SEQUENCE: DIQMTQSPASLSASVGETVTITCRASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYCQHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNECEVQLQQSGAELVKPGASVKLSCTASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYCAGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTCNVAHPASSTKVDKKIVPRNCGGDCGDVEKGKKIFVQKCAQCHTVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNEX
SCORE:     score     fa_atr     fa_rep     fa_sol    fa_intra_atr_xover4    fa_intra_rep_xover4    fa_intra_sol_xover4    lk_ball    lk_ball_iso    lk_ball_bridge    lk_ball_bridge_uncpl    fa_elec    fa_intra_elec    hbond_sr_bb    hbond_lr_bb    hbond_bb_sc    hbond_sc    dslf_fa13    coordinate_constraint      omega    fa_dun_dev    fa_dun_rot    fa_dun_semi    p_aa_pp    hxl_tors        ref    sugar_bb    rama_prepro    cart_bonded       time                           description
REMARK BINARY SILENTFILE
SCORE:  -1738.835  -3170.933    325.699   2114.038               -160.112                 47.958                106.660   1135.372      -1200.994            -5.546                 -37.172  -1158.902         -161.543       -119.079       -268.213       -157.598     -69.250       -4.206                   41.741     10.520        34.598       238.432        411.449   -141.013     186.952   -114.818       0.000         58.713        318.408  12070.000 HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
RT 0.674692 0.515196 -0.528549 -0.5981 -0.0380057 -0.80052 -0.432513 0.856229 0.282497 -24.9682 12.1013 -63.0086   HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
RT 0.327673 -0.779304 -0.53415 -0.832625 0.028997 -0.553078 0.446504 0.625975 -0.639366 -12.6554 46.0451 -17.0662   HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
RT 0.0851791 0.986988 0.136378 0.990981 -0.0697112 -0.114438 -0.103442 0.144895 -0.984025 4.98394 4.2088 -3.13048   HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
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Lzwf3BpjHsCcBlr7vipA4Bpk3RDcQLIBwRYg3BBIu7DMQdP8voxW4Bpc8OEMCr2/vqlz6BRKERDcKLfDwlyH7BlarwCMG+6Hw0WD6Bp4N3CMrTKKw4Gj8BRpwOCs397GwCOg4Bp3TpCcqyGxvo2m2BpehRDcykdEwYvO8BdRXJD8gkTAw5lU7Bd4jwDs/8AFwEg08BJsexBskM4IwI8W9Bx4mKCc9hQDw HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
LjEH2BNER5DsOZwsvBqg1BpPlPEsrI7sPxZlyBZlCQEs6AR1P2a2wBJ3bHEcn0JhPGF6xBh9XbEMeXN+PheT3B9+zQEsLrO9PLkT6BVRbTE8R6/6PZY/7BNcIWEc0NkCQdf36BRCLXE8z42GQX3a+BleAXEMyuGCQ08d1BBkLcD8qtiavC041BB3vdEM2h+kvR4D3Bx1JCEsHm8AQJEr2BtoIeEMhtHBQ19l6BFvQhEcBvqzPycA7BhXXFEskrX1P HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
LuimUBZYp3F0gqL/vuimYBZYp3F0gqL/vuimUBNs0DG0gqL/v HKH_2021_1WEJ_run_1_complex.133_chain_B_2_0000100001_0000001_0
SCORE:  -1774.666  -3122.374    308.198   2073.812               -160.898                 48.057                107.916   1109.487      -1179.326            -5.920                 -39.670  -1138.975         -164.745       -118.584       -261.974       -154.652     -73.542       -3.595                   23.679      4.337        34.140       237.841        411.158   -139.576     188.492   -114.818       0.000         57.142        299.723  11210.000 HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
FOLD_TREE  EDGE 542 258 3  EDGE 258 215 -1  EDGE 258 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
RT 0.824924 0.246451 -0.508687 -0.324755 -0.529935 -0.783392 -0.462639 0.811437 -0.35712 -19.3132 43.2111 -48.7841   HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
RT -0.770445 -0.541939 0.335732 0.600873 -0.441367 0.666443 -0.212991 0.71519 0.665686 -5.1523 7.72274 20.7977   HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
RT -0.523965 -0.701736 -0.482729 -0.0694923 -0.529647 0.845367 -0.8489 0.476489 0.228751 3.71278 2.91639 -1.05132   HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.1904_chain_B_10_0000100001_0000001_0
