Datasets:

dzjxzyd

/

new_ppic_large_embed

like 0

[SH-] . n 1 ( [C@H] 2 [C@@H] ( [C@@H] ( [C@H] ( O 2 ) C O P ( = O ) ( [O-] ) O P ( O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) [n+] 2 c c ( C ( = O ) N ) c c c 2 ) ( [O-] ) = O ) O ) O ) c n c 2 c 1 n c n c 2 N . O

[O-] S ( = O ) [O-] . [H+] . N c 1 n c n c 2 c 1 n c n 2 [C@H] 1 [C@@H] ( [C@H] ( O ) [C@@H] ( C O P ( [O-] ) ( O P ( O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) N 2 C = C ( C ( = O ) N ) C C = C 2 ) ( [O-] ) = O ) = O ) O 1 ) O

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[H+] . [O-] P ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) N 1 C = C C C ( C ( = O ) N ) = C 1 ) ( O P ( [O-] ) ( O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c 2 n c n c ( c 2 n c 1 ) N ) = O ) = O . [O-] S ( [O-] ) = O

O . O = P ( O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( n 2 c n c 3 c 2 n c n c 3 N ) O 1 ) O ) ( [O-] ) O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( [n+] 2 c c ( C ( N ) = O ) c c c 2 ) O 1 ) O . [SH-]

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

O . C ( [C@@H] 1 [C@H] ( [C@H] ( [C@@H] ( O 1 ) n 1 c 2 c ( c ( N ) n c n 2 ) n c 1 ) O ) O ) O P ( [O-] ) ( = O ) O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) [n+] 1 c c c c ( C ( = O ) N ) c 1 ) O . [SH-]

[H+] . n 1 c 2 c ( n ( c 1 ) [C@H] 1 [C@H] ( O ) [C@H] ( O ) [C@H] ( O 1 ) C O P ( O P ( [O-] ) ( O C [C@@H] 1 [C@H] ( [C@H] ( [C@H] ( N 3 C = C C C ( C ( N ) = O ) = C 3 ) O 1 ) O ) O ) = O ) ( = O ) [O-] ) n c n c 2 N . S ( [O-] ) ( [O-] ) = O

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

c 1 2 n c n ( c 1 n c n c 2 N ) [C@H] 1 [C@H] ( O ) [C@H] ( O ) [C@@H] ( C O P ( O P ( O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@H] ( N 3 C = C C C ( = C 3 ) C ( = O ) N ) O 2 ) O ) ( [O-] ) = O ) ( = O ) [O-] ) O 1 . [H+] . [O-] S ( = O ) [O-]

n 1 c n c 2 c ( n c n 2 [C@H] 2 [C@H] ( O ) [C@H] ( O ) [C@H] ( O 2 ) C O P ( O P ( [O-] ) ( = O ) O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@@H] ( O 2 ) [n+] 2 c c c c ( c 2 ) C ( N ) = O ) O ) ( [O-] ) = O ) c 1 N . O . [SH-]

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

c 1 c c ( c [n+] ( [C@@H] 2 O [C@H] ( C O P ( = O ) ( [O-] ) O P ( [O-] ) ( O C [C@H] 3 O [C@H] ( [C@H] ( O ) [C@@H] 3 O ) n 3 c 4 n c n c ( N ) c 4 n c 3 ) = O ) [C@H] ( [C@H] 2 O ) O ) c 1 ) C ( N ) = O . O . [SH-]

O ( P ( [O-] ) ( O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c 2 c ( n c 1 ) c ( n c n 2 ) N ) = O ) P ( [O-] ) ( = O ) O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) N 1 C = C C C ( = C 1 ) C ( N ) = O . [H+] . O = S ( [O-] ) [O-]

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

[O-] S ( = O ) [O-] . [C@@H] 1 ( [C@H] ( N 2 C = C ( C ( N ) = O ) C C = C 2 ) O [C@@H] ( [C@H] 1 O ) C O P ( = O ) ( O P ( = O ) ( O C [C@H] 1 O [C@@H] ( n 2 c 3 n c n c ( c 3 n c 2 ) N ) [C@@H] ( [C@@H] 1 O ) O ) [O-] ) [O-] ) O . [H+]

[SH-] . O . c 1 [n+] ( c c c c 1 C ( = O ) N ) [C@H] 1 [C@@H] ( [C@H] ( O ) [C@@H] ( C O P ( [O-] ) ( = O ) O P ( = O ) ( O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) n 2 c 3 c ( c ( n c n 3 ) N ) n c 2 ) [O-] ) O 1 ) O

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

[SH-] . O . N C ( c 1 c c c [n+] ( c 1 ) [C@H] 1 [C@@H] ( [C@H] ( O ) [C@H] ( O 1 ) C O P ( = O ) ( [O-] ) O P ( O C [C@H] 1 O [C@@H] ( n 2 c 3 c ( n c 2 ) c ( N ) n c n 3 ) [C@@H] ( [C@@H] 1 O ) O ) ( [O-] ) = O ) O ) = O

O = S ( [O-] ) [O-] . C ( [C@H] 1 O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@H] ( O ) [C@@H] 1 O ) O P ( O P ( [O-] ) ( O C [C@H] 1 O [C@@H] ( N 2 C = C ( C ( = O ) N ) C C = C 2 ) [C@H] ( O ) [C@@H] 1 O ) = O ) ( [O-] ) = O . [H+]

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

N c 1 c 2 n c n ( [C@@H] 3 O [C@H] ( C O P ( [O-] ) ( = O ) O P ( O C [C@H] 4 O [C@H] ( [C@@H] ( [C@@H] 4 O ) O ) N 4 C = C ( C ( = O ) N ) C C = C 4 ) ( = O ) [O-] ) [C@H] ( [C@H] 3 O ) O ) c 2 n c n 1 . O = S ( [O-] ) [O-] . [H+]

[SH-] . O ( P ( = O ) ( O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) [n+] 1 c c c c ( c 1 ) C ( N ) = O ) [O-] ) P ( [O-] ) ( = O ) O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c n c 2 c ( N ) n c n c 1 2 . O

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

[SH-] . [C@@H] 1 ( O ) [C@@H] ( C O P ( O P ( O C [C@@H] 2 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( [n+] 3 c c c c ( c 3 ) C ( N ) = O ) O 2 ) ( = O ) [O-] ) ( = O ) [O-] ) O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@@H] 1 O . O

N 1 ( C = C C C ( = C 1 ) C ( N ) = O ) [C@H] 1 [C@H] ( O ) [C@H] ( O ) [C@@H] ( C O P ( = O ) ( [O-] ) O P ( = O ) ( O C [C@H] 2 O [C@H] ( [C@@H] ( [C@@H] 2 O ) O ) n 2 c n c 3 c ( n c n c 2 3 ) N ) [O-] ) O 1 . O = S ( [O-] ) [O-] . [H+]

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

S ( [O-] ) ( [O-] ) = O . O ( P ( O P ( O C [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@@H] ( O 1 ) n 1 c n c 2 c 1 n c n c 2 N ) O ) ( [O-] ) = O ) ( [O-] ) = O ) C [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@H] ( N 2 C = C C C ( C ( N ) = O ) = C 2 ) O 1 ) O . [H+]

O . O ( P ( [O-] ) ( O P ( O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( [n+] 2 c c c c ( C ( N ) = O ) c 2 ) O 1 ) ( [O-] ) = O ) = O ) C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c 2 n c n c ( N ) c 2 n c 1 ) O . [SH-]

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

O . [C@@H] 1 ( O ) [C@@H] ( [C@@H] ( C O P ( [O-] ) ( O P ( = O ) ( [O-] ) O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@H] ( [n+] 3 c c c c ( C ( = O ) N ) c 3 ) O 2 ) O ) = O ) O [C@H] 1 n 1 c 2 n c n c ( N ) c 2 n c 1 ) O . [SH-]

S ( = O ) ( [O-] ) [O-] . N C ( = O ) C 1 C C = C N ( C = 1 ) [C@H] 1 [C@@H] ( [C@H] ( O ) [C@@H] ( C O P ( = O ) ( [O-] ) O P ( [O-] ) ( = O ) O C [C@@H] 2 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 3 c n c 4 c ( n c n c 4 3 ) N ) O 2 ) O 1 ) O . [H+]

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

C 1 ( C C = C N ( C = 1 ) [C@@H] 1 O [C@H] ( C O P ( O P ( O C [C@@H] 2 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 3 c 4 c ( n c 3 ) c ( N ) n c n 4 ) O 2 ) ( = O ) [O-] ) ( [O-] ) = O ) [C@@H] ( O ) [C@H] 1 O ) C ( = O ) N . [O-] S ( = O ) [O-] . [H+]

O . [SH-] . n 1 c ( c 2 c ( n c 1 ) n ( [C@@H] 1 O [C@@H] ( [C@@H] ( O ) [C@H] 1 O ) C O P ( = O ) ( [O-] ) O P ( O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( [n+] 3 c c ( c c c 3 ) C ( = O ) N ) O 1 ) O ) ( [O-] ) = O ) c n 2 ) N

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

O . [SH-] . [n+] 1 ( c c ( c c c 1 ) C ( N ) = O ) [C@H] 1 [C@H] ( O ) [C@H] ( O ) [C@@H] ( C O P ( = O ) ( O P ( [O-] ) ( O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@@H] ( O 2 ) n 2 c 3 c ( n c 2 ) c ( n c n 3 ) N ) O ) = O ) [O-] ) O 1

C ( O P ( = O ) ( [O-] ) O P ( [O-] ) ( O C [C@H] 1 O [C@@H] ( n 2 c 3 c ( n c 2 ) c ( N ) n c n 3 ) [C@H] ( O ) [C@@H] 1 O ) = O ) [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) N 1 C = C ( C C = C 1 ) C ( N ) = O . [O-] S ( = O ) [O-] . [H+]

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[H+] . C 1 = C ( C C = C N 1 [C@H] 1 [C@H] ( O ) [C@@H] ( [C@@H] ( C O P ( [O-] ) ( O P ( = O ) ( [O-] ) O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) n 2 c 3 c ( n c 2 ) c ( N ) n c n 3 ) = O ) O 1 ) O ) C ( = O ) N . S ( [O-] ) ( = O ) [O-]

O [C@@H] 1 [C@H] ( O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( = O ) N ) [C@@H] 1 O ) C O P ( O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@H] ( n 2 c 3 c ( c ( N ) n c n 3 ) n c 2 ) O 1 ) O ) ( [O-] ) = O . [SH-] . O

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

O = C ( c 1 c [n+] ( [C@@H] 2 O [C@@H] ( [C@@H] ( O ) [C@H] 2 O ) C O P ( O P ( O C [C@H] 2 O [C@@H] ( n 3 c 4 n c n c ( c 4 n c 3 ) N ) [C@H] ( O ) [C@@H] 2 O ) ( [O-] ) = O ) ( [O-] ) = O ) c c c 1 ) N . [SH-] . O

[H+] . c 1 n c ( N ) c 2 c ( n ( [C@@H] 3 O [C@@H] ( [C@@H] ( O ) [C@H] 3 O ) C O P ( [O-] ) ( O P ( = O ) ( O C [C@@H] 3 [C@H] ( [C@@H] ( O ) [C@@H] ( O 3 ) N 3 C = C ( C ( N ) = O ) C C = C 3 ) O ) [O-] ) = O ) c n 2 ) n 1 . [O-] S ( [O-] ) = O

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

[H+] . [O-] S ( [O-] ) = O . c 1 ( N ) c 2 n c n ( [C@H] 3 [C@H] ( O ) [C@H] ( O ) [C@H] ( O 3 ) C O P ( = O ) ( O P ( = O ) ( [O-] ) O C [C@H] 3 O [C@H] ( [C@@H] ( [C@@H] 3 O ) O ) N 3 C = C C C ( = C 3 ) C ( = O ) N ) [O-] ) c 2 n c n 1

O . [SH-] . n 1 c ( c 2 n c n ( c 2 n c 1 ) [C@@H] 1 O [C@H] ( C O P ( O P ( = O ) ( [O-] ) O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) [n+] 2 c c ( c c c 2 ) C ( = O ) N ) ( [O-] ) = O ) [C@H] ( [C@H] 1 O ) O ) N

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

O . [SH-] . c 1 c c ( c [n+] ( c 1 ) [C@H] 1 [C@@H] ( [C@@H] ( [C@@H] ( C O P ( O P ( = O ) ( O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@H] ( n 3 c 4 c ( n c 3 ) c ( N ) n c n 4 ) O 2 ) O ) [O-] ) ( [O-] ) = O ) O 1 ) O ) O ) C ( = O ) N

[H+] . [O-] S ( = O ) [O-] . C ( N ) ( = O ) C 1 C C = C N ( [C@@H] 2 O [C@@H] ( [C@H] ( [C@H] 2 O ) O ) C O P ( O P ( [O-] ) ( O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@H] ( n 3 c 4 n c n c ( N ) c 4 n c 3 ) O 2 ) O ) = O ) ( [O-] ) = O ) C = 1

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

C ( [C@H] 1 O [C@@H] ( n 2 c n c 3 c ( N ) n c n c 2 3 ) [C@@H] ( [C@@H] 1 O ) O ) O P ( [O-] ) ( = O ) O P ( = O ) ( O C [C@@H] 1 [C@H] ( [C@H] ( [C@@H] ( O 1 ) N 1 C = C ( C C = C 1 ) C ( N ) = O ) O ) O ) [O-] . [O-] S ( = O ) [O-] . [H+]

[SH-] . P ( = O ) ( [O-] ) ( O P ( = O ) ( O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c 2 c ( n c 1 ) c ( N ) n c n 2 ) [O-] ) O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) [n+] 1 c c c c ( c 1 ) C ( N ) = O . O

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

[SH-] . c 1 [n+] ( [C@H] 2 [C@@H] ( [C@@H] ( [C@H] ( O 2 ) C O P ( = O ) ( [O-] ) O P ( = O ) ( O C [C@H] 2 O [C@H] ( [C@@H] ( [C@@H] 2 O ) O ) n 2 c n c 3 c ( n c n c 2 3 ) N ) [O-] ) O ) O ) c c ( c c 1 ) C ( = O ) N . O

C ( O P ( O P ( = O ) ( [O-] ) O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( n 2 c 3 n c n c ( N ) c 3 n c 2 ) O 1 ) O ) ( [O-] ) = O ) [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@H] ( N 2 C = C C C ( = C 2 ) C ( N ) = O ) O 1 ) O . S ( [O-] ) ( = O ) [O-] . [H+]

MSIDIDIIKARAKNEYRLSKVRGEAMISVRIPGGILPAHLLTVARDIAETWGNGQIHLTTRQKLAMPGIRYEDIDNVNAALEPFLREIEIELCDVQVEDTKAGYLAIGGRNIVACQGNRICQKANTDTTGLSRRLEKLVYPSPYHLKTVIVGCPNDCAKASMADLGIIGVAKMRFTADRCIGCGACVKACSHHAVGCLALKNGKAVKEESACIGCGECVLACPTLAWQRKPDQLWQVRLGGRTSKKTPRVGKLFLNWVTEDVIKQVIVNLYEFEKEMLGGKPIYLHMGHLIDKGGYLRFKERVLRGVQLNPEAMVAERIYWAEDESVARMHLKPAGH

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-6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

[O-] S ( = O ) [O-] . O [C@@H] 1 [C@H] ( O [C@H] ( [C@@H] 1 O ) N 1 C = C ( C ( N ) = O ) C C = C 1 ) C O P ( = O ) ( [O-] ) O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c 2 c ( n c 1 ) c ( N ) n c n 2 ) O . [H+]

O . [SH-] . n 1 c ( c 2 n c n ( [C@H] 3 [C@@H] ( [C@@H] ( [C@@H] ( C O P ( O P ( O C [C@H] 4 O [C@@H] ( [n+] 5 c c c c ( c 5 ) C ( N ) = O ) [C@@H] ( [C@@H] 4 O ) O ) ( [O-] ) = O ) ( = O ) [O-] ) O 3 ) O ) O ) c 2 n c 1 ) N

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-3.5615e-02, 1.1836e-01, -2.6072e-02, 1.1158e-01, 6.0494e-02, -8.8814e-02, 2.5081e-02, -2.0420e-02, -5.5561e-02, 1.6227e-01, 4.7788e-03, -3.5558e-02, 4.9843e-02, -4.9586e-02, -3.0185e-02, -4.0898e-02, 4.2484e-03, -2.1555e-02, 1.0724e-01, 9.3003e-02, 7.3949e-03, -4.8990e-02, -4.2655e-03, -6.7540e-02, -1.6086e-02, -8.8918e-02, -8.4208e-02, -2.1810e-01, 1.9277e-01, 4.1256e-02, 3.0461e-02, -2.0357e-02, -2.6282e-02, -1.1447e-01, -2.0652e-01, -5.8301e-02, -9.6935e-02, -1.7215e-01, -3.6261e-03, -1.9998e-02, -1.7206e-01, -5.6007e-02, 4.1930e-03, 1.3401e-01, -1.8231e-01, -5.7116e-02, 9.7622e-03, 2.8780e-02, 8.0689e-02, -1.7197e-01, 2.1200e-02, 2.7408e-02, -1.2314e-01, 3.0836e-02, 1.3877e-01, -3.3028e-02, 1.1961e-01, 3.8947e-02, -2.6842e-02, -7.7739e-02, -2.1374e-01, 1.1774e-01, -1.3118e-02, -1.2232e+00, -4.6920e-02, 1.7775e-01, -1.9445e-01, 1.0647e-01, -4.7496e-02, -1.0802e-01, -4.5834e-02, 7.3399e-02, 1.0272e-01, 3.4739e-05, -3.0586e-02, -6.8411e-03, 1.2126e-01, 7.0122e-02, -8.4341e-02, -6.4564e-02, -1.3539e-02, 4.0340e-02, 1.7351e-02]])

