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:  -1775.986  -3134.596    303.334   2087.950               -162.281                 47.996                110.290   1120.487      -1186.125            -5.879                 -39.501  -1164.566         -158.926       -118.075       -265.718       -152.712     -76.706       -4.075                   23.826      6.284        34.877       238.918        420.425   -142.004     189.570   -114.818       0.000         62.064        303.976   9265.000 HKH_2021_1WEJ_run_1_complex.728_chain_B_3_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.728_chain_B_3_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_1_complex.728_chain_B_3_0000200002_0000001_0
RT 0.873685 0.21989 -0.433962 -0.233007 -0.593916 -0.770046 -0.427062 0.773894 -0.46766 -18.1994 45.2145 -47.251   HKH_2021_1WEJ_run_1_complex.728_chain_B_3_0000200002_0000001_0
RT 0.240294 0.782141 0.574903 -0.398024 -0.460787 0.793254 0.885345 -0.41944 0.200587 -14.7104 19.4285 15.5996   HKH_2021_1WEJ_run_1_complex.728_chain_B_3_0000200002_0000001_0
RT -0.52976 -0.696524 -0.483952 -0.0767509 -0.528888 0.845214 -0.844668 0.484904 0.226725 3.40032 2.7567 -1.43115   HKH_2021_1WEJ_run_1_complex.728_chain_B_3_0000200002_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.728_chain_B_3_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_1_complex.728_chain_B_3_0000200002_0000001_0
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SCORE:  -1694.204  -3252.071    343.796   2188.263               -162.234                 48.108                109.820   1170.897      -1231.985            -6.145                 -39.173  -1193.960         -163.103       -117.823       -271.866       -165.583     -70.895       -4.134                   56.404     13.292        41.502       243.291        420.737   -138.473     186.346   -114.818       0.000         73.735        341.869  15079.000 HKH_2021_1WEJ_run_2_complex.71_chain_B_5_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.71_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.71_chain_B_5_0000100001_0000001_0
RT 0.78999 0.351759 -0.502176 -0.259933 -0.549653 -0.793924 -0.555293 0.757725 -0.342787 -16.328 46.5915 -47.5349   HKH_2021_1WEJ_run_2_complex.71_chain_B_5_0000100001_0000001_0
RT 0.450836 -0.890806 -0.0566745 0.188077 0.15687 -0.969546 0.872568 0.426447 0.238263 -17.2597 41.8297 -29.3179   HKH_2021_1WEJ_run_2_complex.71_chain_B_5_0000100001_0000001_0
RT -0.383777 0.910217 0.15563 0.91032 0.401212 -0.101717 -0.155025 0.102636 -0.982565 5.13342 4.23428 -4.08551   HKH_2021_1WEJ_run_2_complex.71_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]TVEKGGKHKTGPNLH[HIS_D]GLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.71_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.71_chain_B_5_0000100001_0000001_0
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LuGySBRsu5FENRr/vuGyWBRsu5FENRr/vuGySBJW3EGENRr/v HKH_2021_1WEJ_run_2_complex.71_chain_B_5_0000100001_0000001_0
