ATOM
3386
N
ALA
D
129
37.438
43.323
160.413
1.00
55.68
7


ATOM
3387
CA
ALA
D
129
38.233
42.348
161.158
1.00
56.33
6


ATOM
3388
CB
ALA
D
129
37.463
41.856
162.340
1.00
56.44
6


ATOM
3389
C
ALA
D
129
38.666
41.181
160.294
1.00
56.73
6


ATOM
3390
O
ALA
D
129
39.834
40.849
160.229
1.00
56.57
8


ATOM
3391
N
GLU
D
130
37.697
40.595
159.612
1.00
57.71
7


ATOM
3392
CA
GLU
D
130
37.891
39.482
158.699
1.00
58.84
6


ATOM
3393
CB
GLU
D
130
36.549
39.088
158.086
1.00
58.91
6


ATOM
3394
CG
GLU
D
130
36.326
37.580
157.875
1.00
60.78
6


ATOM
3395
CD
GLU
D
130
34.915
37.246
157.329
1.00
61.28
6


ATOM
3396
OE1
GLU
D
130
34.605
36.036
157.168
1.00
63.77
8


ATOM
3397
OE2
GLU
D
130
34.114
38.185
157.060
1.00
63.59
8


ATOM
3398
C
GLU
D
130
38.815
39.850
157.574
1.00
58.34
6


ATOM
3399
O
GLU
D
130
39.571
39.031
157.107
1.00
58.65
8


ATOM
3400
N
ILE
D
131
38.750
41.073
157.098
1.00
58.35
7


ATOM
3401
CA
ILE
D
131
39.672
41.412
156.042
1.00
58.43
6


ATOM
3402
CB
ILE
D
131
39.202
42.551
155.099
1.00
58.03
6


ATOM
3403
CG1
ILE
D
131
40.244
43.640
155.041
1.00
57.11
6


ATOM
3404
CD
ILE
D
131
40.041
44.549
153.922
1.00
57.22
6


ATOM
3405
CG2
ILE
D
131
37.883
43.136
155.513
1.00
57.47
6


ATOM
3406
C
ILE
D
131
41.077
41.609
156.579
1.00
58.96
6


ATOM
3407
O
ILE
D
131
42.036
41.410
155.845
1.00
59.08
8


ATOM
3408
N
LEU
D
132
41.200
41.967
157.857
1.00
59.64
7


ATOM
3409
CA
LEU
D
132
42.525
42.078
158.485
1.00
60.48
6


ATOM
3410
CB
LEU
D
132
42.537
43.048
159.664
1.00
59.77
6


ATOM
3411
CG
LEU
D
132
42.123
44.505
159.427
1.00
58.68
6


ATOM
3412
CD1
LEU
D
132
41.962
45.279
160.734
1.00
56.21
6


ATOM
3413
CD2
LEU
D
132
43.092
45.215
158.517
1.00
58.25
6


ATOM
3414
C
LEU
D
132
43.106
40.728
158.915
1.00
61.74
6


ATOM
3415
O
LEU
D
132
44.325
40.564
158.889
1.00
61.96
8


ATOM
3416
N
GLN
D
133
42.252
39.769
159.297
1.00
62.98
7


ATOM
3417
CA
GLN
D
133
42.714
38.421
159.632
1.00
64.24
6


ATOM
3418
CB
GLN
D
133
41.629
37.568
160.269
1.00
63.46
6


ATOM
3419
CG
GLN
D
133
40.606
38.347
161.010
1.00
63.49
6


ATOM
3420
CD
GLN
D
133
40.125
37.696
162.295
1.00
62.49
6


ATOM
3421
OE1
GLN
D
133
38.944
37.366
162.422
1.00
61.70
8


ATOM
3422
NE2
GLN
D
133
41.025
37.559
163.274
1.00
61.16
7


ATOM
3423
C
GLN
D
133
43.196
37.722
158.391
1.00
65.87
6


ATOM
3424
O
GLN
D
133
44.056
36.862
158.462
1.00
66.34
8


ATOM
3425
N
LYS
D
134
42.637
38.098
157.247
1.00
67.88
7


ATOM
3426
CA
LYS
D
134
42.958
37.479
155.968
1.00
69.45
6


ATOM
3427
CB
LYS
D
134
41.982
37.949
154.899
1.00
69.50
6


ATOM
3428
CG
LYS
D
134
40.880
36.954
154.655
1.00
69.74
6


ATOM
3429
CD
LYS
D
134
40.247
37.167
153.282
1.00
70.46
6


ATOM
3430
CE
LYS
D
134
39.081
36.219
153.101