C ( C C C C C C C ) C C C C C C C ( C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@H] 2 O [C@H] ( C O ) [C@H] ( [C@@H] ( [C@H] 2 O ) O ) O ) O 1 ) O ) O ) = O ) C ( O ) C C C C C C C / C = C / C C C C C C

O [C@@H] 1 [C@@H] ( O ) [C@@H] ( O [C@H] 2 O [C@H] ( C O ) [C@H] ( [C@@H] ( [C@H] 2 O ) O ) O ) O [C@H] ( C O ) [C@H] 1 O . C ( C C C C C C C C C ( C ( O C [C@H] 1 O [C@H] ( O [C@@H] 2 [C@@H] ( [C@H] ( [C@@H] ( [C@H] ( O 2 ) C O C ( C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) = O ) O ) O ) O ) [C@@H] ( [C@@H] ( O ) [C@@H] 1 O ) O ) = O ) C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

tensor([[ 6.1016e-02, -1.6286e-01, 6.2596e-02, 1.9513e-01, 2.9609e-02, -5.6478e-02, -7.0681e-02, -2.3281e-03, -2.3263e-01, 1.1661e-01, 1.3569e-02, 6.7437e-03, -3.2567e-02, 1.0939e-01, 1.0152e-01, 1.0786e-01, -4.3715e-02, -1.4692e-01, -1.0124e-01, 6.6278e-02, 1.9833e-02, 3.7956e-02, -2.5723e-02, -5.0892e-02, -1.9698e-01, 1.8012e-01, 5.5799e-02, 9.7387e-02, -3.5723e-02, -1.2944e-01, -2.0120e-01, 9.2838e-02, 5.4778e-02, -1.5473e-01, 8.7529e-02, -4.2127e-02, 4.9006e-02, -1.1294e-01, -1.7914e-01, -6.4161e-02, -3.3385e-02, 1.2895e-02, -1.8580e-01, -1.7854e-01, -3.1950e-02, 6.1979e-02, 4.2326e+00, 2.2952e-03, -5.5035e-02, -1.3935e-01, 1.6863e-02, 3.2964e-02, -1.0490e-01, -1.3003e-01, -5.8463e-03, -8.3124e-02, 5.3050e-02, 2.5333e-02, 1.1709e-01, 6.7272e-03, -1.1511e-01, -6.3193e-02, 1.0441e-01, -2.7528e-02, -2.7236e-01, 1.1543e-01, -5.7202e-02, -2.1914e-01, -1.8061e-02, 7.8182e-02, -3.1166e-02, 8.7505e-02, 1.2710e-01, -1.2562e-01, -7.6321e-02, -1.0951e-02, -2.5337e-01, -1.2977e-01, 2.4333e-01, 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-9.4680e-02]])

O [C@H] 1 [C@H] ( O [C@H] ( C O ) [C@@H] ( O ) [C@@H] 1 O ) O [C@@H] 1 [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@H] ( O 1 ) C O ) O . C ( C C C C C C C C C C C C C C ) ( C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@H] ( O 1 ) O [C@@H] 1 [C@H] ( O ) [C@H] ( [C@@H] ( [C@H] ( O 1 ) C O C ( = O ) C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) O ) O ) O ) O ) = O ) C ( O ) C C C C C C C / C = C / C C C C C C

C ( C C C C C C ( C ( C C C C C C C C C C C C C C ) C ( = O ) O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( [C@H] ( [C@@H] ( O [C@H] 2 O [C@H] ( C O ) [C@@H] ( O ) [C@H] ( O ) [C@H] 2 O ) O 1 ) O ) O ) O ) C / C = C / C C C C C C

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

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-9.4680e-02]])

C ( [C@@H] 1 [C@@H] ( O ) [C@H] ( O ) [C@@H] ( O ) [C@H] ( O 1 ) O [C@H] 1 O [C@@H] ( [C@H] ( [C@@H] ( [C@H] 1 O ) O ) O ) C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) O

[C@H] 1 ( [C@H] ( [C@H] ( O ) [C@H] ( O [C@@H] 1 O [C@H] 1 O [C@@H] ( [C@H] ( [C@@H] ( [C@H] 1 O ) O ) O ) C O ) C O ) O ) O . C ( \ C C C C C C C C ( O ) C ( C C C C C C C C C C C C C C ) C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@H] ( [C@H] ( O 1 ) O [C@@H] 1 [C@H] ( O ) [C@@H] ( O ) [C@@H] ( [C@H] ( O 1 ) C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( O ) C C C C C C C / C = C / C C C C C C ) O ) O ) O ) O ) = O ) = C / C C C C C C

MTDLSEKVRAWGRRLLVGAAAAVTLPGLIGLAGGAATANAFSRPGLPVEYLQVPSAGMGRDIKVQFQSGGNGSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSVIMPVGGQSSFYADWYQPACGKAGCSTYKWETFLTSELPSYLASNKGVKRTGNAAVGISMSGSSAMILAVNHPDQFIYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKADAMWGPSSDPAWQRNDPSLHIPELVGHNTRLWLYCGNGTPSELGGANMPAEFLENFVRSSNLKFQDAYNGAGGHNAVFNFNANGTHSWEYWGAQLNAMKPDLQGTLGASPGGGG

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-7.5340e-02]])

C ( C C C C C ) C C C C C C C C C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@H] ( [C@@H] ( O [C@@H] 2 [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@@H] ( C O C ( C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) = O ) O 2 ) O ) O ) O 1 ) O ) O ) O ) = O . C ( [C@@H] 1 [C@H] ( [C@H] ( O ) [C@H] ( [C@@H] ( O [C@H] 2 O [C@@H] ( [C@H] ( [C@H] ( O ) [C@H] 2 O ) O ) C O ) O 1 ) O ) O ) O

C ( C C C C C C C C C C C C C ) C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@H] ( O ) [C@H] ( [C@@H] ( [C@H] ( O 2 ) C O ) O ) O ) O 1 ) O ) O ) = O

MTDLSEKVRAWGRRLLVGAAAAVTLPGLIGLAGGAATANAFSRPGLPVEYLQVPSAGMGRDIKVQFQSGGNGSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSVIMPVGGQSSFYADWYQPACGKAGCSTYKWETFLTSELPSYLASNKGVKRTGNAAVGISMSGSSAMILAVNHPDQFIYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKADAMWGPSSDPAWQRNDPSLHIPELVGHNTRLWLYCGNGTPSELGGANMPAEFLENFVRSSNLKFQDAYNGAGGHNAVFNFNANGTHSWEYWGAQLNAMKPDLQGTLGASPGGGG

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-7.5340e-02]])

O 1 [C@H] ( O [C@H] 2 O [C@@H] ( [C@H] ( [C@@H] ( [C@H] 2 O ) O ) O ) C O C ( = O ) C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) [C@H] ( O ) [C@@H] ( O ) [C@H] ( O ) [C@H] 1 C O

O [C@@H] 1 [C@H] ( [C@H] ( O [C@H] ( C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) [C@H] 1 O ) O [C@@H] 1 [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@@H] ( C O C ( C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) = O ) O 1 ) O ) O . [C@@H] 1 ( O ) [C@H] ( [C@H] ( O [C@H] ( C O ) [C@H] 1 O ) O [C@H] 1 O [C@@H] ( [C@H] ( [C@@H] ( [C@H] 1 O ) O ) O ) C O ) O

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O [C@@H] 1 [C@H] ( [C@H] ( O [C@@H] ( [C@H] 1 O ) C O ) O [C@H] 1 O [C@H] ( C O ) [C@H] ( [C@@H] ( [C@H] 1 O ) O ) O ) O . C ( C C C C C C C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C ( O C [C@H] 1 O [C@H] ( O [C@@H] 2 [C@@H] ( [C@H] ( [C@@H] ( [C@@H] ( C O C ( C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) = O ) O 2 ) O ) O ) O ) [C@H] ( O ) [C@@H] ( O ) [C@@H] 1 O ) = O ) C C C C C C C

O C [C@H] 1 O [C@@H] ( [C@@H] ( [C@H] ( [C@@H] 1 O ) O ) O ) O [C@@H] 1 [C@@H] ( [C@H] ( [C@@H] ( [C@H] ( O 1 ) C O C ( = O ) C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) O ) O ) O

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-8.0496e-02]])

C ( C ( C ( C C C C C C C C C C C C C C ) C ( O C [C@H] 1 O [C@H] ( O [C@H] 2 O [C@H] ( C O ) [C@@H] ( O ) [C@@H] ( [C@H] 2 O ) O ) [C@@H] ( [C@@H] ( O ) [C@@H] 1 O ) O ) = O ) O ) C C C C C C / C = C / C C C C C C

[C@@H] 1 ( O ) [C@H] ( O [C@H] ( O [C@@H] 2 [C@H] ( O ) [C@@H] ( O ) [C@@H] ( [C@@H] ( C O ) O 2 ) O ) [C@@H] ( [C@H] 1 O ) O ) C O . O = C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@H] ( O ) [C@H] ( [C@H] ( O ) [C@H] ( O 2 ) C O C ( C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) = O ) O ) O 1 ) O ) O ) C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C

MTFIDKIRGHWARRMTVAAVAALLLPGLVGVVGGSATAGAFSRPGLPVEYLMVPSPSMGRDIKVQFQSGGPGSHAVYLLDGLRAQDDFNGWDINTNAFEMFLDSGLSVVMPVGGQSSFYSDWYQPACGNNGCVTYKWETFLTSELPEWLAANRDVAATGNAAIGLSMAGSAALILAAYHPDRFIYAGSMSGFLNPSEGWWPFLINISMGDAGGYKANDMWGPTEDPNSAWKRNDPMVQIPRLVANNTRIWVYCGNGQPNELGGGDLPATFLEGLTIRTNETFRDNYIAAGGNNGVFNFPNNGTHNWAYWGRELQAMVPDLQRVLG

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-8.0496e-02]])

[C@@H] 1 ( O ) [C@@H] ( C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) O [C@@H] ( [C@H] ( O ) [C@H] 1 O ) O [C@@H] 1 [C@@H] ( [C@H] ( [C@@H] ( [C@@H] ( C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) O 1 ) O ) O ) O . O C [C@@H] 1 [C@H] ( [C@H] ( O ) [C@@H] ( O ) [C@@H] ( O [C@H] 2 O [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@H] 2 O ) C O ) O 1 ) O

C ( [C@@H] 1 [C@H] ( [C@H] ( O ) [C@H] ( [C@H] ( O 1 ) O [C@@H] 1 [C@@H] ( [C@H] ( [C@@H] ( [C@@H] ( C O ) O 1 ) O ) O ) O ) O ) O ) O C ( = O ) C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C

MTFIDKIRGHWARRMTVAAVAALLLPGLVGVVGGSATAGAFSRPGLPVEYLMVPSPSMGRDIKVQFQSGGPGSHAVYLLDGLRAQDDFNGWDINTNAFEMFLDSGLSVVMPVGGQSSFYSDWYQPACGNNGCVTYKWETFLTSELPEWLAANRDVAATGNAAIGLSMAGSAALILAAYHPDRFIYAGSMSGFLNPSEGWWPFLINISMGDAGGYKANDMWGPTEDPNSAWKRNDPMVQIPRLVANNTRIWVYCGNGQPNELGGGDLPATFLEGLTIRTNETFRDNYIAAGGNNGVFNFPNNGTHNWAYWGRELQAMVPDLQRVLG

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C ( C / C = C / C C C C C C ) C C C C C C ( O ) C ( C ( = O ) O C [C@H] 1 O [C@H] ( O [C@H] 2 O [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@H] 2 O ) C O ) [C@H] ( O ) [C@@H] ( O ) [C@@H] 1 O ) C C C C C C C C C C C C C C

C ( C C C C C ) / C = C / C C C C C C C C ( O ) C ( C ( O C [C@H] 1 O [C@H] ( O [C@@H] 2 [C@@H] ( [C@H] ( [C@H] ( O ) [C@H] ( O 2 ) C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) O ) O ) [C@H] ( O ) [C@H] ( [C@@H] 1 O ) O ) = O ) C C C C C C C C C C C C C C . [C@@H] 1 ( [C@H] ( O ) [C@H] ( O [C@@H] ( [C@@H] 1 O ) O [C@H] 1 O [C@@H] ( [C@H] ( [C@@H] ( [C@H] 1 O ) O ) O ) C O ) C O ) O

MTDLSEKVRAWGRRLLVGAAAAVTLPGLIGLAGGAATANAFSRPGLPVEYLQVPSAGMGRDIKVQFQSGGNGSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSVIMPVGGQSSFYADWYQPACGKAGCSTYKWETFLTSELPSYLASNKGVKRTGNAAVGISMSGSSAMILAVNHPDQFIYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKADAMWGPSSDPAWQRNDPSLHIPELVGHNTRLWLYCGNGTPSELGGANMPAEFLENFVRSSNLKFQDAYNGAGGHNAVFNFNANGTHSWEYWGAQLNAMKPDLQGTLGASPGGGG

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-1.6543e-01, 2.5152e-02, -4.7947e-02, 4.9256e-02, 6.4927e-02, -5.7997e-02, 5.1460e-02, -1.9741e-02, -4.3046e-02, -1.1372e-01, -2.0332e-02, 1.0749e-01, 2.7348e-02, 7.6898e-03, -1.4100e-01, -7.1047e-02, 2.9157e-02, 9.4885e-02, -6.8038e-02, 1.0444e-02, -1.4963e-01, -1.2629e-01, 1.3049e-01, -4.9642e-02, -1.0481e-01, 3.2069e-02, 1.3759e-01, 1.1495e-02, -6.5805e-02, 1.0209e-01, 2.3882e-02, -1.0536e-01, -1.5513e-01, -6.6501e-02, -7.1484e-02, 1.6747e-01, 1.5929e-02, 1.2495e-03, 5.0840e-03, 1.9036e-01, -1.8602e-01, 4.4955e-02, 9.6614e-02, 6.9393e-02, -7.7053e-02, 1.0960e-01, 1.5686e-01, -1.7532e-01, 5.1443e-02, -1.2963e-01, -5.2554e-02, -2.0325e-02, -2.5425e-01, 7.4044e-02, 5.3707e-02, 1.0110e-02, 1.5544e-01, 4.8660e-02, -1.9798e-01, -1.6514e-02, -4.7825e-03, -1.2593e+00, -1.4408e-01, -4.3588e-02, -1.1900e-01, 1.9287e-01, -3.1718e-02, -8.1187e-02, 1.6119e-02, 8.2135e-02, 1.5072e-01, -6.8412e-02, -2.2524e-02, -1.2819e-01, -6.2554e-03, 9.4556e-02, 1.2590e-01, 6.4741e-02, -8.7482e-02, 1.6073e-01, -7.5340e-02]])

C ( C / C = C / C C C C C C ) C C C C C C ( C ( C ( O C [C@@H] 1 [C@H] ( [C@H] ( O ) [C@H] ( [C@@H] ( O [C@@H] 2 [C@H] ( O ) [C@H] ( [C@H] ( O ) [C@@H] ( C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) O 2 ) O ) O 1 ) O ) O ) = O ) C C C C C C C C C C C C C C ) O . O C [C@H] 1 O [C@H] ( O [C@@H] 2 [C@H] ( O ) [C@@H] ( O ) [C@H] ( O ) [C@H] ( O 2 ) C O ) [C@@H] ( [C@@H] ( O ) [C@@H] 1 O ) O

[C@H] 1 ( [C@@H] ( C O C ( C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) = O ) O [C@@H] ( [C@H] ( O ) [C@H] 1 O ) O [C@@H] 1 [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@H] ( O 1 ) C O ) O ) O ) O

MTDLSEKVRAWGRRLLVGAAAAVTLPGLIGLAGGAATANAFSRPGLPVEYLQVPSAGMGRDIKVQFQSGGNGSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSVIMPVGGQSSFYADWYQPACGKAGCSTYKWETFLTSELPSYLASNKGVKRTGNAAVGISMSGSSAMILAVNHPDQFIYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKADAMWGPSSDPAWQRNDPSLHIPELVGHNTRLWLYCGNGTPSELGGANMPAEFLENFVRSSNLKFQDAYNGAGGHNAVFNFNANGTHSWEYWGAQLNAMKPDLQGTLGASPGGGG

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-7.5340e-02]])

C ( C C C C C C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C ( O C [C@@H] 1 [C@@H] ( O ) [C@H] ( O ) [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@@H] ( C O ) O 2 ) O ) O 1 ) = O ) C C C C C C C C

C ( C C C ( O ) C ( C C C C C C C C C C C C C C ) C ( O C [C@H] 1 O [C@H] ( O [C@H] 2 O [C@H] ( C O C ( C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) = O ) [C@H] ( [C@H] ( O ) [C@H] 2 O ) O ) [C@@H] ( [C@H] ( [C@@H] 1 O ) O ) O ) = O ) C C C C / C = C / C C C C C C . [C@H] 1 ( [C@@H] ( O ) [C@@H] ( [C@H] ( [C@@H] ( O [C@H] 2 O [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@H] 2 O ) O ) C O ) O 1 ) O ) O ) C O

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

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-9.4680e-02]])

C ( / C = C / C C C C C C C C ( C ( C ( = O ) O C [C@H] 1 O [C@@H] ( [C@H] ( O ) [C@H] ( [C@@H] 1 O ) O ) O [C@@H] 1 [C@H] ( O ) [C@H] ( [C@H] ( O ) [C@H] ( O 1 ) C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) O ) C C C C C C C C C C C C C C ) O ) C C C C C . O [C@H] 1 [C@H] ( O [C@H] ( C O ) [C@H] ( [C@@H] 1 O ) O ) O [C@H] 1 O [C@@H] ( [C@H] ( [C@H] ( O ) [C@H] 1 O ) O ) C O