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SCORE:  -1771.369  -3102.207    308.276   2043.007               -160.785                 48.116                106.884   1096.901      -1168.530            -5.699                 -37.177  -1128.229         -163.965       -120.749       -266.266       -153.500     -69.843       -3.599                   23.626      5.365        33.847       240.240        410.281   -143.174     188.258   -114.818       0.000         63.450        298.920  29914.000 HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
FOLD_TREE  EDGE 542 258 3  EDGE 258 215 -1  EDGE 258 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
RT 0.747827 0.40937 -0.522658 -0.29074 -0.505813 -0.812172 -0.596846 0.759322 -0.25924 -19.4775 44.6514 -47.9404   HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
RT 0.439371 -0.713539 -0.545725 -0.415625 -0.700043 0.580685 -0.796372 -0.028319 -0.604143 -1.98427 3.13075 30.171   HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
RT -0.533436 -0.687349 -0.492948 -0.0840429 -0.536836 0.83949 -0.841655 0.489243 0.228601 2.35135 2.2072 -0.940152   HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
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LN9nIBde9LGkljZOQN9nMBde9LGkljZOQN9nIBde9TGkljZOQ HKH_2021_1WEJ_run_2_complex.764_chain_B_0_0000100001_0000001_0
SCORE:  -1714.270  -3197.605    331.280   2141.951               -160.878                 48.569                108.555   1137.819      -1209.341            -5.973                 -37.958  -1162.705         -163.924       -115.668       -263.731       -163.825     -71.427       -4.173                   45.164      9.159        38.111       248.980        415.709   -141.546     183.331   -114.818       0.000         66.081        324.594  15682.000 HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
RT 0.878416 0.124412 -0.461419 -0.284177 -0.640286 -0.713636 -0.384225 0.757994 -0.527083 -11.9692 50.742 -45.4822   HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
RT -0.145453 0.47499 -0.867887 -0.962278 -0.271781 0.0125282 -0.229925 0.83697 0.496604 1.37394 36.3499 -18.8886   HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
RT 0.154814 0.986216 0.0583948 0.98102 -0.146475 -0.127062 -0.116757 0.0769575 -0.990174 5.58021 4.07964 -2.61443   HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_1_complex.6_chain_B_12_0000100001_0000001_0
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SCORE:  -1777.911  -3164.859    314.725   2119.061               -160.593                 47.681                105.458   1125.090      -1196.802            -5.911                 -38.254  -1161.004         -160.499       -120.313       -266.109       -159.320     -72.207       -4.142                   26.718      8.443        34.513       244.187        408.131   -141.512     188.158   -114.818       0.000         61.393        304.875  16962.000 HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
RT 0.741431 0.408938 -0.532024 -0.521248 -0.148318 -0.840418 -0.422588 0.900429 0.10319 -17.714 21.501 -62.6512   HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
RT -0.822829 -0.194624 -0.533923 -0.502721 0.687394 0.524177 0.264998 0.699722 -0.663449 -2.319 35.9318 -18.076   HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
RT -0.0179537 0.989835 0.141083 0.999528 0.021286 -0.0221453 -0.0249233 0.140619 -0.98975 5.50946 3.22893 -3.11347   HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
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LQr2WBdof9F017iAwQr2aBdof9F017iAwQr2WBN0vGG017iAw HKH_2021_1WEJ_run_2_complex.335_chain_B_2_0000100001_0000001_0
SCORE:  -1768.639  -3176.361    320.398   2120.955               -161.775                 47.229                108.560   1132.693      -1204.918            -5.547                 -36.159  -1171.935         -168.171       -118.247       -264.678       -159.259     -69.958       -4.119                   31.802      5.299        37.897       241.587        418.224   -144.275     185.513   -114.818       0.000         65.205        316.219  15227.000 HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