SCORE:  -1774.235  -3170.346    311.656   2108.072               -161.443                 47.843                108.286   1123.797      -1198.480            -6.199                 -41.088  -1135.408         -161.623       -119.076       -260.797       -154.517     -80.294       -3.555                   24.619      5.806        34.224       240.854        409.730   -141.804     188.320   -114.818       0.000         63.242        308.762   7537.000 HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.827_chain_B_24_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.827_chain_B_24_0000100001_0000001_0
RT 0.806904 0.249761 -0.53528 -0.331149 -0.559128 -0.760077 -0.489128 0.790566 -0.368454 -19.7006 43.8566 -48.3647   HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
RT -0.729738 -0.427303 -0.533755 0.666455 -0.270178 -0.694869 0.152711 -0.862796 0.481937 3.38732 -8.26096 -29.6105   HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
RT -0.144288 0.950247 0.276064 0.989528 0.137488 0.0439384 0.00379685 0.279513 -0.960135 -3.05563 -1.36506 -2.09265   HKH_2021_1WEJ_run_2_complex.827_chain_B_24_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.827_chain_B_24_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.827_chain_B_24_0000100001_0000001_0
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LIBWIBvU5YGUBAH5vGk0CBfFkVGUKfF4vCeYABbQlZGUe1/nP8OB8AzHXTGU+g93P4j3+ADTJZGk9qtAwjBCzAPhPYGkNiZ/vMBwtA7ymOGEQIFAweObtA7mahGkP+m8vul0iAXqOOGEOzM+vOhviAbv9gGkzSn6vxEwaA/HkXGEPNc7vdREFAfDWXGkKgj5vjpiJBTONdG0Ceq/vHouCBzR8MG0A3b3ve9WABrV8TGE6WBEwqnYABjnThGEJE2BwPQFyArgWHG0RoKBwYzmxATrBpGUMV+7vcwGdAnkoGGEer0+vxK9cAPIKoG0vcZ4vXOSAATTXeGURA42v HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
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LfzYGBLwmhGkCvoDQsfyIBjXSdGkuOPIQEjMGBP8sSG0MiBJQAKGFBPezQG0ysYLQf/0OBTkRcGUMf5HQZNoRB/H9YGEEfhKQVEoXB7tOZGU3UMKQQYfaB3bZWG0wLyMQ/LMgB78KXGkNweMQ6tsIBnZmjGkDObAQNGCIBb1viGU/z3JQ6IfQBzD6jGUwjkGQiauPB3uXWGEEuzEQloYQBDf4QG0W+ELQe8dQBX9beGEy1HMQ7v2YB7sRhG0B6kJQ49zYB3RmTGEY9oIQWLcZBzITOGUihYNQ5HOZBbV9bGEJtVOQaqGhBz+bVGkz/NOQSipgBDa7eGkkp6LQin0gBDwGSG0SZDLQ HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
LWvCFBzQuLGEfCMGQeKTCBHtACGEN61HQPxm4AHJCEGUs/XIQ1UG0AvA3AG0OcaKQuf/CB7XbyFEUOoDQdatIBzsqpFEqv+CQsYkKBL1WdF0uN+HQoZ+PBLl2SFkvrHHQR6xRBjDFHFUTs/JQtoMGB7uMNG0+ZTCQCr9DBLtt+FEZN0JQ0uvBBnZt4FUHnd/PduWABbVElF0NrlEQ+TbLBHdE3FkNEQCQCF2IBjbDfFEpME/PdSnHBPcJRFUzThIQFx+KBbNSoFUldqJQdV6SBj1HfF09ZJGQi9sPB/ioHFkd0yDQsJYVB75SAFUJfpJQaDFPBbHg7E0JxcKQtPFSBn0URFUDKjLQ HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
LYjizAzZ9JGU7qJFQlwBoALntLG07gSFQW0NkAjkdRGE1eJJQuYuXAvKuOGk+YPKQgWskArxDSG0r9ZAQ2rp3AXf3MGUl49BQlJKkA305DG0h4JFQEYXYAz/3SGkr+cAQKcInAfKwNG0SLp5PsNZoAvp0ZGE/CeAQ HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
LAtqqAvo4YGUiRJKQ4F6nADEnfG0kFaMQrklrADuLbG0TVHPQ0wwqA3XsgG0YKlQQb3XsAXWGrGU6MAMQ98s3AHPJrG0dw4LQel1nAj5IwGEKxcJQn8lxAHJfaG00GLJQs6ZeA73LgG03xdMQGGOqAjM0vGkqDrNQI2E6Az74lGUZ/mKQyM/qA7GM4GkqPPJQYZWeAfJbwGkqimJQZgHqA/earG0pIcHQ HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
LyYrwA7XuRGU04JPQEoF0ADAENGEmm2QQkqwvA313BG0jSGRQJtQzAzAC5FkYcCSQBMFABLe4MG0Y3+QQqgfCBrMnXGUGNNRQm/OCBfbBcGENJVSQF02EBDKBcG0EvLQQt5sxAbNZNG05PbNQlm7wAXiCSGkH5pRQASxBBjShJGUNHEQQfRPBBfHpHGEWMzRQWakGB7EKjG0MJRQQI12EBX2LYG0F5kOQ HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