C ( C C C C C ( O ) C ( C C C C C C C C C C C C C C ) C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@H] ( [C@@H] ( O [C@H] 2 O [C@H] ( C O ) [C@H] ( [C@H] ( O ) [C@H] 2 O ) O ) O 1 ) O ) O ) O ) = O ) C C / C = C / C C C C C C

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

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2.5586e-03, -7.7206e-02, -3.9593e-03, -6.0171e-02, -1.1745e-02, 3.8073e-02, 5.9175e-02, 7.9921e-02, -6.6618e-02, -1.8305e-01, 1.6630e-02, -1.2633e-01, 1.1885e-01, 1.1097e-01, -1.8672e-01, 1.7042e-01, 5.0956e-02, -2.0469e-02, -7.1185e-03, 2.5345e-02, 1.3051e-01, -1.4937e-01, 1.5113e-02, 1.7911e-01, 6.1113e-02, 8.6338e-02, 9.7132e-02, 9.2397e-02, 1.5410e-01, 1.2110e-01, 7.0784e-02, 6.7800e-02, 1.4812e-01, -1.9703e-01, -2.5394e-01, 1.2987e-01, -2.3406e-01, 1.7900e-01, 1.7263e-01, -4.4260e-02, 1.9520e-01, 6.8006e-02, -5.2780e-02, 1.6553e-01, -1.4597e-01, 2.4220e-01, 8.4957e-02, -9.3093e-02, -2.1672e-03, -7.3910e-02, 2.2002e-01, -8.0734e-02, -4.2590e-02, 2.7505e-02, -1.9906e-01, 2.0384e-01, -1.7173e-01, -1.2602e-02, -2.6605e-02, -2.4246e-01, 8.1172e-03, -4.0366e-02, 1.9739e-02, 1.3452e-01, -5.8770e-03, -2.0368e-02, 9.6610e-02, 1.2737e-02, 1.6593e-01, -4.7592e-02, 1.3418e-01, -7.4765e-02, -1.4911e-01, -4.2029e-02, -1.1631e-01, -1.8659e-01, -5.1267e-03, -1.1592e-01, 8.4934e-02, 1.5680e-01, -1.5450e-01, 4.0969e-02, -4.3777e-02, 3.0680e-02, 7.4497e-02, -5.4023e-02, 3.6940e-03, 2.8516e-02, -3.2107e-02, -1.3340e-01, -5.1724e-02, 1.4201e-01, 3.3430e-03, 6.1411e-02, -1.3747e-01, -8.6305e-02, 1.4112e-02, 9.9718e-02, -7.9595e-02, -1.2590e-02, -1.1221e-01, -1.2638e-01, 1.1462e-01, -2.5109e-02, -1.0684e-01, 3.5022e-02, 1.5200e-01, 6.1945e-02, -5.7889e-02, 6.9678e-02, 3.5659e-02, -1.4495e-01, -1.4037e-01, -6.6711e-02, -8.2214e-02, 1.4737e-01, 4.1666e-02, -1.0205e-02, 2.5123e-02, 1.8462e-01, -1.3765e-01, 7.7421e-02, 1.5933e-01, 5.2195e-02, -5.1854e-02, 1.5402e-01, 1.5463e-01, -2.1366e-01, 5.2954e-02, -1.2061e-01, -1.0638e-01, -6.1771e-02, -2.7186e-01, 7.4296e-02, 7.6231e-02, 2.2162e-02, 1.6424e-01, 2.4997e-02, -1.6159e-01, 2.6745e-02, -3.4960e-02, -1.0803e+00, -1.7597e-01, -4.8361e-02, -1.4116e-01, 2.3172e-01, -4.2003e-02, -1.0869e-01, -6.4779e-03, 5.4116e-02, 2.0485e-01, -5.0269e-02, -7.0831e-02, -1.2758e-01, -1.9415e-02, 5.9617e-02, 5.3605e-02, 4.8176e-02, -1.1337e-01, 1.7560e-01, -9.4680e-02]])

C ( C C C C / C = C / C C C C C C C C ( O ) C ( C C C C C C C C C C C C C C ) C ( O C [C@@H] 1 [C@@H] ( O ) [C@H] ( O ) [C@H] ( [C@@H] ( O [C@H] 2 O [C@@H] ( [C@H] ( [C@H] ( O ) [C@H] 2 O ) O ) C O ) O 1 ) O ) = O ) C

C ( C C ( C ( C C C C C C C C C C C C C C ) C ( = O ) O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@H] 2 O [C@H] ( C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) [C@H] ( [C@@H] ( [C@H] 2 O ) O ) O ) O 1 ) O ) O ) C C C C C / C = C / C C C C C C . O ( [C@H] 1 O [C@@H] ( [C@H] ( [C@@H] ( [C@H] 1 O ) O ) O ) C O ) [C@@H] 1 [C@H] ( O ) [C@@H] ( O ) [C@@H] ( [C@H] ( O 1 ) C O ) O

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

tensor([[ 6.1016e-02, -1.6286e-01, 6.2596e-02, 1.9513e-01, 2.9609e-02, -5.6478e-02, -7.0681e-02, -2.3281e-03, -2.3263e-01, 1.1661e-01, 1.3569e-02, 6.7437e-03, -3.2567e-02, 1.0939e-01, 1.0152e-01, 1.0786e-01, -4.3715e-02, -1.4692e-01, -1.0124e-01, 6.6278e-02, 1.9833e-02, 3.7956e-02, -2.5723e-02, -5.0892e-02, -1.9698e-01, 1.8012e-01, 5.5799e-02, 9.7387e-02, -3.5723e-02, -1.2944e-01, -2.0120e-01, 9.2838e-02, 5.4778e-02, -1.5473e-01, 8.7529e-02, -4.2127e-02, 4.9006e-02, -1.1294e-01, -1.7914e-01, -6.4161e-02, -3.3385e-02, 1.2895e-02, -1.8580e-01, -1.7854e-01, -3.1950e-02, 6.1979e-02, 4.2326e+00, 2.2952e-03, -5.5035e-02, -1.3935e-01, 1.6863e-02, 3.2964e-02, -1.0490e-01, -1.3003e-01, -5.8463e-03, -8.3124e-02, 5.3050e-02, 2.5333e-02, 1.1709e-01, 6.7272e-03, -1.1511e-01, -6.3193e-02, 1.0441e-01, -2.7528e-02, -2.7236e-01, 1.1543e-01, -5.7202e-02, -2.1914e-01, -1.8061e-02, 7.8182e-02, -3.1166e-02, 8.7505e-02, 1.2710e-01, -1.2562e-01, -7.6321e-02, -1.0951e-02, -2.5337e-01, -1.2977e-01, 2.4333e-01, 1.8885e-02, 2.9994e-01, -1.7805e-02, -1.0746e-01, 1.8354e-02, 7.3558e-02, -1.5940e-01, 1.0464e-02, -4.8018e-03, 7.7087e-02, 1.0760e-01, -7.2274e-02, 9.1059e-02, -6.1691e-02, -1.2712e-02, -1.3567e-01, 2.3535e-02, -1.6241e-01, 1.2363e-01, 1.1766e-01, 4.4456e-02, 6.5697e-02, -4.0225e-02, 1.4091e-01, 1.3977e-01, 2.8318e-02, -8.1837e-02, -2.2221e-02, 8.5137e-02, -1.2567e-01, -1.5949e-01, -1.0108e-01, -1.5057e-01, 2.0399e-03, -1.3025e-01, -1.0482e-01, 1.3452e-01, 1.0703e-01, 2.1043e-01, 6.4518e-02, -1.8016e-01, 2.8649e-02, 5.4702e-02, 2.4411e-01, 1.5347e-01, -2.2213e-01, -7.6049e-02, 1.5875e-01, -9.0950e-03, 2.7563e-02, 5.3119e-02, -1.5986e-01, 1.6490e-01, 9.7554e-02, 2.1283e-01, -1.8549e-02, 8.2916e-02, 1.0880e-01, 2.3828e-02, -8.7205e-02, 8.6105e-02, 5.8140e-02, -8.0948e-02, -1.8592e-01, 6.6777e-02, 1.4016e-02, -2.5431e-01, 4.1314e-02, 2.0157e-02, 1.7492e-01, 2.1764e-02, 2.1611e-02, 3.4622e-02, 2.6054e-02, 8.1098e-03, 7.6226e-02, 6.5143e-03, -1.3143e-01, -1.6449e-01, 1.5076e-02, 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9.2037e-02, -1.2021e-02, -3.8537e-03, -1.8736e-01, 6.6271e-02, -1.1615e-02, -6.6864e-03, -1.7501e-02, -3.3109e-02, -9.9789e-02, 7.7222e-03, 1.6434e-01, 4.4712e-02, 2.0857e-01, 5.6195e-02, -3.8834e-02, -1.1118e-01, -7.8814e-02, -2.2590e-01, 2.8570e-02, -1.3059e-01, 2.7014e-01, -8.3104e-02, 1.8750e-01, -2.4174e-01, -2.0673e-01, 1.5690e-01, 1.3545e-02, 1.7153e-01, -1.1069e-01, -2.9690e-02, 1.6092e-02, 3.1821e-02, 4.5913e-04, -1.4504e-01, -4.4838e-02, 1.0610e-01, -5.0231e-02, 3.5452e-03, -1.4766e-01, -5.0451e-02, 5.5262e-02, 1.3229e-01, -1.1615e-01, -6.5333e-03, 9.5977e-02, 8.6637e-02, 6.5446e-02, 1.2732e-01, 1.7524e-02, -1.5717e-01, -1.3052e-01, -7.5333e-02, 6.5389e-02, 2.1063e-02, 8.4505e-02, 1.7136e-02, 4.9413e-02, 5.9194e-02, 1.1972e-02, -5.3403e-01, 1.7347e-01, 1.6320e-01, 1.0109e-01, 1.0122e-01, 3.6678e-02, -2.4862e-01, -8.9595e-03, -2.6000e-01, 3.2292e-02, -8.9452e-02, 5.4265e-02, 3.2490e-02, 8.1684e-02, -1.3502e-01, 5.4476e-02, -5.4535e-02, 1.7146e-01, 4.6557e-02, 1.3798e-02, 2.5586e-03, -7.7206e-02, -3.9593e-03, -6.0171e-02, -1.1745e-02, 3.8073e-02, 5.9175e-02, 7.9921e-02, -6.6618e-02, -1.8305e-01, 1.6630e-02, -1.2633e-01, 1.1885e-01, 1.1097e-01, -1.8672e-01, 1.7042e-01, 5.0956e-02, -2.0469e-02, -7.1185e-03, 2.5345e-02, 1.3051e-01, -1.4937e-01, 1.5113e-02, 1.7911e-01, 6.1113e-02, 8.6338e-02, 9.7132e-02, 9.2397e-02, 1.5410e-01, 1.2110e-01, 7.0784e-02, 6.7800e-02, 1.4812e-01, -1.9703e-01, -2.5394e-01, 1.2987e-01, -2.3406e-01, 1.7900e-01, 1.7263e-01, -4.4260e-02, 1.9520e-01, 6.8006e-02, -5.2780e-02, 1.6553e-01, -1.4597e-01, 2.4220e-01, 8.4957e-02, -9.3093e-02, -2.1672e-03, -7.3910e-02, 2.2002e-01, -8.0734e-02, -4.2590e-02, 2.7505e-02, -1.9906e-01, 2.0384e-01, -1.7173e-01, -1.2602e-02, -2.6605e-02, -2.4246e-01, 8.1172e-03, -4.0366e-02, 1.9739e-02, 1.3452e-01, -5.8770e-03, -2.0368e-02, 9.6610e-02, 1.2737e-02, 1.6593e-01, -4.7592e-02, 1.3418e-01, -7.4765e-02, -1.4911e-01, -4.2029e-02, -1.1631e-01, -1.8659e-01, -5.1267e-03, -1.1592e-01, 8.4934e-02, 1.5680e-01, -1.5450e-01, 4.0969e-02, -4.3777e-02, 3.0680e-02, 7.4497e-02, -5.4023e-02, 3.6940e-03, 2.8516e-02, -3.2107e-02, -1.3340e-01, -5.1724e-02, 1.4201e-01, 3.3430e-03, 6.1411e-02, -1.3747e-01, -8.6305e-02, 1.4112e-02, 9.9718e-02, -7.9595e-02, -1.2590e-02, -1.1221e-01, -1.2638e-01, 1.1462e-01, -2.5109e-02, -1.0684e-01, 3.5022e-02, 1.5200e-01, 6.1945e-02, -5.7889e-02, 6.9678e-02, 3.5659e-02, -1.4495e-01, -1.4037e-01, -6.6711e-02, -8.2214e-02, 1.4737e-01, 4.1666e-02, -1.0205e-02, 2.5123e-02, 1.8462e-01, -1.3765e-01, 7.7421e-02, 1.5933e-01, 5.2195e-02, -5.1854e-02, 1.5402e-01, 1.5463e-01, -2.1366e-01, 5.2954e-02, -1.2061e-01, -1.0638e-01, -6.1771e-02, -2.7186e-01, 7.4296e-02, 7.6231e-02, 2.2162e-02, 1.6424e-01, 2.4997e-02, -1.6159e-01, 2.6745e-02, -3.4960e-02, -1.0803e+00, -1.7597e-01, -4.8361e-02, -1.4116e-01, 2.3172e-01, -4.2003e-02, -1.0869e-01, -6.4779e-03, 5.4116e-02, 2.0485e-01, -5.0269e-02, -7.0831e-02, -1.2758e-01, -1.9415e-02, 5.9617e-02, 5.3605e-02, 4.8176e-02, -1.1337e-01, 1.7560e-01, -9.4680e-02]])

C ( [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@@H] ( C O ) O 2 ) O ) O ) O 1 ) O ) O ) O . O = C ( O C [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@@H] ( C O C ( C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) = O ) O 2 ) O ) O ) O 1 ) O ) O ) C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C

C ( C ) C C C C C C C C C C C C C ( C ( = O ) O C [C@H] 1 O [C@H] ( O [C@H] 2 O [C@@H] ( [C@H] ( [C@H] ( O ) [C@H] 2 O ) O ) C O ) [C@H] ( O ) [C@@H] ( O ) [C@@H] 1 O ) C ( C C C C C C C / C = C / C C C C C C ) O

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

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-9.4680e-02]])

[C@H] 1 ( [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@@H] ( C O ) O 1 ) O ) O ) O [C@@H] 1 [C@@H] ( [C@H] ( [C@H] ( O ) [C@@H] ( C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( O ) C C C C C C C / C = C / C C C C C C ) O 1 ) O ) O

[C@H] 1 ( [C@H] ( [C@H] ( O ) [C@@H] ( O ) [C@@H] ( O [C@H] 2 O [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@H] 2 O ) O ) C O ) O 1 ) O ) C O . C C C C C C C C C C C C C C C ( C ( = O ) O C [C@@H] 1 [C@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@@H] ( C O C ( C ( C C C C C C C C C C C C C C ) C ( O ) C C C C C C C / C = C / C C C C C C ) = O ) O 2 ) O ) O ) O 1 ) O ) O ) C ( O ) C C C C C C C / C = C / C C C C C C

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

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-1.5450e-01, 4.0969e-02, -4.3777e-02, 3.0680e-02, 7.4497e-02, -5.4023e-02, 3.6940e-03, 2.8516e-02, -3.2107e-02, -1.3340e-01, -5.1724e-02, 1.4201e-01, 3.3430e-03, 6.1411e-02, -1.3747e-01, -8.6305e-02, 1.4112e-02, 9.9718e-02, -7.9595e-02, -1.2590e-02, -1.1221e-01, -1.2638e-01, 1.1462e-01, -2.5109e-02, -1.0684e-01, 3.5022e-02, 1.5200e-01, 6.1945e-02, -5.7889e-02, 6.9678e-02, 3.5659e-02, -1.4495e-01, -1.4037e-01, -6.6711e-02, -8.2214e-02, 1.4737e-01, 4.1666e-02, -1.0205e-02, 2.5123e-02, 1.8462e-01, -1.3765e-01, 7.7421e-02, 1.5933e-01, 5.2195e-02, -5.1854e-02, 1.5402e-01, 1.5463e-01, -2.1366e-01, 5.2954e-02, -1.2061e-01, -1.0638e-01, -6.1771e-02, -2.7186e-01, 7.4296e-02, 7.6231e-02, 2.2162e-02, 1.6424e-01, 2.4997e-02, -1.6159e-01, 2.6745e-02, -3.4960e-02, -1.0803e+00, -1.7597e-01, -4.8361e-02, -1.4116e-01, 2.3172e-01, -4.2003e-02, -1.0869e-01, -6.4779e-03, 5.4116e-02, 2.0485e-01, -5.0269e-02, -7.0831e-02, -1.2758e-01, -1.9415e-02, 5.9617e-02, 5.3605e-02, 4.8176e-02, -1.1337e-01, 1.7560e-01, -9.4680e-02]])

O [C@@H] 1 [C@H] ( O [C@H] ( O [C@H] 2 O [C@H] ( C O ) [C@H] ( [C@H] ( O ) [C@H] 2 O ) O ) [C@@H] ( [C@H] 1 O ) O ) C O . C ( C C C C C C C C C C C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C ( O C [C@H] 1 O [C@H] ( O [C@H] 2 O [C@H] ( C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) [C@@H] ( O ) [C@@H] ( [C@H] 2 O ) O ) [C@@H] ( [C@@H] ( O ) [C@@H] 1 O ) O ) = O ) C C C