RT 0.828956 0.313391 -0.463269 -0.364703 -0.325117 -0.87252 -0.424057 0.892236 -0.155214 -18.5125 44.8783 -47.9052   HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
RT -0.674342 -0.366644 -0.640964 0.192749 -0.925328 0.32652 -0.712818 0.0966408 0.694658 6.16831 -10.8237 -18.923   HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
RT -0.00433212 0.970663 0.240406 0.999734 0.00964622 -0.0209323 -0.0226372 0.240251 -0.970447 -2.33357 -0.736454 -2.22477   HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
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LF7h1A9m+dGkG1y5vF7h9A9m+dGkG1y5vF7h1A9m+lGkG1y5v HKH_2021_1WEJ_run_1_complex.365_chain_B_9_0000100001_0000001_0
SCORE:  -1774.902  -3127.113    309.027   2059.499               -160.814                 48.179                107.753   1114.846      -1178.541            -5.806                 -39.168  -1140.554         -165.012       -119.841       -263.611       -156.908     -73.485       -3.832                   26.057      7.716        36.268       242.718        412.645   -143.932     190.538   -114.818       0.000         59.400        303.887  18283.000 HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
FOLD_TREE  EDGE 542 258 3  EDGE 258 215 -1  EDGE 258 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
RT 0.883013 0.104464 -0.457575 -0.260772 -0.701396 -0.663357 -0.390239 0.705075 -0.5921 -19.6832 45.7322 -46.1635   HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
RT 0.236075 -0.809177 -0.538053 -0.304413 -0.587416 0.74985 -0.922823 -0.01323 -0.384998 -1.30959 -1.09807 27.6783   HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
RT -0.533307 -0.697133 -0.479156 -0.0788367 -0.523005 0.848676 -0.84224 0.490379 0.223962 1.39119 2.21618 -1.21131   HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
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LLgbEBlENMGELlsNQLgbIBlENMGELlsNQLgbEBlENUGELlsNQ HKH_2021_1WEJ_run_1_complex.472_chain_B_11_0000100001_0000001_0
SCORE:  -1760.547  -3223.639    330.426   2170.373               -162.736                 48.698                110.788   1152.681      -1226.511            -5.921                 -38.953  -1182.133         -160.535       -119.610       -266.311       -165.112     -74.526       -3.524                   28.538      8.943        39.665       242.423        419.976   -143.583     189.307   -114.818       0.000         58.477        327.068  14939.000 HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
RT 0.773496 0.389376 -0.50009 -0.316872 -0.445765 -0.837189 -0.548904 0.806027 -0.221415 -19.5546 43.8901 -48.7602   HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
RT 0.833414 0.538048 -0.126194 0.427732 -0.483401 0.763786 0.349952 -0.690527 -0.633013 -5.11754 -21.3757 -23.3298   HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
RT -0.237902 0.90548 0.351438 0.970915 0.211655 0.111921 0.0269583 0.367842 -0.929497 -2.98628 -1.82387 -2.75744   HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
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LH5A1AxJzcGEUNx4vH5A9AxJzcGEUNx4vH5A1AxJzkGEUNx4v HKH_2021_1WEJ_run_1_complex.101_chain_B_5_0000100001_0000001_0
SCORE:  -1778.244  -3117.563    305.535   2062.144               -159.939                 47.022                107.466   1107.308      -1177.983            -5.936                 -37.755  -1142.587         -160.532       -119.799       -262.598       -150.372     -74.017       -3.624                   22.767      4.699        35.260       236.453        415.841   -140.948     189.187   -114.818       0.000         58.404        298.140   7929.000 HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
FOLD_TREE  EDGE 542 258 3  EDGE 258 215 -1  EDGE 258 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
RT 0.860154 0.104126 -0.499292 -0.302431 -0.684143 -0.663689 -0.410695 0.721877 -0.556978 -20.1615 43.8419 -47.5538   HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