LOFboA7xl8F0CPQQQLL6jALkOnFE5EYQQTv8PATsvnFk9qDQQqZXFATJA4FkqLSQQwItGAb6hWFUAVuPQd8xpA39CXF02S6OQel+1A7woTFE3ejPQUkm7ATN1BFEoX7NQfbT2APvj2EEfQfMQrrmCBvxh/EkOmLOQoD3lA/bKDGUDABPQsz1kAzk3hFkgGaRQgtOpA3OjcF0vs1MQaM0lAvomHFUcIBPQytx2AnFFQF0Wx1QQJcI6A3fpiFkPvKPQ HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
L6hx0AhuPeGUfh55v6hx8AhuPeGUfh55v6hx0AhuPmGUfh55v HKH_2021_1WEJ_run_2_complex.827_chain_B_24_0000100001_0000001_0
SCORE:  -1760.529  -3147.594    310.737   2087.395               -160.538                 46.881                107.726   1121.281      -1188.228            -5.920                 -38.235  -1143.437         -165.664       -120.560       -267.982       -163.255     -64.659       -3.205                   26.237      8.048        36.794       243.069        414.651   -141.581     188.395   -114.818       0.000         64.876        309.054  14357.000 HKH_2021_1WEJ_run_1_complex.770_chain_B_5_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.770_chain_B_5_0000200002_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.770_chain_B_5_0000200002_0000001_0
RT 0.757943 0.348354 -0.551518 -0.282899 -0.58629 -0.7591 -0.587785 0.731378 -0.345825 -18.3653 44.0415 -50.0844   HKH_2021_1WEJ_run_1_complex.770_chain_B_5_0000200002_0000001_0
RT 0.340315 -0.509674 0.790201 -0.118374 -0.856897 -0.501712 0.932831 0.0772005 -0.351947 -27.2585 40.9309 -22.7541   HKH_2021_1WEJ_run_1_complex.770_chain_B_5_0000200002_0000001_0
RT 0.0192319 0.993149 0.115262 0.994088 -0.00667235 -0.108375 -0.106863 0.116665 -0.987405 5.96217 3.1778 -1.61602   HKH_2021_1WEJ_run_1_complex.770_chain_B_5_0000200002_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.770_chain_B_5_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_1_complex.770_chain_B_5_0000200002_0000001_0
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SCORE:  -1713.351  -3224.736    334.916   2158.998               -161.239                 48.138                106.593   1148.264      -1217.105            -6.372                 -40.480  -1166.334         -161.061       -116.576       -266.039       -157.439     -75.668       -3.729                   46.500     10.870        37.492       240.055        418.773   -141.363     190.052   -114.818       0.000         65.977        332.980  15298.000 HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
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.219_chain_B_3_0000100001_0000001_1
RT 0.787805 0.334504 -0.517176 -0.285395 -0.545846 -0.787783 -0.545815 0.768219 -0.334554 -15.1455 46.3111 -47.6627   HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
RT -0.872713 0.061902 0.484293 -0.243338 0.804799 -0.541373 -0.423271 -0.59031 -0.687296 -11.5223 46.4067 -19.3816   HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
RT -0.017229 0.997478 0.0688502 0.992265 0.0255246 -0.121487 -0.122938 0.0662245 -0.990202 4.4337 3.82149 -2.79829   HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
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]TVEKGGKH[HIS_D]KTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
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.219_chain_B_3_0000100001_0000001_1