C ( C C C ( C ( O C [C@@H] 1 [C@H] ( [C@H] ( O ) [C@H] ( [C@@H] ( O [C@H] 2 O [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@H] 2 O ) O ) C O ) O 1 ) O ) O ) = O ) C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C

MTLVDRLRGAVAGMPRRLVVGAAGAALLSGLIGAVGGSATAGAFSRPGLPVEYLQVPSAAMGRDIKVQFQSGGANSPALYLLDGMRAQDDFNGWDINTPAFEWYNQSGISVAMPVGGQSSFYSDWYKPACGKAGCTTYKWETFLTSELPQYLSAQKQVKPTGSGVVGLSMAGSSALILAAYHPDQFVYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKAADMWGPKEDPAWARNDPSLQVGKLVANNTRIWVYCGNGKPSDLGGDNLPAKFLEGFVRTSNLKFQDAYNGAGGHNAVWNFDANGTHDWPYWGAQLQAMKPDLQSVLGATPGAGPATAAATNAGNGQGT

tensor([[ 6.1016e-02, -1.6286e-01, 6.2596e-02, 1.9513e-01, 2.9609e-02, -5.6478e-02, -7.0681e-02, -2.3281e-03, -2.3263e-01, 1.1661e-01, 1.3569e-02, 6.7437e-03, -3.2567e-02, 1.0939e-01, 1.0152e-01, 1.0786e-01, -4.3715e-02, -1.4692e-01, -1.0124e-01, 6.6278e-02, 1.9833e-02, 3.7956e-02, -2.5723e-02, -5.0892e-02, -1.9698e-01, 1.8012e-01, 5.5799e-02, 9.7387e-02, -3.5723e-02, -1.2944e-01, -2.0120e-01, 9.2838e-02, 5.4778e-02, -1.5473e-01, 8.7529e-02, -4.2127e-02, 4.9006e-02, -1.1294e-01, -1.7914e-01, -6.4161e-02, -3.3385e-02, 1.2895e-02, -1.8580e-01, -1.7854e-01, -3.1950e-02, 6.1979e-02, 4.2326e+00, 2.2952e-03, -5.5035e-02, -1.3935e-01, 1.6863e-02, 3.2964e-02, -1.0490e-01, -1.3003e-01, -5.8463e-03, -8.3124e-02, 5.3050e-02, 2.5333e-02, 1.1709e-01, 6.7272e-03, -1.1511e-01, -6.3193e-02, 1.0441e-01, -2.7528e-02, -2.7236e-01, 1.1543e-01, -5.7202e-02, -2.1914e-01, -1.8061e-02, 7.8182e-02, -3.1166e-02, 8.7505e-02, 1.2710e-01, -1.2562e-01, -7.6321e-02, -1.0951e-02, -2.5337e-01, -1.2977e-01, 2.4333e-01, 1.8885e-02, 2.9994e-01, -1.7805e-02, -1.0746e-01, 1.8354e-02, 7.3558e-02, -1.5940e-01, 1.0464e-02, -4.8018e-03, 7.7087e-02, 1.0760e-01, -7.2274e-02, 9.1059e-02, -6.1691e-02, -1.2712e-02, -1.3567e-01, 2.3535e-02, -1.6241e-01, 1.2363e-01, 1.1766e-01, 4.4456e-02, 6.5697e-02, -4.0225e-02, 1.4091e-01, 1.3977e-01, 2.8318e-02, -8.1837e-02, -2.2221e-02, 8.5137e-02, -1.2567e-01, -1.5949e-01, -1.0108e-01, -1.5057e-01, 2.0399e-03, -1.3025e-01, -1.0482e-01, 1.3452e-01, 1.0703e-01, 2.1043e-01, 6.4518e-02, -1.8016e-01, 2.8649e-02, 5.4702e-02, 2.4411e-01, 1.5347e-01, -2.2213e-01, -7.6049e-02, 1.5875e-01, -9.0950e-03, 2.7563e-02, 5.3119e-02, -1.5986e-01, 1.6490e-01, 9.7554e-02, 2.1283e-01, -1.8549e-02, 8.2916e-02, 1.0880e-01, 2.3828e-02, -8.7205e-02, 8.6105e-02, 5.8140e-02, -8.0948e-02, -1.8592e-01, 6.6777e-02, 1.4016e-02, -2.5431e-01, 4.1314e-02, 2.0157e-02, 1.7492e-01, 2.1764e-02, 2.1611e-02, 3.4622e-02, 2.6054e-02, 8.1098e-03, 7.6226e-02, 6.5143e-03, -1.3143e-01, -1.6449e-01, 1.5076e-02, 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2.5586e-03, -7.7206e-02, -3.9593e-03, -6.0171e-02, -1.1745e-02, 3.8073e-02, 5.9175e-02, 7.9921e-02, -6.6618e-02, -1.8305e-01, 1.6630e-02, -1.2633e-01, 1.1885e-01, 1.1097e-01, -1.8672e-01, 1.7042e-01, 5.0956e-02, -2.0469e-02, -7.1185e-03, 2.5345e-02, 1.3051e-01, -1.4937e-01, 1.5113e-02, 1.7911e-01, 6.1113e-02, 8.6338e-02, 9.7132e-02, 9.2397e-02, 1.5410e-01, 1.2110e-01, 7.0784e-02, 6.7800e-02, 1.4812e-01, -1.9703e-01, -2.5394e-01, 1.2987e-01, -2.3406e-01, 1.7900e-01, 1.7263e-01, -4.4260e-02, 1.9520e-01, 6.8006e-02, -5.2780e-02, 1.6553e-01, -1.4597e-01, 2.4220e-01, 8.4957e-02, -9.3093e-02, -2.1672e-03, -7.3910e-02, 2.2002e-01, -8.0734e-02, -4.2590e-02, 2.7505e-02, -1.9906e-01, 2.0384e-01, -1.7173e-01, -1.2602e-02, -2.6605e-02, -2.4246e-01, 8.1172e-03, -4.0366e-02, 1.9739e-02, 1.3452e-01, -5.8770e-03, -2.0368e-02, 9.6610e-02, 1.2737e-02, 1.6593e-01, -4.7592e-02, 1.3418e-01, -7.4765e-02, -1.4911e-01, -4.2029e-02, -1.1631e-01, -1.8659e-01, -5.1267e-03, -1.1592e-01, 8.4934e-02, 1.5680e-01, -1.5450e-01, 4.0969e-02, -4.3777e-02, 3.0680e-02, 7.4497e-02, -5.4023e-02, 3.6940e-03, 2.8516e-02, -3.2107e-02, -1.3340e-01, -5.1724e-02, 1.4201e-01, 3.3430e-03, 6.1411e-02, -1.3747e-01, -8.6305e-02, 1.4112e-02, 9.9718e-02, -7.9595e-02, -1.2590e-02, -1.1221e-01, -1.2638e-01, 1.1462e-01, -2.5109e-02, -1.0684e-01, 3.5022e-02, 1.5200e-01, 6.1945e-02, -5.7889e-02, 6.9678e-02, 3.5659e-02, -1.4495e-01, -1.4037e-01, -6.6711e-02, -8.2214e-02, 1.4737e-01, 4.1666e-02, -1.0205e-02, 2.5123e-02, 1.8462e-01, -1.3765e-01, 7.7421e-02, 1.5933e-01, 5.2195e-02, -5.1854e-02, 1.5402e-01, 1.5463e-01, -2.1366e-01, 5.2954e-02, -1.2061e-01, -1.0638e-01, -6.1771e-02, -2.7186e-01, 7.4296e-02, 7.6231e-02, 2.2162e-02, 1.6424e-01, 2.4997e-02, -1.6159e-01, 2.6745e-02, -3.4960e-02, -1.0803e+00, -1.7597e-01, -4.8361e-02, -1.4116e-01, 2.3172e-01, -4.2003e-02, -1.0869e-01, -6.4779e-03, 5.4116e-02, 2.0485e-01, -5.0269e-02, -7.0831e-02, -1.2758e-01, -1.9415e-02, 5.9617e-02, 5.3605e-02, 4.8176e-02, -1.1337e-01, 1.7560e-01, -9.4680e-02]])

C ( C C C C C / C = C / C C C C C C ) C C ( O ) C ( C C C C C C C C C C C C C C ) C ( = O ) O C [C@@H] 1 [C@H] ( [C@H] ( O ) [C@H] ( [C@@H] ( O [C@@H] 2 [C@H] ( O ) [C@@H] ( O ) [C@@H] ( [C@H] ( O 2 ) C O ) O ) O 1 ) O ) O

C ( [C@@H] 1 [C@@H] ( O ) [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@H] 2 O [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@H] 2 O ) C O ) O 1 ) O ) O . C ( C C C C C C C ) C C C C C C C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C ( = O ) O C [C@H] 1 O [C@@H] ( [C@@H] ( [C@@H] ( O ) [C@@H] 1 O ) O ) O [C@H] 1 O [C@@H] ( [C@@H] ( O ) [C@@H] ( [C@H] 1 O ) O ) C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( O ) C C C C C C C / C = C / C C C C C C

MTDLSEKVRAWGRRLLVGAAAAVTLPGLIGLAGGAATANAFSRPGLPVEYLQVPSAGMGRDIKVQFQSGGNGSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSVIMPVGGQSSFYADWYQPACGKAGCSTYKWETFLTSELPSYLASNKGVKRTGNAAVGISMSGSSAMILAVNHPDQFIYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKADAMWGPSSDPAWQRNDPSLHIPELVGHNTRLWLYCGNGTPSELGGANMPAEFLENFVRSSNLKFQDAYNGAGGHNAVFNFNANGTHSWEYWGAQLNAMKPDLQGTLGASPGGGG

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[C@@H] 1 ( O [C@H] ( O [C@H] 2 O [C@H] ( C O ) [C@@H] ( O ) [C@H] ( O ) [C@H] 2 O ) [C@@H] ( [C@H] ( [C@@H] 1 O ) O ) O ) C O . O ( C [C@H] 1 O [C@H] ( O [C@@H] 2 [C@@H] ( [C@H] ( [C@@H] ( [C@@H] ( C O C ( = O ) C ( C C C C C C C C C C C C C C ) C ( C C C C C C C / C = C / C C C C C C ) O ) O 2 ) O ) O ) O ) [C@H] ( O ) [C@@H] ( O ) [C@@H] 1 O ) C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O

C ( C C ( C ( C ( = O ) O C [C@H] 1 O [C@@H] ( [C@@H] ( [C@H] ( [C@@H] 1 O ) O ) O ) O [C@@H] 1 [C@@H] ( [C@H] ( [C@@H] ( [C@@H] ( C O ) O 1 ) O ) O ) O ) C C C C C C C C C C C C C C ) O ) C C C C C / C = C / C C C C C C

MTDLSEKVRAWGRRLLVGAAAAVTLPGLIGLAGGAATANAFSRPGLPVEYLQVPSAGMGRDIKVQFQSGGNGSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSVIMPVGGQSSFYADWYQPACGKAGCSTYKWETFLTSELPSYLASNKGVKRTGNAAVGISMSGSSAMILAVNHPDQFIYAGSLSALLDPSQGMGPSLIGLAMGDAGGYKADAMWGPSSDPAWQRNDPSLHIPELVGHNTRLWLYCGNGTPSELGGANMPAEFLENFVRSSNLKFQDAYNGAGGHNAVFNFNANGTHSWEYWGAQLNAMKPDLQGTLGASPGGGG

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-1.6543e-01, 2.5152e-02, -4.7947e-02, 4.9256e-02, 6.4927e-02, -5.7997e-02, 5.1460e-02, -1.9741e-02, -4.3046e-02, -1.1372e-01, -2.0332e-02, 1.0749e-01, 2.7348e-02, 7.6898e-03, -1.4100e-01, -7.1047e-02, 2.9157e-02, 9.4885e-02, -6.8038e-02, 1.0444e-02, -1.4963e-01, -1.2629e-01, 1.3049e-01, -4.9642e-02, -1.0481e-01, 3.2069e-02, 1.3759e-01, 1.1495e-02, -6.5805e-02, 1.0209e-01, 2.3882e-02, -1.0536e-01, -1.5513e-01, -6.6501e-02, -7.1484e-02, 1.6747e-01, 1.5929e-02, 1.2495e-03, 5.0840e-03, 1.9036e-01, -1.8602e-01, 4.4955e-02, 9.6614e-02, 6.9393e-02, -7.7053e-02, 1.0960e-01, 1.5686e-01, -1.7532e-01, 5.1443e-02, -1.2963e-01, -5.2554e-02, -2.0325e-02, -2.5425e-01, 7.4044e-02, 5.3707e-02, 1.0110e-02, 1.5544e-01, 4.8660e-02, -1.9798e-01, -1.6514e-02, -4.7825e-03, -1.2593e+00, -1.4408e-01, -4.3588e-02, -1.1900e-01, 1.9287e-01, -3.1718e-02, -8.1187e-02, 1.6119e-02, 8.2135e-02, 1.5072e-01, -6.8412e-02, -2.2524e-02, -1.2819e-01, -6.2554e-03, 9.4556e-02, 1.2590e-01, 6.4741e-02, -8.7482e-02, 1.6073e-01, -7.5340e-02]])

C ( C C C C ) C / C = C / C C C C C C C C ( O ) C ( C ( = O ) O C [C@H] 1 O [C@H] ( O [C@@H] 2 [C@H] ( O ) [C@@H] ( O ) [C@H] ( O ) [C@H] ( O 2 ) C O ) [C@@H] ( [C@@H] ( O ) [C@@H] 1 O ) O ) C C C C C C C C C C C C C C

C ( O ) [C@H] 1 O [C@@H] ( [C@H] ( O ) [C@@H] ( O ) [C@@H] 1 O ) O [C@H] 1 O [C@H] ( C O ) [C@@H] ( O ) [C@H] ( O ) [C@H] 1 O . O [C@H] 1 [C@H] ( O [C@H] ( C O C ( C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) = O ) [C@@H] ( O ) [C@@H] 1 O ) O [C@H] 1 O [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@H] 1 O ) C O C ( C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) = O

MTFIDKIRGHWARRMTVAAVAALLLPGLVGVVGGSATAGAFSRPGLPVEYLMVPSPSMGRDIKVQFQSGGPGSHAVYLLDGLRAQDDFNGWDINTNAFEMFLDSGLSVVMPVGGQSSFYSDWYQPACGNNGCVTYKWETFLTSELPEWLAANRDVAATGNAAIGLSMAGSAALILAAYHPDRFIYAGSMSGFLNPSEGWWPFLINISMGDAGGYKANDMWGPTEDPNSAWKRNDPMVQIPRLVANNTRIWVYCGNGQPNELGGGDLPATFLEGLTIRTNETFRDNYIAAGGNNGVFNFPNNGTHNWAYWGRELQAMVPDLQRVLG

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-8.0496e-02]])

O [C@H] 1 [C@@H] ( [C@@H] ( O ) [C@@H] ( O [C@@H] 2 [C@@H] ( [C@@H] ( O ) [C@H] ( O ) [C@@H] ( C O ) O 2 ) O ) O [C@@H] 1 C O ) O . C ( C ) C C C C C C C C C C C C C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C ( = O ) O C [C@H] 1 O [C@H] ( O [C@H] 2 O [C@H] ( C O C ( C ( C ( O ) C C C C C C C / C = C / C C C C C C ) C C C C C C C C C C C C C C ) = O ) [C@@H] ( O ) [C@@H] ( [C@H] 2 O ) O ) [C@H] ( O ) [C@H] ( [C@@H] 1 O ) O

O [C@H] 1 [C@@H] ( O [C@@H] 2 [C@@H] ( [C@H] ( [C@@H] ( [C@@H] ( C O C ( C ( C ( C C C C C C C / C = C / C C C C C C ) O ) C C C C C C C C C C C C C C ) = O ) O 2 ) O ) O ) O ) O [C@H] ( C O ) [C@@H] ( O ) [C@@H] 1 O

MTFIDKIRGHWARRMTVAAVAALLLPGLVGVVGGSATAGAFSRPGLPVEYLMVPSPSMGRDIKVQFQSGGPGSHAVYLLDGLRAQDDFNGWDINTNAFEMFLDSGLSVVMPVGGQSSFYSDWYQPACGNNGCVTYKWETFLTSELPEWLAANRDVAATGNAAIGLSMAGSAALILAAYHPDRFIYAGSMSGFLNPSEGWWPFLINISMGDAGGYKANDMWGPTEDPNSAWKRNDPMVQIPRLVANNTRIWVYCGNGQPNELGGGDLPATFLEGLTIRTNETFRDNYIAAGGNNGVFNFPNNGTHNWAYWGRELQAMVPDLQRVLG

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[C@@H] 1 ( [C@@H] ( O ) [C@@H] ( O [C@@H] 1 C O P ( = O ) ( [O-] ) O P ( O C [C@H] 1 O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( N ) = O ) [C@H] ( O ) [C@@H] 1 O ) ( = O ) [O-] ) n 1 c n c 2 c 1 n c n c 2 N ) O . C 1 ( [C@@H] ( [C@H] 1 C = O ) C = C ( C ) C ) ( C ) C . O

[H+] . [C@H] 1 ( O [C@H] ( C O P ( O P ( = O ) ( [O-] ) O C [C@@H] 2 [C@@H] ( O ) [C@H] ( [C@H] ( N 3 C = C ( C ( = O ) N ) C C = C 3 ) O 2 ) O ) ( = O ) [O-] ) [C@@H] ( O ) [C@H] 1 O ) n 1 c 2 c ( c ( n c n 2 ) N ) n c 1 . C C 1 ( C ) [C@H] ( C ( [O-] ) = O ) [C@H] 1 C = C ( C ) C