RT 0.295111 -0.671494 -0.679709 -0.2273 -0.740309 0.632674 -0.928032 -0.0322113 -0.371104 -2.54264 10.7301 25.6801   HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
RT -0.548843 -0.691327 -0.469934 -0.0443166 -0.537318 0.842215 -0.83475 0.48307 0.264266 3.61139 3.01626 -1.35347   HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIH[HIS_D]NYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
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LG2vMBpBsFGkGRKNQG2vQBpBsFGkGRKNQG2vMBpBsNGkGRKNQ HKH_2021_1WEJ_run_2_complex.259_chain_B_22_0000200002_0000001_0
SCORE:  -1734.867  -3160.047    316.447   2105.598               -161.956                 47.401                106.422   1128.657      -1194.581            -6.210                 -41.537  -1140.013         -158.584       -124.587       -269.158       -153.705     -72.995       -4.038                   36.780      8.353        33.925       242.845        409.444   -138.264     190.418   -114.818       0.000         68.716        310.622   9065.000 HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
RT 0.864282 0.098147 -0.493339 -0.388715 -0.492152 -0.778901 -0.319245 0.864959 -0.387207 -20.1852 32.2939 -56.8313   HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
RT -0.0165618 0.401972 0.915502 -0.345675 0.856865 -0.38248 -0.938208 -0.322801 0.124761 -19.916 33.633 -9.97745   HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
RT 0.153751 0.98686 0.0496854 0.984351 -0.148591 -0.0947306 -0.086103 0.0634728 -0.994262 5.86211 4.06164 -2.6667   HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIH[HIS_D]NYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
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L6VGVBVJg6Fk1ob9v6VGZBVJg6Fk1ob9v6VGVBtEQFGk1ob9v HKH_2021_1WEJ_run_2_complex.692_chain_B_9_0000100001_0000001_0
SCORE:  -1789.019  -3104.653    300.579   2054.091               -160.658                 47.396                107.932   1107.480      -1174.549            -5.777                 -38.645  -1143.013         -165.760       -120.172       -262.345       -153.616     -77.783       -3.062                   21.283      4.874        33.465       236.085        418.708   -142.734     187.821   -114.818       0.000         58.044        300.810  15021.000 HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
FOLD_TREE  EDGE 542 259 3  EDGE 259 215 -1  EDGE 259 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
RT 0.887328 0.11012 -0.447797 -0.251649 -0.698095 -0.670325 -0.386421 0.707486 -0.591728 -19.6848 46.2157 -45.3818   HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
RT -0.861454 0.0497021 -0.505398 -0.433522 0.446347 0.782836 0.264492 0.893478 -0.362961 14.2349 15.753 31.6895   HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
RT 0.0988612 0.441575 -0.891761 -0.822862 -0.467656 -0.322793 -0.559575 0.765708 0.317122 2.17375 0.415928 -3.32927   HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
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LmW8DA5MZgEkCXYkQXzxy/8tdMEkKiSkQuGlo9YyzPE0szQkQruWE/SSmHEEoJCkQwXE+/cWJ1DUhHikQK9Kt/g8XJDkYUbkQNF28/4IjmCEBKqkQDV8t/0R90BkS0ikQsaM+/QmYwAkqGxkQ89cNAl5MhEk0olkQr6i9/I9nHE0N0CkQx2YQAptJzDUbyjkQ5oDx/Ad38Dk82xkQGC/o+wtvJDkWVbkQ8KK4/EQkCDkNFLkQnx8PAd34mC0AkqkQpYAx/ggesCUtR6kQWxks+8YyyBEcjikQfQA6/wQkpBUxsSkQE+p0/09Vt/zR1rkQChmPApDRzA04KxkQUdcz/cpn5A09EAlQ HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
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L9noE/SOdAFUEjgjQaiEe+Sz76E08mKjQdSCh/6FynEEeDCjQWnXR/Ca/fEkmUwiQo/7o/0uA3Ek3PIjQ7vx2/44UlEEKvUjQDmKBAdWCLF0HvOjQKqZB7aFM6E0ecsjQcGI/+uqtIFEgqAjQv7Yv/EBLzEEgG4iQpPbt/AQNnEU4VjjQ0yESA5p3HF0kqMjQ/lr4/0OWYFULnEjQF3G8/w99OFkKXfjQ HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
LBCs9/CwteEkvMPjQmF/LATxrME0CMIjQ22+hAP2jREEqyIjQ9njoAjH1CEE7FIjQKK6GALDHxDkdwUjQGkNj/muodDU51OjQ2Vwd/WwCLDUic9iQTp/B+66DhD0docjQLfoBAXFBlEUXIejQ8PJIA7QaJEUNg3iQDgtGAfh84DEN0ljQKNZTA7EbZDE9QSjQ5yuQ/YrkUDUHhZjQgqXl+2mCxDE4fqjQ HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