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Lfc/DCRg/4CUG4XFQcnHEC992lDkNnxGQBs3CC5uv2DUfJmIQqv6CCJKrFE04TsKQvzfECp9rAEkV1DCQ1lTECtTcYEEuE/CQahLFCZx2jE0MsHGQs/ODCtu4iE06rhAQTo/ECNYl5Ek9a0GQzeDDCdcf4E0+pOBQpk7DCZb3DF0W8VEQM8xDCVenZFUaD+EQFoJECxOYvCk/4fBQhC5ECFlsoD0zx4IQnGjFCdOS8DE+oUBQNQ8DCdf83Dk5YD9PBPBGCtb5bE0ucAIQfpiCCBK4ZEUDRD8PgUsFCRzoCF03yoIQAUOCCdyjAFkklm+PHjCDCRvkeFk6v1CQ HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
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L/DgAC5gyBDUyfYLQasKAClxiuCEp88NQBk4AC1wzFDUXAHQQqFTAC5v5ND0KnKRQ7/cACBhP9BEkZ7NQBg4/B98FOBk0cMQQe+GAC17pc/z99BQQToC/Bdd+09TrNNRQGLS/BJCSD87AzARQ4h4AC9govC0aV3JQdZO+BxxuyCkVMVOQ2iAACJPdgBEu2JMQ6AiBC1YXzBEkjyNQiLfACR8jjB0K/ERQa7w9BRR0cB0cMVQQL+M/BF7Oz+D6jOOQuuKBCxn59+TDg4PQVGCACd9ue+DR6HSQXX78BxXBb+D37SRQgcd+BVoXA+bkayRQpFT+BlyOF9rSyIQQ3BnACBt8E9b6a7QQ HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
LDxICCRhRSDErvzPQ9ayCCtPuqDkEI9QQvNSCC1lrMEEa0+QQCP3BC1w1UE0PDBSQ/mTECZF1pDE71wQQ8BHFCBEYBE0oa0RQF0mGC1jq8DETlmRQfAeHC5xZNE0dMeSQ0lVHCNHdJEkv48TQOPoCCtxLJD0P3FOQi/iCCN4HcDkRh6RQxkpECpZwIDU6bxQQ1IjECZW92DEEgjPQp13EClYbSE0uawRQyR1ECxaf3DUKF0SQKQ4GCRrlbD0Kc0RQ+z0GCd7iBEUyWkQQhmgICVoHLE0YDMSQZ2LHCpC7dEE9+QSQpz7HCJKvTEEEgcUQ5UXGCJB/LE04gRUQN5mHC1Cx0Dk65KUQ HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
LGpRCCVUKXEksjpPQYq8BCBB0tEE2QZPQUEjAC1JmzEUfvKQQ91VACVLjEFUKlwQQ3xFCCFRe0EE2+eMQ1ukCCdrSPEk2Y+NQySqCCp+s2Ek1hTQQFZ5BCxOcFFUywTMQnRGDCF9+wEkHxzLQEcYBCF0rrEEcmRLQ HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
LJYM/B5bSlEkje6PQRoZ8BN/QpE0jnQQQ3Oi7Bt5LiEEA7pRQELK5B9yajEUR8/RQSzn6BtkHeEUcacOQWc76BRTkHE0uVkOQC8S7BhLCmEkXilLQYmp/BV9ZXE0nn9OQQUE8Bpje6EkIuLQQ/Rn4B5PbhEket7OQBSw8BZN5DEELZNOQhAA6Bp3BeEUouKKQcd+6B5oM3EkdmfLQBtW9BlyhiEUpaGLQ HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
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LCzh/BR6xvEkLzeUQlojAClqq8EErsZVQyoDACVxuTFkVXbVQJis9BpOmXF0+FZVQro2ACFOgiF00vlVQIWDCChqt7E0SlCVQ90rCC10VlE0vBNVQ5DMECFlXkEUC55UQonwEChlX0E0BHiUQWrwECFMQTE0blDVQsVV/Bttm0E0xNhTQIVcAClUI2EE07ZWQmxLCCVThAFE/2/TQ4EnCCFm5GFUJRqVQO4gCCF98fE0KXOWQywKCCNsSaEkXmiUQ HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
LMQkUBVdi9FkKV59vMQkYBVdi9FkKV59vMQkUBtOxGGkKV59v HKH_2021_1WEJ_run_1_complex.219_chain_B_3_0000100001_0000001_1
SCORE:  -1751.353  -3113.211    313.765   2075.462               -162.020                 48.535                106.853   1117.495      -1181.103            -5.815                 -38.116  -1153.471         -153.260       -120.397       -265.224       -157.460     -74.644       -3.751                   29.725      5.365        36.980       232.950        413.447   -142.401     189.303   -114.818       0.000         58.267        306.191  15472.000 HKH_2021_1WEJ_run_1_complex.579_chain_B_6_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.579_chain_B_6_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.579_chain_B_6_0000100001_0000001_0
RT 0.756328 0.406854 -0.512287 -0.271484 -0.517267 -0.811622 -0.595201 0.75293 -0.280769 -20.8771 43.9613 -48.1177   HKH_2021_1WEJ_run_1_complex.579_chain_B_6_0000100001_0000001_0
RT 0.0105353 0.264937 -0.964208 0.640214 0.738927 0.210031 0.768124 -0.619513 -0.161831 -1.59124 -2.08617 13.8524   HKH_2021_1WEJ_run_1_complex.579_chain_B_6_0000100001_0000001_0