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2.2404e-01, 1.6001e-02, 1.9559e-02, -3.7437e-02, -1.1785e-01, 1.6102e-02, 1.7144e-01, -3.7973e-02, 1.0903e-01, -5.2819e-02, -1.0549e-01, 1.5005e-01, -6.2337e-02, -2.1862e-01, -3.5000e-02, -2.9718e-01, -5.9984e-02, 1.1212e-01, 1.3698e-01, -2.8704e-02, -1.6094e-02, 4.8916e-02, -3.7723e-02, 8.8993e-02, -2.0819e-01, 2.5814e-02, -8.7043e-02, 3.5603e-02, -6.3582e-02, 5.4812e-02, 1.0183e-01, 6.9785e-04, -1.1602e-01, -1.5639e-01, -1.5295e-01, -1.9695e-01, 1.2396e-03, -5.6632e-02, 1.0207e-01, 3.3131e-02, 1.8178e-01, 8.6714e-02, 4.2934e-01, 4.5237e-02, -4.7493e-02, 2.4301e-02, 2.0902e-01, 9.5740e-02, -3.9917e-02, 4.2575e-02, -7.0493e-02, -3.6524e-02, 1.6931e-02, -1.6062e-01, 1.3029e-01, -3.0359e-02, 2.0623e-01, 9.3877e-02, -7.7737e-02, -2.7300e-01, 3.6877e-03, -8.1714e-02, -7.0385e-01, -1.1378e-01, 8.8448e-03, -1.1781e-01, 2.4588e-01, -2.1790e-01, -8.6528e-02, -1.3717e-01, 2.0169e-01, 2.7701e-01, 6.0508e-02, -2.5265e-02, -6.5406e-02, 1.8930e-01, -2.4287e-02, 3.5849e-02, -3.7835e-02, -7.9926e-02, -1.1035e-01, 3.5665e-02]])

[H+] . C C 1 ( [C@H] ( C ( [O-] ) = O ) [C@H] 1 C = C ( C ) C ) C . [C@H] 1 ( N 2 C = C C C ( C ( = O ) N ) = C 2 ) [C@H] ( O ) [C@H] ( O ) [C@H] ( O 1 ) C O P ( = O ) ( [O-] ) O P ( = O ) ( [O-] ) O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c 2 n c n c ( N ) c 2 n c 1

[C@@H] 1 ( C = C ( C ) C ) [C@@H] ( C = O ) C 1 ( C ) C . c 1 2 n c n c ( c 2 n c n 1 [C@@H] 1 O [C@H] ( C O P ( = O ) ( O P ( = O ) ( [O-] ) O C [C@H] 2 O [C@@H] ( [n+] 3 c c ( C ( N ) = O ) c c c 3 ) [C@@H] ( [C@@H] 2 O ) O ) [O-] ) [C@@H] ( O ) [C@H] 1 O ) N . O

MSSGANGNSKSLAYDIKFTKLFINGEFVDSISGSTFETIDPATEEVLATVAEGREEDVDLAVKAAREAFDNGPWPRLSGEARRKILLKFADLIEENADEIATLEVIDTGKPFQIARYVENSWTSETFRYFAGAADKIRGATLKMSSDFQAYTLREPIGVVGHIIPWNAPAYLFAMKVAPALAAGCTVVIKPAENTPLVGLFMAYLSKLAGVPDGVINVVNGFGSTAGAAVSSHMDIDAVTFTGSTKVGRTIMQAAAASNLKPVSLELGGKSPFIVFDDADIEKAAEIAVLGVLSNKGELCVAGSRVFVHEGIYDAFVKKLEATVKNWATGDRFDAATRHGPQNNKQQYEKVLSYIELGKKEGATLVTGGKPFGNKGYYIEPTLFTNVTDEMTIAKEEIFGPVIMVLKFKTIEEVIRRANATTYGLAAGIMTKNIDIANTVTRSIRAGSVWVNCYLALDRDTPFGGYKMSGFGREQGLEALEHYLQVKTVTTPIYNSPWL

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-1.1035e-01, 3.5665e-02]])

C C ( C ) = C [C@@H] 1 [C@H] ( C 1 ( C ) C ) C = O . n 1 c ( N ) c 2 c ( n c 1 ) n ( c n 2 ) [C@@H] 1 O [C@H] ( C O P ( O P ( [O-] ) ( O C [C@@H] 2 [C@H] ( [C@@H] ( O ) [C@@H] ( O 2 ) [n+] 2 c c ( C ( N ) = O ) c c c 2 ) O ) = O ) ( = O ) [O-] ) [C@H] ( [C@H] 1 O ) O . O

[H+] . C 1 ( C ) ( C ) [C@H] ( C ( [O-] ) = O ) [C@H] 1 C = C ( C ) C . O [C@@H] 1 [C@@H] ( [C@@H] ( C O P ( [O-] ) ( = O ) O P ( [O-] ) ( = O ) O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) n 2 c 3 c ( n c 2 ) c ( n c n 3 ) N ) O [C@H] 1 N 1 C = C C C ( C ( = O ) N ) = C 1 ) O

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[H+] . C C 1 ( C ) [C@@H] ( [C@H] 1 C ( = O ) [O-] ) C = C ( C ) C . N C ( = O ) C 1 C C = C N ( [C@@H] 2 O [C@@H] ( [C@H] ( [C@H] 2 O ) O ) C O P ( = O ) ( O P ( O C [C@@H] 2 [C@H] ( [C@H] ( [C@H] ( n 3 c 4 n c n c ( c 4 n c 3 ) N ) O 2 ) O ) O ) ( [O-] ) = O ) [O-] ) C = 1

C C ( = C [C@H] 1 C ( [C@@H] 1 C = O ) ( C ) C ) C . [O-] P ( O P ( = O ) ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c 2 n c n c ( N ) c 2 n c 1 ) [O-] ) ( O C [C@@H] 1 [C@H] ( [C@H] ( [C@H] ( [n+] 2 c c c c ( C ( N ) = O ) c 2 ) O 1 ) O ) O ) = O . O

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-1.1035e-01, 3.5665e-02]])

C 1 ( [C@@H] ( [C@H] 1 C = C ( C ) C ) C = O ) ( C ) C . O = P ( [O-] ) ( O P ( O C [C@H] 1 O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( = O ) N ) [C@H] ( O ) [C@@H] 1 O ) ( = O ) [O-] ) O C [C@@H] 1 [C@H] ( [C@H] ( [C@@H] ( O 1 ) n 1 c n c 2 c ( N ) n c n c 2 1 ) O ) O . O

[H+] . C ( [C@@H] 1 [C@@H] ( C ( = O ) [O-] ) C 1 ( C ) C ) = C ( C ) C . O ( C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) N 1 C = C C C ( = C 1 ) C ( = O ) N ) P ( [O-] ) ( O P ( [O-] ) ( O C [C@H] 1 O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@H] ( O ) [C@@H] 1 O ) = O ) = O

MSSGANGNSKSLAYDIKFTKLFINGEFVDSISGSTFETIDPATEEVLATVAEGREEDVDLAVKAAREAFDNGPWPRLSGEARRKILLKFADLIEENADEIATLEVIDTGKPFQIARYVENSWTSETFRYFAGAADKIRGATLKMSSDFQAYTLREPIGVVGHIIPWNAPAYLFAMKVAPALAAGCTVVIKPAENTPLVGLFMAYLSKLAGVPDGVINVVNGFGSTAGAAVSSHMDIDAVTFTGSTKVGRTIMQAAAASNLKPVSLELGGKSPFIVFDDADIEKAAEIAVLGVLSNKGELCVAGSRVFVHEGIYDAFVKKLEATVKNWATGDRFDAATRHGPQNNKQQYEKVLSYIELGKKEGATLVTGGKPFGNKGYYIEPTLFTNVTDEMTIAKEEIFGPVIMVLKFKTIEEVIRRANATTYGLAAGIMTKNIDIANTVTRSIRAGSVWVNCYLALDRDTPFGGYKMSGFGREQGLEALEHYLQVKTVTTPIYNSPWL

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-1.1035e-01, 3.5665e-02]])

[H+] . [O-] C ( [C@@H] 1 [C@H] ( C 1 ( C ) C ) C = C ( C ) C ) = O . [O-] P ( = O ) ( O C [C@H] 1 O [C@@H] ( N 2 C = C ( C C = C 2 ) C ( N ) = O ) [C@H] ( O ) [C@@H] 1 O ) O P ( = O ) ( [O-] ) O C [C@@H] 1 [C@H] ( [C@H] ( [C@@H] ( O 1 ) n 1 c n c 2 c ( N ) n c n c 1 2 ) O ) O

O [C@H] 1 [C@@H] ( O [C@@H] ( [C@H] 1 O ) C O P ( O P ( [O-] ) ( O C [C@H] 1 O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( = O ) N ) [C@@H] ( [C@@H] 1 O ) O ) = O ) ( [O-] ) = O ) n 1 c n c 2 c 1 n c n c 2 N . C 1 ( C ) ( C ) [C@@H] ( [C@H] 1 C = C ( C ) C ) C = O . O

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-1.1035e-01, 3.5665e-02]])

O [C@@H] 1 [C@H] ( O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( N ) = O ) [C@@H] 1 O ) C O P ( [O-] ) ( O P ( O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 2 c 3 c ( c ( n c n 3 ) N ) n c 2 ) O 1 ) ( = O ) [O-] ) = O . C C ( = C [C@H] 1 C ( [C@@H] 1 C = O ) ( C ) C ) C . O

[H+] . C ( = C ( C ) C ) [C@@H] 1 [C@H] ( C 1 ( C ) C ) C ( [O-] ) = O . O [C@H] 1 [C@H] ( [C@H] ( n 2 c n c 3 c ( N ) n c n c 3 2 ) O [C@@H] 1 C O P ( O P ( = O ) ( [O-] ) O C [C@H] 1 O [C@@H] ( N 2 C = C ( C ( = O ) N ) C C = C 2 ) [C@@H] ( [C@@H] 1 O ) O ) ( = O ) [O-] ) O

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-1.1035e-01, 3.5665e-02]])

[O-] C ( = O ) [C@@H] 1 [C@H] ( C 1 ( C ) C ) C = C ( C ) C . [H+] . n 1 ( c n c 2 c ( n c n c 2 1 ) N ) [C@H] 1 [C@@H] ( [C@@H] ( [C@H] ( O 1 ) C O P ( O P ( O C [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@H] ( N 2 C = C ( C C = C 2 ) C ( = O ) N ) O 1 ) O ) ( = O ) [O-] ) ( = O ) [O-] ) O ) O

[C@@H] 1 ( C = O ) [C@H] ( C 1 ( C ) C ) C = C ( C ) C . O = P ( O P ( = O ) ( [O-] ) O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c 2 n c n c ( c 2 n c 1 ) N ) ( O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) [n+] 1 c c c c ( C ( = O ) N ) c 1 ) O ) [O-] . O

MSSGANGNSKSLAYDIKFTKLFINGEFVDSISGSTFETIDPATEEVLATVAEGREEDVDLAVKAAREAFDNGPWPRLSGEARRKILLKFADLIEENADEIATLEVIDTGKPFQIARYVENSWTSETFRYFAGAADKIRGATLKMSSDFQAYTLREPIGVVGHIIPWNAPAYLFAMKVAPALAAGCTVVIKPAENTPLVGLFMAYLSKLAGVPDGVINVVNGFGSTAGAAVSSHMDIDAVTFTGSTKVGRTIMQAAAASNLKPVSLELGGKSPFIVFDDADIEKAAEIAVLGVLSNKGELCVAGSRVFVHEGIYDAFVKKLEATVKNWATGDRFDAATRHGPQNNKQQYEKVLSYIELGKKEGATLVTGGKPFGNKGYYIEPTLFTNVTDEMTIAKEEIFGPVIMVLKFKTIEEVIRRANATTYGLAAGIMTKNIDIANTVTRSIRAGSVWVNCYLALDRDTPFGGYKMSGFGREQGLEALEHYLQVKTVTTPIYNSPWL

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-1.1035e-01, 3.5665e-02]])

C ( [C@@H] 1 [C@H] ( C 1 ( C ) C ) C = O ) = C ( C ) C . O [C@@H] 1 [C@H] ( O ) [C@H] ( O [C@H] 1 n 1 c 2 c ( c ( N ) n c n 2 ) n c 1 ) C O P ( [O-] ) ( O P ( = O ) ( [O-] ) O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) [n+] 1 c c ( c c c 1 ) C ( N ) = O ) = O . O

C C 1 ( C ) [C@H] ( C = C ( C ) C ) [C@H] 1 C ( = O ) [O-] . [H+] . O [C@H] 1 [C@H] ( [C@@H] ( O [C@@H] 1 C O P ( = O ) ( [O-] ) O P ( [O-] ) ( O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c n c 2 c 1 n c n c 2 N ) O ) = O ) N 1 C = C ( C C = C 1 ) C ( N ) = O ) O

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-1.1035e-01, 3.5665e-02]])

[C@@H] 1 ( [C@@H] ( O ) [C@H] ( N 2 C = C C C ( = C 2 ) C ( = O ) N ) O [C@@H] 1 C O P ( = O ) ( O P ( = O ) ( [O-] ) O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( n 2 c 3 c ( c ( N ) n c n 3 ) n c 2 ) O 1 ) O ) [O-] ) O . [C@H] 1 ( C ( [O-] ) = O ) C ( [C@@H] 1 C = C ( C ) C ) ( C ) C . [H+]

[C@H] 1 ( C = C ( C ) C ) C ( C ) ( C ) [C@@H] 1 C = O . O . O ( C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) [n+] 1 c c ( C ( N ) = O ) c c c 1 ) O ) P ( = O ) ( O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c 2 c ( n c 1 ) c ( n c n 2 ) N ) [O-]

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-1.1035e-01, 3.5665e-02]])

C C 1 ( C ) [C@H] ( C = C ( C ) C ) [C@H] 1 C = O . O . [C@@H] 1 ( [C@@H] ( O ) [C@@H] ( O [C@@H] 1 C O P ( [O-] ) ( O P ( [O-] ) ( = O ) O C [C@H] 1 O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( = O ) N ) [C@@H] ( [C@@H] 1 O ) O ) = O ) n 1 c 2 c ( c ( n c n 2 ) N ) n c 1 ) O

N C ( C 1 = C N ( [C@H] 2 [C@H] ( O ) [C@@H] ( [C@H] ( O 2 ) C O P ( O P ( = O ) ( [O-] ) O C [C@@H] 2 [C@H] ( [C@H] ( [C@H] ( n 3 c 4 n c n c ( N ) c 4 n c 3 ) O 2 ) O ) O ) ( = O ) [O-] ) O ) C = C C 1 ) = O . [C@H] 1 ( C = C ( C ) C ) C ( [C@@H] 1 C ( = O ) [O-] ) ( C ) C . [H+]

MSSGANGNSKSLAYDIKFTKLFINGEFVDSISGSTFETIDPATEEVLATVAEGREEDVDLAVKAAREAFDNGPWPRLSGEARRKILLKFADLIEENADEIATLEVIDTGKPFQIARYVENSWTSETFRYFAGAADKIRGATLKMSSDFQAYTLREPIGVVGHIIPWNAPAYLFAMKVAPALAAGCTVVIKPAENTPLVGLFMAYLSKLAGVPDGVINVVNGFGSTAGAAVSSHMDIDAVTFTGSTKVGRTIMQAAAASNLKPVSLELGGKSPFIVFDDADIEKAAEIAVLGVLSNKGELCVAGSRVFVHEGIYDAFVKKLEATVKNWATGDRFDAATRHGPQNNKQQYEKVLSYIELGKKEGATLVTGGKPFGNKGYYIEPTLFTNVTDEMTIAKEEIFGPVIMVLKFKTIEEVIRRANATTYGLAAGIMTKNIDIANTVTRSIRAGSVWVNCYLALDRDTPFGGYKMSGFGREQGLEALEHYLQVKTVTTPIYNSPWL

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-1.1035e-01, 3.5665e-02]])

O = C ( C 1 C C = C N ( C = 1 ) [C@@H] 1 O [C@@H] ( [C@H] ( [C@H] 1 O ) O ) C O P ( = O ) ( [O-] ) O P ( O C [C@H] 1 O [C@@H] ( n 2 c 3 c ( c ( N ) n c n 3 ) n c 2 ) [C@H] ( O ) [C@@H] 1 O ) ( = O ) [O-] ) N . [H+] . C 1 ( C ) ( C ) [C@@H] ( [C@H] 1 C = C ( C ) C ) C ( = O ) [O-]

O [C@@H] 1 [C@@H] ( [C@@H] ( C O P ( [O-] ) ( O P ( = O ) ( [O-] ) O C [C@@H] 2 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 3 c n c 4 c ( N ) n c n c 4 3 ) O 2 ) = O ) O [C@H] 1 [n+] 1 c c ( C ( = O ) N ) c c c 1 ) O . C ( [C@H] 1 C ( C ) ( C ) [C@@H] 1 C = C ( C ) C ) = O . O

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O [C@H] 1 [C@@H] ( O ) [C@@H] ( O [C@@H] 1 C O P ( O P ( [O-] ) ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c n c 2 c ( n c n c 2 1 ) N ) = O ) ( = O ) [O-] ) [n+] 1 c c c c ( C ( = O ) N ) c 1 . C C 1 ( C ) [C@@H] ( [C@H] 1 C = O ) C = C ( C ) C . O