LLR1kA79BmE0X+JjQzuDwAzygsE04kKjQ4ZhyAvgX9Ekxo5iQgl8uALTj7EEXXniQzc84A/7vLFkCl9iQ7dOzA7/p0E0I8gjQW0zyAHWhjEE1myjQuWj2AnEVrEUGkIkQnXU5A/9w9E0gqKkQpjn2AzrheE0aUXkQdiEeA7XXxEUClKjQtf+0Az7ieE0iGHjQmB0tADYjBFEdpljQvKT7AzYL7EUAggjQWkw3ALfDWEUmstjQ8FoqA/jxdEEx+zjQ HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
LLjLHBl2hGGUCPBPQLjLLBl2hGGUCPBPQLjLHBl2hOGUCPBPQ HKH_2021_1WEJ_run_2_complex.1859_chain_B_2_0000100001_0000001_0
SCORE:  -1749.325  -3202.027    321.115   2154.988               -162.787                 48.565                108.872   1147.970      -1216.453            -6.192                 -39.508  -1161.394         -168.585       -122.127       -266.485       -157.575     -70.290       -3.332                   31.474      8.912        39.561       243.797        416.195   -144.342     188.400   -114.818       0.000         64.962        311.779  18846.000 HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
RT 0.887431 0.0806712 -0.453825 -0.297326 -0.652169 -0.697333 -0.352225 0.753769 -0.554769 -19.1074 44.2626 -48.0617   HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
RT -0.680857 -0.0592592 -0.730015 -0.386877 -0.817225 0.427164 -0.6219 0.573264 0.533487 3.43808 -16.3535 -11.8979   HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
RT -0.094568 0.894122 0.437725 0.991417 0.0447169 0.122849 0.0902681 0.445586 -0.890677 -4.42678 -1.50931 -2.07742   HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
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LS+7FBBYw2HUHPUPQuv+FBZjZrHUhksOQlhWKBhCNpH0f+lMQHynLBdx+fH0FN/LQoOeABxMnnHEtp4NQy8dDBZAj7HEyeMOQR6BHBxlCnHUk6PQQUbmABRICfHU2QhNQi9S7A5tNpHEW/ePQkCe+AZVprHkkMKMQ HKH_2021_1WEJ_run_2_complex.488_chain_B_5_0000100001_0000001_0
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SCORE:  -1704.157  -3179.001    329.208   2127.184               -163.316                 49.294                112.697   1133.522      -1205.319            -6.011                 -39.010  -1150.234         -167.391       -117.804       -264.658       -159.356     -71.193       -3.690                   39.831      6.602        38.523       245.556        421.717   -143.480     187.521   -114.818       0.000         62.551        326.917  15545.000 HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
FOLD_TREE  EDGE 542 256 3  EDGE 256 215 -1  EDGE 256 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
RT 0.756062 0.411923 -0.508615 -0.257769 -0.526891 -0.809902 -0.601602 0.743442 -0.292182 -20.8015 44.4866 -48.2468   HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
RT 0.790379 0.0528596 0.610333 0.0505179 -0.998501 0.0210574 0.610532 0.0141894 -0.791865 -28.0118 39.8586 -17.8208   HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
RT -0.104945 0.986237 0.127763 0.993807 0.108725 -0.0229593 -0.0365343 0.124562 -0.991539 4.92126 2.55418 -2.93291   HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QHFWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[CYS:disulfide]FLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERH[HIS_D]NSYTC[CYS:disulfide]EATHKTSTSPIVKSFNRNEC[CYS:disulfide:CtermTruncation]E[GLU:NtermTruncation]VQLQQSGAELVKPGASVKLSC[CYS:disulfide]TASGFNIKDTYMHWVKQRPEKGLEWIGRIDPASGNTKYDPKFQDKATITADTSSNTAYLQLSSLTSEDTAVYYC[CYS:disulfide]AGYDYGNFDYWGQGTTLTVSSAETTPPSVYPLAPGTAALKSSMVTLGC[CYS:disulfide]LVKGYFPEPVTVTWNSGSLSSGVH[HIS_D]TFPAVLQSDLYTLTSSVTVPSSTWPSQTVTC[CYS:disulfide]NVAHPASSTKVDKKIVPRNC[CYS:disulfide]GGDC[CYS:CtermProteinFull]G[GLY:NtermProteinFull]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
NONCANONICAL_CONNECTION: 88  SG  23  SG
NONCANONICAL_CONNECTION: 194  SG  134  SG
NONCANONICAL_CONNECTION: 310  SG  236  SG
NONCANONICAL_CONNECTION: 413  SG  358  SG
NONCANONICAL_CONNECTION: 433  SG  214  SG
CHAIN_ENDINGS  437 HKH_2021_1WEJ_run_1_complex.797_chain_B_8_0000100001_0000001_0
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