RT -0.535429 -0.699195 -0.473753 -0.0723311 -0.520911 0.850541 -0.841477 0.489671 0.228337 1.76861 2.40039 -1.4419   HKH_2021_1WEJ_run_1_complex.579_chain_B_6_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_1_complex.579_chain_B_6_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.579_chain_B_6_0000100001_0000001_0
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SCORE:  -1746.584  -3167.436    322.067   2104.150               -159.398                 46.343                105.265   1123.528      -1195.857            -5.608                 -36.297  -1136.568         -170.915       -118.809       -263.356       -156.528     -71.713       -3.737                   34.653      6.832        34.199       234.877        414.244   -139.965     188.605   -114.818       0.000         69.089        310.570  12113.000 HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.19_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.19_chain_B_9_0000100001_0000001_0
RT 0.746295 0.367988 -0.554643 -0.372679 -0.459411 -0.806258 -0.551502 0.80841 -0.205714 -17.3254 39.328 -53.0294   HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
RT 0.0684916 -0.476039 -0.876753 -0.995155 0.0295342 -0.0937769 0.0705356 0.878928 -0.47171 -13.951 42.5202 -15.0268   HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
RT 0.0327724 0.99076 0.131608 0.997621 -0.024436 -0.0644657 -0.0606541 0.133408 -0.989203 6.02432 2.25894 -3.17374   HKH_2021_1WEJ_run_2_complex.19_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_2_complex.19_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.19_chain_B_9_0000100001_0000001_0
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LY9b9B5Ih4DkYnY2P4Ab8BdySAE0rNgtvSn/8BlqHbDkwKv6vCnU7BJsJPDU1joAwGqu9BBxfUE0GO53vZ+C9BVM9pEEpB4pv+T0+B14b7EEpbn2v+5G6BJ+7uEEpKSvvMe5+Bh51FEU4ea6PltR6BhsPCEkAvkrvMQ5/BJzaSEED2F3v8hJ9B1N7VEUUBJAwlJg9BpvEpEE2+C0PTtY+B1zrKFE2ortvjXdACtTX3EkfHG0vuIb+Bp/y8EkXg1/vyqr5Bh7F+EETpX7uDoo5BhKxvEU5/O8vTz54BVbxiE0KxvIv HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
LizT/BtLnGDE2rx5v3d3/BVVejCk0JjAwKmy9B5ZKACkdO0/vQD28BhItbB0502DwDuWBClc6SC0nqq/vd8wBCpE4jBEzHBEwObODCVqOMBku3cDwjvqDCVFSOA0zD0Hwt9GFChy7w/Dk7THwwQXACtqyQD0U35wvNVr/BNA1uC053mEwwbDCCVdrtCURyAAwW4cBCVWkECU22e3vbvJBC9MgqA0ijlDwQHmBCtvo+Bkgy/HwRj1DCN1JDCEPHuDwoLZDCx+8uAEROH/vUAFDCFbvn+DoqlHwJRgDCFYYsA0fM2JwbzYFCpUdh+joqIJwsCqFC9mawA0JEiHwSESFCVfH5+jWhwDw HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
LBx/8BtrCtBUP97zvFv66BR/8sAkdbixvxgJ4B9WWRBEPEN3v4bo2B1XLrAkSyq9v6666BtEkJAUnqS1PWry4BxS4I+TDx94PFfM5BBdc97TQiECQab22BhFHC77DVBEQbVe2BxH9R/7rV3AQS359B5qmEC0+GjYP+jV7BFFGx/jx/Q6vTP48Bla2c/D5GZ4PxKn6BJNh+AEpYQ8Pely2Bt61A/jscb4P1O84BVHYM6ziuDsP8cB7B1n2L3LlVJCQ7Vb5BxN0n+T0byEQo0O3BBEGl8rReFIQwgA1BB1lP5TwA0DQBK70B5e7JA8nzZCQLbC2BZPA3+7oh15PwgI4BFjDNAs0MCBQ HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
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LNbC2BtGO4CE0rSDwz6h1B9wGGDkQsXIwhah1BNgChCE7vVKwneU1BNsInCEqnxMwXsi3BFrDpDk7lPJwuBO6BxMtZDErGNJwwPU3BZjXIEk3H6Gw5V53B9v38CEhdwBwCpizBd/gUDkPXaIwLxG3BBffxDU05PLwhAn6B9xjNDUNl7GwDEu4BFyXUEk0OJIwHrS1B5agOEEDwKHwZLx3BFvQEEUP0yCw HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