1.00
69.53
6


ATOM
3431
NZ
LYS
D
134
38.315
36.185
154.378
1.00
68.46
7


ATOM
3432
C
LYS
D
134
44.380
37.758
155.516
1.00
70.59
6


ATOM
3433
O
LYS
D
134
44.776
37.378
154.419
1.00
71.05
8


ATOM
3434
N
LEU
D
135
45.161
38.419
156.352
1.00
71.76
7


ATOM
3435
CA
LEU
D
135
46.517
38.729
155.952
1.00
73.04
6


ATOM
3436
CB
LEU
D
135
46.817
40.200
156.190
1.00
72.80
6


ATOM
3437
CG
LEU
D
135
45.845
41.222
155.624
1.00
73.19
6


ATOM
3438
CD1
LEU
D
135
46.683
42.401
155.235
1.00
73.35
6


ATOM
3439
CD2
LEU
D
135
45.045
40.723
154.417
1.00
73.25
6


ATOM
3440
C
LEU
D
135
47.585
37.880
156.630
1.00
73.90
6


ATOM
3441
O
LEU
D
135
47.401
37.401
157.750
1.00
74.12
8


ATOM
3442
N
ASN
D
136
48.698
37.697
155.917
1.00
74.85
7


ATOM
3443
CA
ASN
D
136
49.983
37.279
156.506
1.00
75.36
6


ATOM
3444
CB
ASN
D
136
51.157
37.643
155.572
1.00
75.34
6


ATOM
3445
CG
ASN
D
136
51.405
36.607
154.495
1.00
75.68
6


ATOM
3446
OD1
ASN
D
136
52.547
36.392
154.085
1.00
76.30
8


ATOM
3447
ND2
ASN
D
136
50.343
35.961
154.026
1.00
76.17
7


ATOM
3448
C
ASN
D
136
50.223
37.945
157.869
1.00
75.50
6


ATOM
3449
O
ASN
D
136
50.143
39.172
158.017
1.00
75.57
8


ATOM
3450
OXT
ASN
D
136
50.494
37.277
158.867
1.00
75.61
8


ATOM
3451
O
HOH
W
1
39.138
62.572
162.958
1.00
35.50
8


ATOM
3452
O
HOH
W
2
23.650
56.588
178.179
1.00
14.86
8


ATOM
3453
O
HOH
W
3
29.968
72.539
172.433
1.00
39.04
8


ATOM
3454
O
HOH
W
4
15.687
58.071
156.392
1.00
42.72
8


ATOM
3455
O
HOH
W
5
53.222
71.911
156.097
1.00
17.44
8


ATOM
3456
O
HOH
W
7
7.516
45.583
169.214
1.00
27.95
8


ATOM
3457
O
HOH
W
8
21.763
70.506
166.534
1.00
52.40
8


ATOM
3458
O
HOH
W
9
40.935
72.205
154.010
1.00
52.17
8


ATOM
3459
O
HOH
W
10
25.966
55.823
176.389
1.00
33.09
8


ATOM
3460
O
HOH
W
11
22.985
68.007
186.404
1.00
31.73
8


ATOM
3461
O
HOH
W
12
19.448
80.405
148.664
1.00
55.55
8


ATOM
3462
O
HOH
W
13
45.407
70.720
157.818
1.00
51.51
8


ATOM
3463
O
HOH
W
14
63.737
34.018
250.378
1.00
32.05
8


ATOM
3464
O
HOH
W
15
47.212
38.556
218.411
1.00
49.21
8


ATOM
3465
O
HOH
W
16
15.743
67.512
164.830
1.00
48.95
8


ATOM
3466
O
HOH
W
17
22.476
54.851
168.024
1.00
38.77
8


ATOM
3467
O
HOH
W
18
41.039
72.232
147.406
1.00
42.02
8


ATOM
3468
O
HOH
W
19
19.457
49.799
183.166
1.00
51.67
8


ATOM
3469
O
HOH
W
20
50.654
61.154
152.546
1.00
50.46
8


ATOM
3470
O
HOH
W
21
49.970
57.246
176.606
1.00
41.58
8


ATOM
3471
O
HOH
W
22
15.170
61.276
178.334
1.00
54.81
8


ATOM
3472
O
HOH
W
23
50.212
50.934
189.517
1.00
60.63
8


ATOM
3473
O
HOH
W
24
21.739
52.101
175.735
1.00
60.72
8


ATOM
3474
O
HOH
W
25
33.393
54.787
148.401
1.00
52.56
8


ATOM
3475
O
HOH
W
26
15.340
61.743
143.921
1.00
71.13
8


ATOM
3476
O
HOH
W
27