N C ( = O ) C 1 C C = C N ( C = 1 ) [C@H] 1 [C@H] ( O ) [C@@H] ( [C@H] ( O 1 ) C O P ( O P ( = O ) ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c n c 2 c ( N ) n c n c 1 2 ) [O-] ) ( [O-] ) = O ) O . [H+] . C C ( = C [C@@H] 1 [C@@H] ( C ( [O-] ) = O ) C 1 ( C ) C ) C

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-1.1035e-01, 3.5665e-02]])

[H+] . [C@@H] 1 ( C O P ( O P ( [O-] ) ( O C [C@H] 2 O [C@@H] ( N 3 C = C C C ( = C 3 ) C ( = O ) N ) [C@@H] ( [C@@H] 2 O ) O ) = O ) ( [O-] ) = O ) [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c 2 c ( n c 1 ) c ( N ) n c n 2 . [C@H] 1 ( [C@H] ( C 1 ( C ) C ) C = C ( C ) C ) C ( [O-] ) = O

O . [C@@H] 1 ( C = O ) [C@H] ( C 1 ( C ) C ) C = C ( C ) C . c 1 c c ( C ( N ) = O ) c [n+] ( [C@H] 2 [C@H] ( O ) [C@H] ( O ) [C@@H] ( C O P ( = O ) ( [O-] ) O P ( O C [C@H] 3 O [C@H] ( [C@H] ( O ) [C@@H] 3 O ) n 3 c 4 n c n c ( N ) c 4 n c 3 ) ( = O ) [O-] ) O 2 ) c 1

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-1.1035e-01, 3.5665e-02]])

O . C C ( C ) = C [C@@H] 1 [C@@H] ( C = O ) C 1 ( C ) C . O [C@H] 1 [C@H] ( [C@@H] ( O [C@@H] 1 C O P ( O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@@H] ( O 1 ) [n+] 1 c c ( C ( = O ) N ) c c c 1 ) O ) ( = O ) [O-] ) n 1 c n c 2 c ( n c n c 1 2 ) N ) O

[H+] . O 1 [C@@H] ( [C@@H] ( O ) [C@H] ( [C@@H] 1 N 1 C = C ( C ( = O ) N ) C C = C 1 ) O ) C O P ( O P ( [O-] ) ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c 2 n c n c ( c 2 n c 1 ) N ) = O ) ( [O-] ) = O . C ( [C@@H] 1 [C@H] ( C 1 ( C ) C ) C ( [O-] ) = O ) = C ( C ) C

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[C@@H] 1 ( [C@H] ( N 2 C = C ( C ( N ) = O ) C C = C 2 ) O [C@@H] ( [C@H] 1 O ) C O P ( O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@H] ( [C@H] ( n 2 c n c 3 c 2 n c n c 3 N ) O 1 ) O ) O ) ( [O-] ) = O ) O . [H+] . C ( = O ) ( [C@H] 1 C ( C ) ( C ) [C@@H] 1 C = C ( C ) C ) [O-]

[O-] P ( O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( [n+] 2 c c ( c c c 2 ) C ( N ) = O ) O 1 ) O ) ( = O ) O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 2 c 3 c ( n c 2 ) c ( n c n 3 ) N ) O 1 . C C 1 ( C ) [C@@H] ( [C@H] 1 C = O ) C = C ( C ) C . O

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-1.1035e-01, 3.5665e-02]])

O ( C [C@@H] 1 [C@H] ( [C@H] ( [C@H] ( n 2 c 3 c ( c ( N ) n c n 3 ) n c 2 ) O 1 ) O ) O ) P ( [O-] ) ( = O ) O P ( = O ) ( O C [C@H] 1 O [C@@H] ( [n+] 2 c c c c ( c 2 ) C ( N ) = O ) [C@H] ( O ) [C@@H] 1 O ) [O-] . C C 1 ( [C@H] ( C = C ( C ) C ) [C@H] 1 C = O ) C . O

O [C@@H] 1 [C@@H] ( C O P ( O P ( [O-] ) ( = O ) O C [C@H] 2 O [C@H] ( [C@H] ( O ) [C@@H] 2 O ) N 2 C = C ( C ( N ) = O ) C C = C 2 ) ( [O-] ) = O ) O [C@H] ( [C@@H] 1 O ) n 1 c n c 2 c ( n c n c 2 1 ) N . [H+] . C C 1 ( C ) [C@H] ( C ( = O ) [O-] ) [C@H] 1 C = C ( C ) C

MSSGANGNSKSLAYDIKFTKLFINGEFVDSISGSTFETIDPATEEVLATVAEGREEDVDLAVKAAREAFDNGPWPRLSGEARRKILLKFADLIEENADEIATLEVIDTGKPFQIARYVENSWTSETFRYFAGAADKIRGATLKMSSDFQAYTLREPIGVVGHIIPWNAPAYLFAMKVAPALAAGCTVVIKPAENTPLVGLFMAYLSKLAGVPDGVINVVNGFGSTAGAAVSSHMDIDAVTFTGSTKVGRTIMQAAAASNLKPVSLELGGKSPFIVFDDADIEKAAEIAVLGVLSNKGELCVAGSRVFVHEGIYDAFVKKLEATVKNWATGDRFDAATRHGPQNNKQQYEKVLSYIELGKKEGATLVTGGKPFGNKGYYIEPTLFTNVTDEMTIAKEEIFGPVIMVLKFKTIEEVIRRANATTYGLAAGIMTKNIDIANTVTRSIRAGSVWVNCYLALDRDTPFGGYKMSGFGREQGLEALEHYLQVKTVTTPIYNSPWL

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-1.1035e-01, 3.5665e-02]])

n 1 c n c ( N ) c 2 n c n ( c 1 2 ) [C@@H] 1 O [C@H] ( C O P ( O P ( = O ) ( O C [C@@H] 2 [C@H] ( [C@H] ( [C@@H] ( O 2 ) N 2 C = C C C ( C ( = O ) N ) = C 2 ) O ) O ) [O-] ) ( = O ) [O-] ) [C@@H] ( O ) [C@H] 1 O . [H+] . C ( = C [C@H] 1 C ( C ) ( [C@@H] 1 C ( = O ) [O-] ) C ) ( C ) C

O . [C@H] 1 ( [C@H] ( C 1 ( C ) C ) C = O ) C = C ( C ) C . P ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c n c 2 c 1 n c n c 2 N ) ( [O-] ) ( = O ) O P ( = O ) ( [O-] ) O C [C@H] 1 O [C@@H] ( [n+] 2 c c c c ( C ( N ) = O ) c 2 ) [C@@H] ( [C@@H] 1 O ) O

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O . C ( = C [C@@H] 1 [C@H] ( C 1 ( C ) C ) C = O ) ( C ) C . c 1 [n+] ( c c ( C ( N ) = O ) c c 1 ) [C@H] 1 [C@@H] ( [C@H] ( O ) [C@H] ( O 1 ) C O P ( = O ) ( O P ( = O ) ( [O-] ) O C [C@H] 1 O [C@@H] ( n 2 c 3 n c n c ( c 3 n c 2 ) N ) [C@H] ( O ) [C@@H] 1 O ) [O-] ) O

C ( [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) N 1 C = C ( C C = C 1 ) C ( = O ) N ) O P ( O P ( = O ) ( O C [C@H] 1 O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@@H] ( [C@@H] 1 O ) O ) [O-] ) ( [O-] ) = O . [H+] . C ( [O-] ) ( = O ) [C@@H] 1 [C@@H] ( C = C ( C ) C ) C 1 ( C ) C

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-1.1035e-01, 3.5665e-02]])

n 1 c 2 n ( c n c 2 c ( N ) n c 1 ) [C@H] 1 [C@@H] ( [C@@H] ( [C@H] ( O 1 ) C O P ( O P ( O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) N 1 C = C ( C ( N ) = O ) C C = C 1 ) ( [O-] ) = O ) ( [O-] ) = O ) O ) O . [C@H] 1 ( [C@H] ( C 1 ( C ) C ) C = C ( C ) C ) C ( = O ) [O-] . [H+]

[C@@H] 1 ( [C@@H] ( [C@H] ( O ) [C@H] ( O 1 ) C O P ( [O-] ) ( = O ) O P ( O C [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@H] ( n 2 c n c 3 c 2 n c n c 3 N ) O 1 ) O ) ( [O-] ) = O ) O ) [n+] 1 c c ( C ( N ) = O ) c c c 1 . C C ( C ) = C [C@@H] 1 [C@H] ( C 1 ( C ) C ) C = O . O

MSSGANGNSKSLAYDIKFTKLFINGEFVDSISGSTFETIDPATEEVLATVAEGREEDVDLAVKAAREAFDNGPWPRLSGEARRKILLKFADLIEENADEIATLEVIDTGKPFQIARYVENSWTSETFRYFAGAADKIRGATLKMSSDFQAYTLREPIGVVGHIIPWNAPAYLFAMKVAPALAAGCTVVIKPAENTPLVGLFMAYLSKLAGVPDGVINVVNGFGSTAGAAVSSHMDIDAVTFTGSTKVGRTIMQAAAASNLKPVSLELGGKSPFIVFDDADIEKAAEIAVLGVLSNKGELCVAGSRVFVHEGIYDAFVKKLEATVKNWATGDRFDAATRHGPQNNKQQYEKVLSYIELGKKEGATLVTGGKPFGNKGYYIEPTLFTNVTDEMTIAKEEIFGPVIMVLKFKTIEEVIRRANATTYGLAAGIMTKNIDIANTVTRSIRAGSVWVNCYLALDRDTPFGGYKMSGFGREQGLEALEHYLQVKTVTTPIYNSPWL

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-1.1035e-01, 3.5665e-02]])

O ( P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@H] ( [C@@H] ( O 1 ) n 1 c 2 n c n c ( c 2 n c 1 ) N ) O ) O ) P ( O P ( [O-] ) ( [O-] ) = O ) ( = O ) [O-] . C ( [C@@H] ( O ) [C@H] ( [C@@H] ( O ) [C@@H] ( O ) C = O ) O ) O

O = P ( O P ( [O-] ) ( = O ) [O-] ) ( O C [C@@H] 1 [C@H] ( [C@@H] ( O ) [C@H] ( n 2 c n c 3 c ( N ) n c n c 2 3 ) O 1 ) O ) [O-] . [H+] . O [C@H] ( [C@@H] ( C O P ( [O-] ) ( = O ) [O-] ) O ) [C@@H] ( O ) [C@@H] ( O ) C = O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[H+] . N c 1 c 2 n c n ( c 2 n c n 1 ) [C@H] 1 [C@@H] ( [C@H] ( O ) [C@@H] ( C O P ( O P ( [O-] ) ( [O-] ) = O ) ( [O-] ) = O ) O 1 ) O . C ( O P ( [O-] ) ( = O ) [O-] ) [C@H] ( [C@H] ( [C@H] ( [C@H] ( C = O ) O ) O ) O ) O

[C@@H] 1 ( O ) [C@@H] ( [C@H] ( O [C@H] 1 n 1 c 2 c ( n c 1 ) c ( n c n 2 ) N ) C O P ( [O-] ) ( = O ) O P ( [O-] ) ( O P ( [O-] ) ( = O ) [O-] ) = O ) O . [C@@H] ( C = O ) ( O ) [C@@H] ( [C@H] ( O ) [C@H] ( O ) C O ) O

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

c 1 n c ( N ) c 2 c ( n ( c n 2 ) [C@H] 2 [C@H] ( O ) [C@@H] ( [C@@H] ( C O P ( O P ( O P ( [O-] ) ( [O-] ) = O ) ( [O-] ) = O ) ( = O ) [O-] ) O 2 ) O ) n 1 . O [C@@H] ( [C@H] ( [C@H] ( [C@H] ( C = O ) O ) O ) O ) C O

[H+] . [C@@H] 1 ( O ) [C@@H] ( C O P ( O P ( = O ) ( [O-] ) [O-] ) ( [O-] ) = O ) O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@@H] 1 O . O [C@@H] ( [C@@H] ( O ) [C@H] ( C = O ) O ) [C@H] ( O ) C O P ( = O ) ( [O-] ) [O-]

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

O [C@H] 1 [C@@H] ( O [C@H] ( C O P ( O P ( [O-] ) ( [O-] ) = O ) ( = O ) [O-] ) [C@H] 1 O ) n 1 c 2 c ( n c 1 ) c ( n c n 2 ) N . O ( P ( [O-] ) ( = O ) [O-] ) C [C@H] ( [C@@H] ( O ) [C@H] ( [C@@H] ( O ) C = O ) O ) O . [H+]

O C [C@H] ( [C@@H] ( O ) [C@H] ( [C@@H] ( O ) C = O ) O ) O . P ( O P ( [O-] ) ( [O-] ) = O ) ( = O ) ( O P ( = O ) ( O C [C@H] 1 O [C@H] ( [C@@H] ( [C@@H] 1 O ) O ) n 1 c 2 n c n c ( c 2 n c 1 ) N ) [O-] ) [O-]

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

O [C@@H] ( [C@@H] ( O ) C = O ) [C@H] ( O ) [C@H] ( O ) C O . n 1 c n c ( N ) c 2 c 1 n ( [C@H] 1 [C@@H] ( [C@@H] ( [C@@H] ( C O P ( = O ) ( O P ( [O-] ) ( = O ) O P ( [O-] ) ( = O ) [O-] ) [O-] ) O 1 ) O ) O ) c n 2

O = P ( [O-] ) ( [O-] ) O P ( [O-] ) ( = O ) O C [C@@H] 1 [C@H] ( [C@H] ( [C@H] ( n 2 c n c 3 c ( N ) n c n c 3 2 ) O 1 ) O ) O . [C@@H] ( [C@H] ( O ) [C@H] ( O ) [C@@H] ( C O P ( = O ) ( [O-] ) [O-] ) O ) ( C = O ) O . [H+]

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[H+] . O ( P ( [O-] ) ( = O ) [O-] ) P ( [O-] ) ( = O ) O C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c 2 c ( n c 1 ) c ( n c n 2 ) N . O ( C [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O ) [C@H] ( C = O ) O ) P ( [O-] ) ( [O-] ) = O

O = P ( O P ( O P ( = O ) ( [O-] ) [O-] ) ( [O-] ) = O ) ( [O-] ) O C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 2 c n c 3 c ( N ) n c n c 3 2 ) O 1 . O [C@H] ( [C@H] ( O ) [C@@H] ( C O ) O ) [C@H] ( C = O ) O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

O = P ( [O-] ) ( [O-] ) O P ( = O ) ( [O-] ) O P ( = O ) ( O C [C@H] 1 O [C@@H] ( n 2 c n c 3 c ( n c n c 2 3 ) N ) [C@H] ( O ) [C@@H] 1 O ) [O-] . [C@@H] ( [C@H] ( O ) [C@@H] ( C O ) O ) ( [C@@H] ( O ) C = O ) O

[H+] . n 1 c 2 c ( n ( c 1 ) [C@@H] 1 O [C@H] ( C O P ( O P ( [O-] ) ( = O ) [O-] ) ( [O-] ) = O ) [C@H] ( [C@H] 1 O ) O ) n c n c 2 N . [O-] P ( O C [C@H] ( [C@H] ( [C@H] ( [C@H] ( C = O ) O ) O ) O ) O ) ( = O ) [O-]

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C ( = O ) [C@H] ( O ) [C@@H] ( [C@@H] ( [C@H] ( O ) C O P ( [O-] ) ( [O-] ) = O ) O ) O . [H+] . O 1 [C@H] ( C O P ( = O ) ( O P ( [O-] ) ( = O ) [O-] ) [O-] ) [C@H] ( [C@H] ( [C@@H] 1 n 1 c n c 2 c 1 n c n c 2 N ) O ) O

[C@H] ( O ) ( [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O ) C = O ) C O . O 1 [C@@H] ( n 2 c 3 c ( c ( n c n 3 ) N ) n c 2 ) [C@@H] ( [C@@H] ( [C@H] 1 C O P ( [O-] ) ( = O ) O P ( O P ( [O-] ) ( = O ) [O-] ) ( = O ) [O-] ) O ) O

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-4.1923e-02, -4.5941e-02, -5.1676e-02, 1.7840e-01, -4.4486e-02, -9.1104e-02, 1.9541e-02, -9.3447e-02, -8.3130e-02, 1.5070e-02, 5.4055e-02, 9.3211e-02, 1.5877e-01, 5.8905e-03, -3.4084e-02, -2.3427e-01, -5.7378e-02, -3.5010e-02, 8.0291e-02, 4.5093e-02, -1.0557e-01, -1.2837e-01, 1.5205e-01, -2.0033e-01, 1.3573e-01, -1.6352e-01, -5.9881e-02, -1.5691e-01, 1.2099e-01, -4.9244e-02, 1.8772e-02, 3.5318e-02, 1.4492e-01, -8.3573e-03, -1.0137e-01, -1.9738e-01, -1.8797e-02, -9.2286e-02, -1.0801e-01, -1.8535e-02, -4.3082e-02, 3.0644e-02, -3.3644e-02, 1.2056e-01, 5.4900e-02, -1.7082e-02, 1.1070e-01, 1.0443e-01, 1.3649e-01, -5.4803e-02, 1.6093e-01, 4.9609e-02, -5.9988e-02, 2.5656e-04, -5.4748e-02, 5.7633e-02, 9.3664e-02, 5.8138e-02, 1.4516e-01, -1.2041e-01, -2.9099e-01, -8.7130e-02, -1.3031e-01, -6.1575e-01, 4.1368e-02, -5.6046e-02, -1.0252e-01, 1.2515e-01, -3.3023e-02, 6.3905e-03, -9.3978e-02, 2.7730e-02, 9.6527e-02, 4.1501e-02, 4.3860e-02, 6.8545e-03, 1.0167e-01, 6.2024e-02, 9.3003e-02, -5.1769e-02, -1.4767e-01, 3.3187e-02, -5.6423e-02]])