Ldg91BlXU0BUxhVJw/r21BN+FpAE7NBLw8DmzBFDpZ/DySMKw9mizBhjGM8DRsELwGJi4BpWd3/zkPGLw7Nl6BlGqqA0RRxMwIcW6Bhp6pAU0bPPwOpi8BhSNSBE6+jLwmqO2BNHhrBUi1oGw4sZ1B1Jf9AUTZDNwKKT5Bhvbs/D+ODJwnVS4BhpKt9TGR4Lwrm69BJTuwB0TApMwDRq8B92oSBEIDiJw HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
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LrOUYBpBRJGU9JnAwrOUcBpBRJGU9JnAwrOUYBpBRRGU9JnAw HKH_2021_1WEJ_run_2_complex.19_chain_B_9_0000100001_0000001_0
SCORE:  -1788.045  -3152.759    313.316   2105.510               -161.431                 47.615                107.776   1139.886      -1194.196            -5.715                 -37.056  -1182.108         -164.380       -116.966       -261.833       -171.398     -79.939       -3.795                   28.320      4.025        33.739       241.821        420.014   -140.634     188.566   -114.818       0.000         60.881        307.514  23706.000 HKH_2021_1WEJ_run_1_complex.870_chain_B_7_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.870_chain_B_7_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.870_chain_B_7_0000100001_0000001_0
RT 0.834588 0.207924 -0.510128 -0.325746 -0.56051 -0.761392 -0.444244 0.801621 -0.400065 -17.6818 45.6345 -47.2871   HKH_2021_1WEJ_run_1_complex.870_chain_B_7_0000100001_0000001_0
RT -0.373842 -0.0411917 0.926577 0.744535 -0.609069 0.273318 0.553091 0.792047 0.258364 -16.1545 -20.0413 -13.8518   HKH_2021_1WEJ_run_1_complex.870_chain_B_7_0000100001_0000001_0
RT 0.0122251 0.95873 0.284055 0.995146 -0.0394074 0.0901772 0.0976495 0.281574 -0.954558 -2.16027 -1.64821 -1.49945   HKH_2021_1WEJ_run_1_complex.870_chain_B_7_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.870_chain_B_7_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.870_chain_B_7_0000100001_0000001_0
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SCORE:  -1798.940  -3132.134    303.404   2064.561               -160.205                 47.135                105.409   1124.903      -1183.036            -5.712                 -37.869  -1152.407         -164.464       -121.878       -265.687       -157.473     -74.302       -3.143                   26.548      6.624        34.344       241.812        417.118   -143.764     187.050   -114.818       0.000         56.748        302.295   4144.000 HKH_2021_1WEJ_run_1_complex.551_chain_B_12_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1WEJ_run_1_complex.551_chain_B_12_0000100001_0000001_0
RES_NUM A:1-437 B:438-542 HKH_2021_1WEJ_run_1_complex.551_chain_B_12_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.551_chain_B_12_0000100001_0000001_0
RT 0.786075 0.289412 -0.546192 -0.366902 -0.492664 -0.789091 -0.497462 0.820685 -0.281085 -21.6875 41.5066 -49.5196   HKH_2021_1WEJ_run_1_complex.551_chain_B_12_0000100001_0000001_0
RT -0.360462 -0.557842 -0.747582 -0.725259 -0.336382 0.600705 -0.586572 0.758722 -0.283327 5.14129 12.6689 33.4038   HKH_2021_1WEJ_run_1_complex.551_chain_B_12_0000100001_0000001_0