45.833
67.108
136.296
1.00
58.98
8


ATOM
3477
O3
GOL
W
50
44.951
55.236
166.054
1.00
42.03
8


ATOM
3478
C3
GOL
W
50
43.576
55.492
166.281
1.00
44.24
6


ATOM
3479
C2
GOL
W
50
43.379
55.849
167.742
1.00
46.17
6


ATOM
3480
O2
GOL
W
50
43.678
54.769
168.615
1.00
45.85
8


ATOM
3481
C1
GOL
W
50
41.926
56.188
167.959
1.00
47.57
6


ATOM
3482
O1
GOL
W
50
41.639
55.649
169.238
1.00
52.52
8

## Claims

1. A crystal of a CC2-LZ domain of mammalian Nuclear factor kappa B Essential Modulator (NEMO), comprising at least one ankyrin 1D5 polypeptide having the sequence set forth in SEQ ID NO:5 and at least one CC2-LZ domain of mammalian NEMO, wherein the CC2-LZ domain comprises the amino acid sequence as set forth in SEQ ID NO:3 or SEQ ID NO:4, wherein the crystal has the following unit cell parameters:
a=b=63.5±5 Å:
c=437.5±5 Å; and
α=β=γ=90°;

and the crystal has a space group P43212.

2. The crystal of claim 1, wherein the crystallographic coordinates are as described in Table 1.

3. The crystal of claim 1, wherein the at least one ankyrin 1D5 polypeptide stabilizes the complex.

4. The crystal of claim 1, wherein the three-dimensional structure is obtained by X-ray diffraction, and the three-dimensional structure is as shown in FIGS. 2 and 3.

5. The crystal of claim 1, wherein the CC2-LZ domain having the amino acid sequence set forth in SEQ ID NO:3 comprises the mutation Val66Pro (V66P) and/or the mutation Phe55Ala (F55A), which mutations correspond to Val316Pro (V316P) and Phe305Ala (F305A) relative to the murine NEMO protein sequence set forth in SEQ ID NO:1.

6. The crystal of claim 1, wherein the CC2-LZ domain having the amino acid sequence set forth in SEQ ID NO:4 comprises the mutation Ala66Pro (A66P) and/or the mutation Phe55Ala (F55A), which mutations correspond to Ala323Pro (A323P) and Phe312Ala (F312A) relative to the human NEMO protein sequence set forth in SEQ ID NO:2.

7. A method of crystallizing an CC2-LZ domain of mammalian NEMO, comprising the following steps:
incubating at least one ankyrin 1D5 polypeptide having the sequence, set forth in SEQ ID NO:5 and an CC2-LZ domain comprising an amino acid sequence as set forth in SEQ ID NO:3 or SEQ ID NO:4; and
co-crystallizing the ankyrin CC2-LZ protein complex by growing crystals in a reservoir solution comprising 10% polyethylene glycol 40000, 5% isopropanol, 100 mM Na Hepes pH7.5, or a reservoir solution comprising 5% 2-methyl-2,4-pentadiol, 5% ethanol, 100 mM Na Hepes pH7.5, by vapour diffusion at 18-20° C. for more than 36 hours,
seeding with microcrystals, and
allowing growth for a few days to reach a size of 300×150×20 μm.

8. A crystal produced by the method of claim 7.