O [C@@H] ( [C@@H] ( O ) C = O ) [C@H] ( O ) [C@@H] ( C O ) O . [C@H] 1 ( C O P ( [O-] ) ( O P ( O P ( [O-] ) ( = O ) [O-] ) ( [O-] ) = O ) = O ) O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c 2 c ( n c 1 ) c ( N ) n c n 2

O = C [C@@H] ( [C@H] ( O ) [C@@H] ( [C@@H] ( C O P ( = O ) ( [O-] ) [O-] ) O ) O ) O . [H+] . P ( [O-] ) ( O P ( [O-] ) ( [O-] ) = O ) ( = O ) O C [C@H] 1 O [C@@H] ( n 2 c 3 c ( c ( N ) n c n 3 ) n c 2 ) [C@@H] ( [C@@H] 1 O ) O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[H+] . O ( P ( [O-] ) ( = O ) [O-] ) C [C@H] ( [C@@H] ( O ) [C@H] ( [C@H] ( C = O ) O ) O ) O . [C@@H] 1 ( C O P ( O P ( = O ) ( [O-] ) [O-] ) ( = O ) [O-] ) [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O 1 ) n 1 c 2 c ( n c 1 ) c ( n c n 2 ) N

n 1 c ( c 2 c ( n c 1 ) n ( [C@H] 1 [C@@H] ( [C@@H] ( [C@H] ( O 1 ) C O P ( = O ) ( O P ( = O ) ( O P ( [O-] ) ( [O-] ) = O ) [O-] ) [O-] ) O ) O ) c n 2 ) N . C ( [C@H] ( [C@@H] ( O ) [C@@H] ( O ) [C@H] ( C = O ) O ) O ) O

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O 1 [C@H] ( [C@@H] ( [C@H] ( O ) [C@H] 1 C O P ( = O ) ( O P ( = O ) ( [O-] ) O P ( [O-] ) ( [O-] ) = O ) [O-] ) O ) n 1 c n c 2 c 1 n c n c 2 N . O C [C@H] ( [C@H] ( [C@@H] ( O ) [C@H] ( C = O ) O ) O ) O

[H+] . O [C@H] ( [C@@H] ( C O P ( [O-] ) ( = O ) [O-] ) O ) [C@H] ( [C@@H] ( O ) C = O ) O . [C@H] 1 ( C O P ( O P ( = O ) ( [O-] ) [O-] ) ( = O ) [O-] ) O [C@@H] ( n 2 c 3 n c n c ( c 3 n c 2 ) N ) [C@@H] ( [C@@H] 1 O ) O

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[O-] P ( = O ) ( [O-] ) O C [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O ) [C@H] ( C = O ) O . O = P ( [O-] ) ( [O-] ) O P ( [O-] ) ( O C [C@H] 1 O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@@H] ( [C@@H] 1 O ) O ) = O . [H+]

[C@H] 1 ( [C@@H] ( C O P ( [O-] ) ( = O ) O P ( = O ) ( [O-] ) O P ( [O-] ) ( [O-] ) = O ) O [C@@H] ( n 2 c n c 3 c 2 n c n c 3 N ) [C@@H] 1 O ) O . O [C@H] ( [C@H] ( O ) C O ) [C@H] ( [C@@H] ( O ) C = O ) O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

O [C@H] 1 [C@H] ( [C@H] ( n 2 c n c 3 c 2 n c n c 3 N ) O [C@@H] 1 C O P ( [O-] ) ( O P ( = O ) ( O P ( [O-] ) ( = O ) [O-] ) [O-] ) = O ) O . O C [C@@H] ( O ) [C@H] ( [C@@H] ( O ) [C@H] ( C = O ) O ) O

C ( [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O ) [C@@H] ( O ) C = O ) O P ( = O ) ( [O-] ) [O-] . O [C@@H] 1 [C@@H] ( [C@H] ( O [C@H] 1 n 1 c 2 n c n c ( c 2 n c 1 ) N ) C O P ( [O-] ) ( O P ( = O ) ( [O-] ) [O-] ) = O ) O . [H+]

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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O ( P ( [O-] ) ( = O ) [O-] ) C [C@H] ( [C@@H] ( O ) [C@H] ( [C@@H] ( O ) C = O ) O ) O . [H+] . [C@H] 1 ( O ) [C@H] ( [C@H] ( n 2 c 3 c ( c ( n c n 3 ) N ) n c 2 ) O [C@@H] 1 C O P ( O P ( [O-] ) ( = O ) [O-] ) ( = O ) [O-] ) O

N c 1 n c n c 2 n ( c n c 1 2 ) [C@@H] 1 O [C@@H] ( [C@@H] ( O ) [C@H] 1 O ) C O P ( = O ) ( O P ( [O-] ) ( = O ) O P ( = O ) ( [O-] ) [O-] ) [O-] . O [C@H] ( [C@H] ( O ) [C@@H] ( C O ) O ) [C@@H] ( O ) C = O

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

n 1 c n ( [C@H] 2 [C@@H] ( [C@H] ( O ) [C@@H] ( C O P ( = O ) ( O P ( = O ) ( O P ( [O-] ) ( [O-] ) = O ) [O-] ) [O-] ) O 2 ) O ) c 2 c 1 c ( N ) n c n 2 . O = C [C@H] ( O ) [C@H] ( O ) [C@H] ( O ) [C@H] ( O ) C O

O ( P ( [O-] ) ( = O ) [O-] ) C [C@@H] ( O ) [C@@H] ( O ) [C@H] ( [C@@H] ( O ) C = O ) O . [H+] . [O-] P ( [O-] ) ( O P ( = O ) ( O C [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@H] ( n 2 c 3 c ( c ( n c n 3 ) N ) n c 2 ) O 1 ) O ) [O-] ) = O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[H+] . O = P ( O C [C@@H] ( O ) [C@H] ( [C@@H] ( O ) [C@@H] ( O ) C = O ) O ) ( [O-] ) [O-] . O 1 [C@@H] ( [C@@H] ( O ) [C@@H] ( O ) [C@@H] 1 n 1 c n c 2 c ( N ) n c n c 2 1 ) C O P ( = O ) ( [O-] ) O P ( [O-] ) ( = O ) [O-]

c 1 n ( [C@H] 2 [C@@H] ( [C@@H] ( [C@H] ( O 2 ) C O P ( O P ( O P ( [O-] ) ( = O ) [O-] ) ( = O ) [O-] ) ( [O-] ) = O ) O ) O ) c 2 n c n c ( N ) c 2 n 1 . O [C@H] ( [C@@H] ( [C@H] ( O ) [C@H] ( O ) C O ) O ) C = O

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

O ( C [C@@H] 1 [C@@H] ( O ) [C@@H] ( O ) [C@H] ( n 2 c 3 c ( n c 2 ) c ( N ) n c n 3 ) O 1 ) P ( O P ( [O-] ) ( O P ( [O-] ) ( [O-] ) = O ) = O ) ( = O ) [O-] . O [C@H] ( C O ) [C@H] ( [C@H] ( [C@@H] ( O ) C = O ) O ) O

[H+] . [C@H] ( [C@H] ( O ) [C@@H] ( [C@@H] ( C O P ( [O-] ) ( = O ) [O-] ) O ) O ) ( O ) C = O . [C@@H] 1 ( [C@H] ( O ) [C@H] ( O ) [C@H] ( O 1 ) C O P ( O P ( = O ) ( [O-] ) [O-] ) ( [O-] ) = O ) n 1 c n c 2 c ( N ) n c n c 1 2

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[H+] . n 1 c ( N ) c 2 c ( n c 1 ) n ( c n 2 ) [C@@H] 1 O [C@H] ( C O P ( [O-] ) ( = O ) O P ( [O-] ) ( [O-] ) = O ) [C@H] ( [C@H] 1 O ) O . O = C [C@@H] ( [C@@H] ( [C@@H] ( [C@@H] ( C O P ( [O-] ) ( = O ) [O-] ) O ) O ) O ) O

O ( P ( O P ( O P ( [O-] ) ( [O-] ) = O ) ( = O ) [O-] ) ( = O ) [O-] ) C [C@H] 1 O [C@H] ( [C@H] ( O ) [C@@H] 1 O ) n 1 c n c 2 c 1 n c n c 2 N . O [C@@H] ( [C@H] ( [C@@H] ( O ) [C@@H] ( O ) C = O ) O ) C O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[C@@H] 1 ( n 2 c 3 c ( n c 2 ) c ( n c n 3 ) N ) O [C@@H] ( [C@H] ( [C@H] 1 O ) O ) C O P ( O P ( = O ) ( O P ( = O ) ( [O-] ) [O-] ) [O-] ) ( = O ) [O-] . O [C@@H] ( [C@@H] ( O ) [C@@H] ( O ) C = O ) [C@@H] ( C O ) O

[H+] . c 1 n c 2 c ( n c n c 2 n 1 [C@H] 1 [C@H] ( O ) [C@H] ( O ) [C@H] ( O 1 ) C O P ( O P ( = O ) ( [O-] ) [O-] ) ( = O ) [O-] ) N . O = P ( [O-] ) ( [O-] ) O C [C@H] ( [C@@H] ( O ) [C@H] ( [C@H] ( C = O ) O ) O ) O

MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP

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-1.4767e-01, 3.3187e-02, -5.6423e-02]])

[H+] . [C@@H] ( [C@@H] ( C O P ( [O-] ) ( [O-] ) = O ) O ) ( [C@@H] ( O ) [C@H] ( C = O ) O ) O . c 1 n c 2 c ( n c n c 2 n 1 [C@@H] 1 O [C@@H] ( [C@@H] ( O ) [C@H] 1 O ) C O P ( [O-] ) ( O P ( [O-] ) ( = O ) [O-] ) = O ) N

C ( = O ) [C@H] ( O ) [C@@H] ( [C@@H] ( [C@@H] ( C O ) O ) O ) O . C ( [C@@H] 1 [C@@H] ( O ) [C@H] ( [C@@H] ( O 1 ) n 1 c n c 2 c ( n c n c 2 1 ) N ) O ) O P ( = O ) ( O P ( O P ( [O-] ) ( [O-] ) = O ) ( = O ) [O-] ) [O-]

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-4.1923e-02, -4.5941e-02, -5.1676e-02, 1.7840e-01, -4.4486e-02, -9.1104e-02, 1.9541e-02, -9.3447e-02, -8.3130e-02, 1.5070e-02, 5.4055e-02, 9.3211e-02, 1.5877e-01, 5.8905e-03, -3.4084e-02, -2.3427e-01, -5.7378e-02, -3.5010e-02, 8.0291e-02, 4.5093e-02, -1.0557e-01, -1.2837e-01, 1.5205e-01, -2.0033e-01, 1.3573e-01, -1.6352e-01, -5.9881e-02, -1.5691e-01, 1.2099e-01, -4.9244e-02, 1.8772e-02, 3.5318e-02, 1.4492e-01, -8.3573e-03, -1.0137e-01, -1.9738e-01, -1.8797e-02, -9.2286e-02, -1.0801e-01, -1.8535e-02, -4.3082e-02, 3.0644e-02, -3.3644e-02, 1.2056e-01, 5.4900e-02, -1.7082e-02, 1.1070e-01, 1.0443e-01, 1.3649e-01, -5.4803e-02, 1.6093e-01, 4.9609e-02, -5.9988e-02, 2.5656e-04, -5.4748e-02, 5.7633e-02, 9.3664e-02, 5.8138e-02, 1.4516e-01, -1.2041e-01, -2.9099e-01, -8.7130e-02, -1.3031e-01, -6.1575e-01, 4.1368e-02, -5.6046e-02, -1.0252e-01, 1.2515e-01, -3.3023e-02, 6.3905e-03, -9.3978e-02, 2.7730e-02, 9.6527e-02, 4.1501e-02, 4.3860e-02, 6.8545e-03, 1.0167e-01, 6.2024e-02, 9.3003e-02, -5.1769e-02, -1.4767e-01, 3.3187e-02, -5.6423e-02]])

C ( C C [C@H] ( O ) [C@H] ( S C [C@@H] ( C ( N C C ( [O-] ) = O ) = O ) N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) C ( = O ) [O-] . O

O = C ( [O-] ) C [NH3+] . C ( C / C = C \ C / C = C \ C = C \ C = C \ [C@H] ( [C@H] ( C C C C ( [O-] ) = O ) O ) S C [C@H] ( N C ( C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) = O ) C ( [O-] ) = O ) C C C

MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY

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1.4692e-01, 1.6375e-02]])

C ( = O ) ( C [NH3+] ) [O-] . C ( = O ) ( C C [C@H] ( [NH3+] ) C ( [O-] ) = O ) N [C@H] ( C ( [O-] ) = O ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( = O ) [O-]

[NH3+] [C@@H] ( C C C ( N [C@@H] ( C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@H] ( C C C C ( = O ) [O-] ) O ) C ( = O ) N C C ( = O ) [O-] ) = O ) C ( [O-] ) = O . O

MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY

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C ( C C ) C C / C = C \ C / C = C \ C = C \ C = C \ [C@@H] ( S C [C@@H] ( C ( = O ) N C C ( [O-] ) = O ) N C ( C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) = O ) [C@H] ( C C C C ( [O-] ) = O ) O . O

C ( [NH3+] ) C ( [O-] ) = O . C ( = C \ C C C C C ) \ C / C = C \ C = C \ C = C \ [C@@H] ( S C [C@@H] ( C ( = O ) [O-] ) N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) [C@@H] ( O ) C C C C ( [O-] ) = O

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-1.0143e-01, 1.7208e-02, 2.7255e-02, 8.0435e-02, -6.4251e-02, 1.4899e-01, 1.1707e-01, -2.0952e-01, 9.1696e-02, -5.6841e-02, -8.4825e-02, 9.8528e-02, -1.6988e-01, 2.1717e-01, 9.1176e-02, -8.8236e-02, 4.3082e-02, 9.5857e-02, 6.4470e-02, 6.9857e-03, -5.9041e-02, -8.8771e-02, -1.7867e-01, -3.7473e-02, 2.3222e-01, 5.7231e-02, 8.7119e-02, 8.0714e-02, 1.2585e-01, 6.1656e-02, 1.7526e-01, 6.1773e-02, 5.1874e-02, 1.0314e-01, -1.2091e-02, -1.5985e-01, 4.8182e-02, 2.5396e-02, -1.3712e-01, 5.2375e-02, -3.2581e-02, 4.6337e-02, 1.7814e-01, -2.2478e-01, 1.0284e-01, -1.2339e-01, 2.1882e-01, 1.4786e-01, 4.0731e-02, 1.6074e-01, 4.6595e-02, 2.8837e-02, 6.1002e-02, -1.7591e-01, 9.6948e-02, -2.2339e-02, -1.3282e-02, -3.5301e-02, -2.1387e-02, -2.7815e-02, -1.0549e-01, -1.5596e-01, 5.5295e-02, 2.7124e-01, 2.2106e-01, 1.1728e-01, -5.4763e-02, 1.0739e-02, -1.0869e-01, -1.7993e-02, 4.0440e-02, 5.2559e-02, 3.2483e-02, -1.3453e-01, 8.3829e-02, -1.1532e-01, -2.2198e-02, 5.2790e-02, -2.8676e-02, 2.1844e-02, 6.2841e-02, -2.1507e-01, 2.8998e-02, -1.9398e-02, -8.2640e-02, -2.0711e-02, 2.0790e-01, -7.9734e-03, 1.9057e-01, -9.7694e-02, -1.3091e-01, 1.6307e-02, -7.7878e-02, -6.7771e-02, 3.9866e-02, -2.2607e-01, -1.5430e-01, 1.0351e-01, 1.1843e-01, -1.9369e-01, -3.0720e-02, -1.7057e-01, 2.1596e-02, 1.0373e-01, -1.3902e-01, -1.1936e-01, -8.4033e-02, 9.9886e-02, 6.6538e-02, 7.4260e-02, -1.5676e-01, -1.1221e-01, -6.1781e-02, -4.8090e-02, -1.1904e-01, 3.2038e-02, -1.0641e-01, 7.9683e-02, 3.9650e-02, 3.5734e-02, 6.5099e-02, -1.4929e-01, 2.2856e-01, 5.7212e-02, 1.4201e-02, 8.9162e-02, 1.7521e-01, 2.4841e-01, -8.4776e-02, 2.8336e-03, -6.6142e-02, -4.6454e-02, 1.8627e-02, -6.9944e-02, 1.0024e-01, 1.4320e-02, 1.6023e-01, 1.1470e-01, -1.8827e-01, -1.0429e-01, -5.4796e-02, -5.0175e-02, -7.8876e-01, -3.1224e-02, 2.7634e-02, -4.8525e-02, 1.5092e-01, -2.4152e-01, -2.7255e-01, -2.2158e-01, 1.8802e-01, 1.7050e-01, 1.1956e-01, -7.6663e-02, -9.9491e-02, 7.6030e-02, 4.6147e-02, 2.6436e-02, 1.0876e-01, -2.2409e-02, 1.4695e-01, -1.5807e-02]])

C ( [NH3+] ) C ( = O ) [O-] . [C@@H] ( C C C C ( [O-] ) = O ) ( O ) [C@H] ( S C [C@@H] ( C ( = O ) [O-] ) N C ( = O ) C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) / C = C / C = C / C = C \ C / C = C \ C C C C C

O = C ( [C@H] ( C C C ( = O ) N [C@H] ( C ( N C C ( = O ) [O-] ) = O ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( = O ) [O-] ) [NH3+] ) [O-] . O