RT -0.530802 -0.701318 -0.475818 -0.0722603 -0.521944 0.849914 -0.84441 0.485518 0.226371 2.77851 2.85183 -1.03741   HKH_2021_1WEJ_run_1_complex.551_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.551_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.551_chain_B_12_0000100001_0000001_0
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LN3RCB9uFqE0klokQTGQDBRLOVEEMSykQ80B8AZcHJEUJN1kQU0Z7AtMqrDUlIxkQfmVGBZKWXEUmKHlQorDIBln8BEEsmQlQ1OmLB59KFEUV6jlQ63nNBxd8fD0wwslQBIPRB1lkmD0dU/lQBWjDBhHz3EUg6vkQYFpFBllsLEkChnkQ7Q5JBd6GhE0viElQK12DBp9sfEEQ3SlQrBiEB94gxDk7OVlQu4PKBlY3xDEBeElQQ0CPBtcAPEURYflQp6XJBZViNE0sVwlQgaQKBVQMMDElrxlQza1PBNdZPD0LNglQXHnSBt7WKDkyvEmQL8ZUBViX5D0wW6lQNtRPBNT01DEsGLmQ HKH_2021_1WEJ_run_1_complex.551_chain_B_12_0000100001_0000001_0
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L3CtJBlHRHGEH6HOQ3CtNBlHRHGEH6HOQ3CtJBlHRPGEH6HOQ HKH_2021_1WEJ_run_1_complex.551_chain_B_12_0000100001_0000001_0
SCORE:  -1722.309  -3190.260    329.722   2124.255               -160.373                 48.404                105.287   1129.725      -1203.326            -6.302                 -41.254  -1157.593         -160.649       -116.802       -271.489       -152.451     -70.718       -3.575                   43.223     10.061        38.535       238.576        411.265   -141.577     187.665   -114.818       0.000         70.059        332.101  12489.000 HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.889_chain_B_4_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.889_chain_B_4_0000100001_0000001_0
RT 0.815689 0.2503 -0.521537 -0.363325 -0.479896 -0.798558 -0.450163 0.840863 -0.300505 -20.6109 42.9584 -48.7181   HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
RT 0.748815 -0.604657 -0.271416 0.05003 0.459911 -0.886554 0.660888 0.650286 0.374639 -21.8222 43.4813 -25.3878   HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
RT -0.142878 0.987836 0.0613655 0.98974 0.14256 0.00955661 0.00069212 0.0621013 -0.99807 5.39244 2.88483 -3.03358   HKH_2021_1WEJ_run_1_complex.889_chain_B_4_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.889_chain_B_4_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.889_chain_B_4_0000100001_0000001_0
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LYe1lBJkfdEkrTyIQU2RoBZbvQE0RjrIQEk1pB93DSEULTRLQGrAqBF4CjEkfyfMQ4MGqB5XNYEUJwzEQOaApBBy1VEkCkR+PBEqoBZ4Y1DUAaz5P7CIlB1wctDk6lv6P8qCmBpL0tEUxerIQAPwnBBeCAEkDVXIQ77iqB9MMpEk3/YFQLg/rB9slPEEbCBFQKMEnBZ78cE0iTB+P/LTqBJMYeEUrUs4PEonkBhbiNDkDIO4PxigkBhCfxD017bBQC2FkB5cQCE0m6YzP HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LfwDrBBqUAEE3jEMQluzsBxPEBE0MqYOQ1JsvBBeO8DEuKgNQWAgwBF4oZDkbQpMQbwDsBV9GgDUvcPQQM9HpB1aynDUbvtQQGrEuBtDxhD0IkaRQ0x/nBpTDFD0V4mRQEDzqBBoNlD0n/BLQsMpsBVguQEUoyUPQCXIsBVWiADUdgkPQNJCpBddCDEEj8PRQzb1nBtXEqD00UrPQ0oltB9ilJDkd4JSQAyFwBxmqbDk8KDRQhSAuBZMnAE0vS4RQ9l9lBtvJND08h4RQmCBoBZ0kmCkw+ERQ6pKpBlKICD0P+gSQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LbmMxB1sYPEk9TtNQyw/zBd0oQEEGM8MQtQQ1B9sgjEEidYOQP1L0BNfQ1EEu8TOQ3nR0Bh4wRE0Xm4JQrmH3BJ9JUE0H5xIQbcV5B9v+IEU2bwJQtHh3B9cuhEkI3TFQZV07Bt8NME0MAoIQ+785B5bwkE020GDQ74G8B53GaE0X+CFQzAUwB1QvcEUhjbOQLf/0BpJGCE01fnNQh5azBptPDEEXDBJQQqFzBBcJfEEJZJJQVwH5BJQU7DU3KaLQ7E01BZGMqEUU0sDQbOj9BpiqDEUosXJQpYK6BtVrvEETWm/Pl2C+BBJecEUwNPDQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LkJZ3BxJgfEUUs