MKRLLILSLLLEAVCGNENFVGHQVLRISAADEAQVQKVKELEDLEHLQLDFWRDAARAGIPIDVRVPFPSIQSVKAFLEYHGISYEIMIEDVQLLLDEEKQQMSAFQARALSTDSFNYATYHTLDEIYEFMDLLVAEHPQLVSKIQIGNTFEGRPIHVLKFSTGGTNRPAIWIDTGIHSREWVTQASGVWFAKKITKDYGQDPTFTAVLDNMDIFLEIVTNPDGFAYTHKTNRMWRKTRSHTQGSLCVGVDPNRNWDAGFGMAGASSNPCSETYRGKFPNSEVEVKSIVDFVTSHGNIKAFISIHSYSQLLLYPYGYTSEPAPDQAELDQLAKSAVTALTSLHGTKFKYGSIIDTIYQASGSTIDWTYSQGIKYSFTFELRDTGLRGFLLPASQIIPTAEETWLALLTIMDHTVKHPY

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6.2841e-02, -2.1507e-01, 2.8998e-02, -1.9398e-02, -8.2640e-02, -2.0711e-02, 2.0790e-01, -7.9734e-03, 1.9057e-01, -9.7694e-02, -1.3091e-01, 1.6307e-02, -7.7878e-02, -6.7771e-02, 3.9866e-02, -2.2607e-01, -1.5430e-01, 1.0351e-01, 1.1843e-01, -1.9369e-01, -3.0720e-02, -1.7057e-01, 2.1596e-02, 1.0373e-01, -1.3902e-01, -1.1936e-01, -8.4033e-02, 9.9886e-02, 6.6538e-02, 7.4260e-02, -1.5676e-01, -1.1221e-01, -6.1781e-02, -4.8090e-02, -1.1904e-01, 3.2038e-02, -1.0641e-01, 7.9683e-02, 3.9650e-02, 3.5734e-02, 6.5099e-02, -1.4929e-01, 2.2856e-01, 5.7212e-02, 1.4201e-02, 8.9162e-02, 1.7521e-01, 2.4841e-01, -8.4776e-02, 2.8336e-03, -6.6142e-02, -4.6454e-02, 1.8627e-02, -6.9944e-02, 1.0024e-01, 1.4320e-02, 1.6023e-01, 1.1470e-01, -1.8827e-01, -1.0429e-01, -5.4796e-02, -5.0175e-02, -7.8876e-01, -3.1224e-02, 2.7634e-02, -4.8525e-02, 1.5092e-01, -2.4152e-01, -2.7255e-01, -2.2158e-01, 1.8802e-01, 1.7050e-01, 1.1956e-01, -7.6663e-02, -9.9491e-02, 7.6030e-02, 4.6147e-02, 2.6436e-02, 1.0876e-01, -2.2409e-02, 1.4695e-01, -1.5807e-02]])

N ( C ( [C@@H] ( N C ( = O ) C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) C S [C@@H] ( [C@H] ( C C C C ( [O-] ) = O ) O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) = O ) C C ( = O ) [O-] . O

C ( C ( [O-] ) = O ) [NH3+] . O = C ( N [C@H] ( C ( [O-] ) = O ) C S [C@@H] ( [C@@H] ( O ) C C C C ( [O-] ) = O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) C C [C@H] ( [NH3+] ) C ( [O-] ) = O

MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY

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1.4692e-01, 1.6375e-02]])

[C@H] ( N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) ( C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@H] ( C C C C ( [O-] ) = O ) O ) C ( = O ) [O-] . C ( C ( [O-] ) = O ) [NH3+]

O . C ( C ( = O ) [O-] ) C C [C@H] ( O ) [C@H] ( S C [C@H] ( N C ( C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) = O ) C ( = O ) N C C ( = O ) [O-] ) / C = C / C = C / C = C \ C / C = C \ C C C C C

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1.4692e-01, 1.6375e-02]])

O . C ( = C / C = C / C = C \ C / C = C \ C C C C C ) \ [C@H] ( [C@H] ( C C C C ( [O-] ) = O ) O ) S C [C@@H] ( C ( N C C ( [O-] ) = O ) = O ) N C ( C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) = O

[O-] C ( = O ) C C C [C@H] ( O ) [C@@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) S C [C@@H] ( C ( = O ) [O-] ) N C ( C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) = O . C ( [NH3+] ) C ( [O-] ) = O

MKRLLILSLLLEAVCGNENFVGHQVLRISAADEAQVQKVKELEDLEHLQLDFWRDAARAGIPIDVRVPFPSIQSVKAFLEYHGISYEIMIEDVQLLLDEEKQQMSAFQARALSTDSFNYATYHTLDEIYEFMDLLVAEHPQLVSKIQIGNTFEGRPIHVLKFSTGGTNRPAIWIDTGIHSREWVTQASGVWFAKKITKDYGQDPTFTAVLDNMDIFLEIVTNPDGFAYTHKTNRMWRKTRSHTQGSLCVGVDPNRNWDAGFGMAGASSNPCSETYRGKFPNSEVEVKSIVDFVTSHGNIKAFISIHSYSQLLLYPYGYTSEPAPDQAELDQLAKSAVTALTSLHGTKFKYGSIIDTIYQASGSTIDWTYSQGIKYSFTFELRDTGLRGFLLPASQIIPTAEETWLALLTIMDHTVKHPY

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1.4695e-01, -1.5807e-02]])

[O-] C ( = O ) C C C [C@@H] ( [C@H] ( S C [C@@H] ( C ( = O ) [O-] ) N C ( C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) = O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) O . C ( C [NH3+] ) ( [O-] ) = O

C ( C C C ) C / C = C \ C / C = C \ C = C \ C = C \ [C@H] ( [C@@H] ( O ) C C C C ( [O-] ) = O ) S C [C@H] ( N C ( C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) = O ) C ( = O ) N C C ( [O-] ) = O . O

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C ( C C C / C = C \ C / C = C \ C = C \ C = C \ [C@@H] ( S C [C@H] ( N C ( = O ) C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) C ( = O ) N C C ( = O ) [O-] ) [C@H] ( C C C C ( = O ) [O-] ) O ) C . O

C ( [O-] ) ( C C C [C@H] ( O ) [C@@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) S C [C@@H] ( C ( [O-] ) = O ) N C ( = O ) C C [C@H] ( [NH3+] ) C ( [O-] ) = O ) = O . [O-] C ( = O ) C [NH3+]

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6.2841e-02, -2.1507e-01, 2.8998e-02, -1.9398e-02, -8.2640e-02, -2.0711e-02, 2.0790e-01, -7.9734e-03, 1.9057e-01, -9.7694e-02, -1.3091e-01, 1.6307e-02, -7.7878e-02, -6.7771e-02, 3.9866e-02, -2.2607e-01, -1.5430e-01, 1.0351e-01, 1.1843e-01, -1.9369e-01, -3.0720e-02, -1.7057e-01, 2.1596e-02, 1.0373e-01, -1.3902e-01, -1.1936e-01, -8.4033e-02, 9.9886e-02, 6.6538e-02, 7.4260e-02, -1.5676e-01, -1.1221e-01, -6.1781e-02, -4.8090e-02, -1.1904e-01, 3.2038e-02, -1.0641e-01, 7.9683e-02, 3.9650e-02, 3.5734e-02, 6.5099e-02, -1.4929e-01, 2.2856e-01, 5.7212e-02, 1.4201e-02, 8.9162e-02, 1.7521e-01, 2.4841e-01, -8.4776e-02, 2.8336e-03, -6.6142e-02, -4.6454e-02, 1.8627e-02, -6.9944e-02, 1.0024e-01, 1.4320e-02, 1.6023e-01, 1.1470e-01, -1.8827e-01, -1.0429e-01, -5.4796e-02, -5.0175e-02, -7.8876e-01, -3.1224e-02, 2.7634e-02, -4.8525e-02, 1.5092e-01, -2.4152e-01, -2.7255e-01, -2.2158e-01, 1.8802e-01, 1.7050e-01, 1.1956e-01, -7.6663e-02, -9.9491e-02, 7.6030e-02, 4.6147e-02, 2.6436e-02, 1.0876e-01, -2.2409e-02, 1.4695e-01, -1.5807e-02]])

C ( C ( [O-] ) = O ) [NH3+] . [C@H] ( C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@H] ( C C C C ( = O ) [O-] ) O ) ( C ( [O-] ) = O ) N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-]

O . C ( C ( = O ) N [C@H] ( C ( N C C ( [O-] ) = O ) = O ) C S [C@@H] ( [C@H] ( C C C C ( = O ) [O-] ) O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) C [C@@H] ( C ( = O ) [O-] ) [NH3+]

MKRLLILSLLLEAVCGNENFVGHQVLRISAADEAQVQKVKELEDLEHLQLDFWRDAARAGIPIDVRVPFPSIQSVKAFLEYHGISYEIMIEDVQLLLDEEKQQMSAFQARALSTDSFNYATYHTLDEIYEFMDLLVAEHPQLVSKIQIGNTFEGRPIHVLKFSTGGTNRPAIWIDTGIHSREWVTQASGVWFAKKITKDYGQDPTFTAVLDNMDIFLEIVTNPDGFAYTHKTNRMWRKTRSHTQGSLCVGVDPNRNWDAGFGMAGASSNPCSETYRGKFPNSEVEVKSIVDFVTSHGNIKAFISIHSYSQLLLYPYGYTSEPAPDQAELDQLAKSAVTALTSLHGTKFKYGSIIDTIYQASGSTIDWTYSQGIKYSFTFELRDTGLRGFLLPASQIIPTAEETWLALLTIMDHTVKHPY

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1.4695e-01, -1.5807e-02]])

O . C ( N [C@H] ( C ( = O ) N C C ( [O-] ) = O ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@H] ( C C C C ( [O-] ) = O ) O ) ( C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) = O

C ( [O-] ) ( C [NH3+] ) = O . C ( [C@H] ( N C ( C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) = O ) C ( = O ) [O-] ) S [C@@H] ( [C@H] ( C C C C ( = O ) [O-] ) O ) / C = C / C = C / C = C \ C / C = C \ C C C C C

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1.4695e-01, -1.5807e-02]])

[O-] C ( C [NH3+] ) = O . C ( C C C ( [O-] ) = O ) [C@@H] ( [C@H] ( S C [C@@H] ( C ( = O ) [O-] ) N C ( C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) = O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) O

O . C ( S [C@@H] ( [C@@H] ( O ) C C C C ( [O-] ) = O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@H] ( N C ( = O ) C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) C ( N C C ( = O ) [O-] ) = O

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1.4695e-01, -1.5807e-02]])

O . C ( S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( [O-] ) = O ) [C@@H] ( C ( = O ) N C C ( [O-] ) = O ) N C ( C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) = O

C ( [O-] ) ( C [NH3+] ) = O . [C@@H] ( [C@H] ( S C [C@@H] ( C ( [O-] ) = O ) N C ( = O ) C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) ( C C C C ( [O-] ) = O ) O

MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY

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1.4692e-01, 1.6375e-02]])

O = C ( [O-] ) C [NH3+] . [O-] C ( C C C [C@@H] ( [C@@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) S C [C@H] ( N C ( = O ) C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) C ( = O ) [O-] ) O ) = O

O . C ( / C = C / C = C / [C@@H] ( S C [C@H] ( N C ( C C [C@H] ( [NH3+] ) C ( [O-] ) = O ) = O ) C ( N C C ( [O-] ) = O ) = O ) [C@H] ( C C C C ( [O-] ) = O ) O ) = C / C / C = C \ C C C C C

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1.4692e-01, 1.6375e-02]])

O . C ( C ( = O ) N [C@H] ( C ( = O ) N C C ( = O ) [O-] ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( = O ) [O-] ) C [C@@H] ( C ( [O-] ) = O ) [NH3+]

[NH3+] C C ( [O-] ) = O . [O-] C ( [C@@H] ( N C ( = O ) C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( [O-] ) = O ) = O

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6.2841e-02, -2.1507e-01, 2.8998e-02, -1.9398e-02, -8.2640e-02, -2.0711e-02, 2.0790e-01, -7.9734e-03, 1.9057e-01, -9.7694e-02, -1.3091e-01, 1.6307e-02, -7.7878e-02, -6.7771e-02, 3.9866e-02, -2.2607e-01, -1.5430e-01, 1.0351e-01, 1.1843e-01, -1.9369e-01, -3.0720e-02, -1.7057e-01, 2.1596e-02, 1.0373e-01, -1.3902e-01, -1.1936e-01, -8.4033e-02, 9.9886e-02, 6.6538e-02, 7.4260e-02, -1.5676e-01, -1.1221e-01, -6.1781e-02, -4.8090e-02, -1.1904e-01, 3.2038e-02, -1.0641e-01, 7.9683e-02, 3.9650e-02, 3.5734e-02, 6.5099e-02, -1.4929e-01, 2.2856e-01, 5.7212e-02, 1.4201e-02, 8.9162e-02, 1.7521e-01, 2.4841e-01, -8.4776e-02, 2.8336e-03, -6.6142e-02, -4.6454e-02, 1.8627e-02, -6.9944e-02, 1.0024e-01, 1.4320e-02, 1.6023e-01, 1.1470e-01, -1.8827e-01, -1.0429e-01, -5.4796e-02, -5.0175e-02, -7.8876e-01, -3.1224e-02, 2.7634e-02, -4.8525e-02, 1.5092e-01, -2.4152e-01, -2.7255e-01, -2.2158e-01, 1.8802e-01, 1.7050e-01, 1.1956e-01, -7.6663e-02, -9.9491e-02, 7.6030e-02, 4.6147e-02, 2.6436e-02, 1.0876e-01, -2.2409e-02, 1.4695e-01, -1.5807e-02]])

O = C ( C [NH3+] ) [O-] . C ( = C \ C C C C C ) \ C / C = C \ C = C \ C = C \ [C@H] ( [C@@H] ( O ) C C C C ( = O ) [O-] ) S C [C@@H] ( C ( [O-] ) = O ) N C ( = O ) C C [C@@H] ( C ( [O-] ) = O ) [NH3+]

O . C ( \ C C C C C ) = C \ C / C = C \ C = C \ C = C \ [C@@H] ( S C [C@H] ( N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) C ( = O ) N C C ( [O-] ) = O ) [C@H] ( C C C C ( [O-] ) = O ) O

MKRLLILSLLLEAVCGNENFVGHQVLRISAADEAQVQKVKELEDLEHLQLDFWRDAARAGIPIDVRVPFPSIQSVKAFLEYHGISYEIMIEDVQLLLDEEKQQMSAFQARALSTDSFNYATYHTLDEIYEFMDLLVAEHPQLVSKIQIGNTFEGRPIHVLKFSTGGTNRPAIWIDTGIHSREWVTQASGVWFAKKITKDYGQDPTFTAVLDNMDIFLEIVTNPDGFAYTHKTNRMWRKTRSHTQGSLCVGVDPNRNWDAGFGMAGASSNPCSETYRGKFPNSEVEVKSIVDFVTSHGNIKAFISIHSYSQLLLYPYGYTSEPAPDQAELDQLAKSAVTALTSLHGTKFKYGSIIDTIYQASGSTIDWTYSQGIKYSFTFELRDTGLRGFLLPASQIIPTAEETWLALLTIMDHTVKHPY

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1.4695e-01, -1.5807e-02]])

O . C ( / C = C / C = C / [C@@H] ( S C [C@@H] ( C ( = O ) N C C ( [O-] ) = O ) N C ( = O ) C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) [C@@H] ( O ) C C C C ( [O-] ) = O ) = C / C / C = C \ C C C C C

[O-] C ( C [NH3+] ) = O . C ( = O ) ( [O-] ) [C@H] ( C C C ( N [C@H] ( C ( = O ) [O-] ) C S [C@@H] ( [C@H] ( C C C C ( = O ) [O-] ) O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) = O ) [NH3+]

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1.4695e-01, -1.5807e-02]])

[NH3+] [C@@H] ( C C C ( N [C@H] ( C ( = O ) [O-] ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( = O ) [O-] ) = O ) C ( = O ) [O-] . C ( C ( [O-] ) = O ) [NH3+]

O . C ( = O ) ( C N C ( [C@H] ( C S [C@@H] ( [C@@H] ( O ) C C C C ( [O-] ) = O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) N C ( C C [C@@H] ( C ( [O-] ) = O ) [NH3+] ) = O ) = O ) [O-]

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1.4695e-01, -1.5807e-02]])

O . O = C ( C C C [C@H] ( O ) [C@H] ( S C [C@H] ( N C ( = O ) C C [C@@H] ( C ( = O ) [O-] ) [NH3+] ) C ( N C C ( = O ) [O-] ) = O ) / C = C / C = C / C = C \ C / C = C \ C C C C C ) [O-]

[C@@H] ( S C [C@H] ( N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-] ) C ( [O-] ) = O ) ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( = O ) [O-] . C ( C ( = O ) [O-] ) [NH3+]

MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY

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1.4692e-01, 1.6375e-02]])

C ( = C \ C / C = C \ C C C C C ) \ C = C \ C = C \ [C@H] ( [C@@H] ( O ) C C C C ( [O-] ) = O ) S C [C@@H] ( C ( [O-] ) = O ) N C ( = O ) C C [C@H] ( [NH3+] ) C ( = O ) [O-] . C ( C [NH3+] ) ( [O-] ) = O

[O-] C ( [C@@H] ( [NH3+] ) C C C ( = O ) N [C@H] ( C ( = O ) N C C ( = O ) [O-] ) C S [C@H] ( / C = C / C = C / C = C \ C / C = C \ C C C C C ) [C@@H] ( O ) C C C C ( = O ) [O-] ) = O . O

MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY

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