4PQwvr4B94jwEU0DtQQCz35B9O/BFkP2oPQkxw5Bp38UFUaOKQQuC56BpYRnEkuRkRQtnJ4BZVgQEUH/8PQygL3BlO13EEwGWRQdGz7BNLB0EE/AKSQDQE6B5fMbEEk6OSQ4Sa8BxdDgEUPa7QQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LA596B9Kh7EkSnXNQ/UU8BBlCKFUppiLQ4qV/BlyPIFk6T3LQG9KACJMo/EUDU2NQvB76B5ovrEEtV7MQRMx7BVyPGFkiGfJQmss7BpNcaFErS7LQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LtEZACVyAQFUPH3JQpO2BC1qWPFUXByJQTSdCCRarlFk4D7JQ2obCCFubxFElS5HQBhSCCpSrEFk20UGQBMuBC59AuEEgrBGQe0yDChdwEFUGY1FQ3q4BCd0LjE0Z1qAQwBy/BpqLXFEuBVIQqLNCCdfEGF02jeLQBz2BC9AfNFUSSDDQVNNCChBQkEEg1hIQOErACpBvuEEkE7GQiCFECt2o9EE8kICQpCMECpJ+UFE1C7FQPxOECh1r7EEEFkIQ7BcBCRkiTEUf38AQFkYBCRZXsEkj2P7Pii7CCFpdhE0sIM/P HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
L9WEDCZB/qFEL5MMQHInDCZMPAG0kioMQhf3ECV/0CGkHSALQlZCFChD3LGkn9DKQ0W6DCBe4BGUfcmPQ+2qCCV1tCGkmmrQQCnCDCx+NEGE9uJSQSHzBClLDFGE1SCTQHrJCCpBMGGEAqeUQ3fFDCBiBgFUuEsNQ661CCZu+FGEaKDMQWahEChCk2FUkqKQQ+efECNvMJG09g2PQFdECCpKhJGEseWQQscECCJ3+2FEflkQQEKpDC1F66F0oKfSQfVoDCl9fLGEa7QSQmuNBC5l+LGE5nuSQRaMBCJJv7FExG6SQUgTBCNctGGk3yBVQnxrCClsf/FUr2xUQ58sCCRD4MGECOnUQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LsjvFCdl91FkbGrKQYCAHClPV5FEFoQJQO50GCd9y5F0YNdEQMkLGCxHzrFEghICQqV/HCRUAoFUa4FKQZCcICZgrpF0JHBNQMKYJC1XcXFULwxNQMw1JCVoGZFEDdVQQVApKCprCGFEa+vQQLLiFCFUinF0Y0eLQTsZHCBDaEGkun3JQenhHCBncYFUk41JQLw3ICBagoFEEzzIQ+c8ICFG74FURQVNQo8jHCNOIpFUZwTOQZ+2ICZJUIF0jEiNQovPKC9feXFEBudMQqJdKCxhXnFEmUcQQhO+ICVkgaFkBQ/QQmz7KCRmzHF0pVtRQVQEKC91n4E089qQQnDdLCJumEFkpFKQQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LFMdHCF5wEGEU32BQnfXHCpzzFGETSG4PGi7HCRXl4F07VqoPfnWHCdwhxF0gSozvuWFICpT5PGkXGfwPXP9HC5W0RGEJIm3vSEoIChgIcGEG/T7vv/fICtfldG0DmsDwpaKJCFQjnGU3AmFwJh+HCB1OKGEXf/DQUgUGC1fXGGk5c1zPthrHCx71WGkXNZ4PNQJJCphWPG01WV0PQeZICVGLLGk+4S8vC95GCZ4SSG0ayy5v2VKICtj6iGkt0i2v7prJC974bGUOoL5v6P9ICB4vWGkYGsFwuZcHCtw4dGkLvwEwLfDJCBeIoGklWzIwpavIClv+tG0lR0DwASJKC17QnG0lSrEw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LdhDJCVRLwF0lA9zP21rJCxZieFEbXOVP2M2ICtrdKFkMF9hPPOuICtUu+E01gM1vppFLCFCkaFkpc5xPEI/KC1ThWFkf1HAQ8f9LCJ8KuFERFNsPl3eJCFyJ2F0Pep8PSsxJCNWsiFUS0C4v6xhLCRXnMFEfwQgPy0zLCFBMQFEAvXBQyP9MCd5TrFERIl0P1/BMC5eLxF0SkDzvQjhLCVnC8F0zs61P HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LfmMICpqPHFk/Ya6PVGWHCpFp0Ek4qw7P7TJGClOP2E0oejwPZDuFCxmHmEU0oZSv3F6GCxHCyEktBsDQENAICZ7LrEk54gHQvpgHCdxboEUcOmKQBVYGCJQ2tEk+EJLQXpQIC1w8gEEyWOMQ9UXIClebRFE8dRAQD46HC18fmEU4ji5PmBjGC50VBFk5pGFQ15FGCF4pmEkkn9DQqJbICtdGcEEHCIGQ68yICBUJ3EEItbHQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LnbnFCRfsJF03m6qPT0fECRXFMFU4mNxvPd6EC5tYGFUAu6/vq+MEClMj6E0bmsCw9q+DClVuiFkQkNxvZMTDCddRoF0ltKyPFliCCZ6u7F0OyAxPMKTDCBbwHGUgRptPq1zDCF5kNGE2Tr7Pb3sDC9kSKG0GazCQvcbECJDyWGUDvz5PQY9FC1+XWF0vBZ2PTusDCpOWBFECxXovHQzECVcvtF0XkLzvrZSDCF37kF0GqN7vpTnCClznbFkbL21P2nAECht3pF0COg7Pea1BCh936FEyHWov9oBCCtIT8Fkukt7PxtZDCpqwKGEno+vvRUODCZdSDGUwKzDQj/GEC9apOGUFD4FQyrgEC1DtZG0i0UpPRYyECloFbG07WBAQ HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LERGGCBSpNFUQroBwh0jGC581IF0bnBHwnRyGChl5wEE8lwHwkKeGClD/nEUlOAKw8Q3HC5vpUF03BJIwThvHCxL0sFUa+bIwdiEJCZbS3Fk7e9IwuEEKCJOSsFUNuzIwiVGJCNqEFGUFvgJwiKpGCVKqXF0vAb+vS2yFC9zBOFUz76IwiHlICBDjRFU2EFFw4iSICZpWOFkhp+Jw71DHCtodwFEFnEKwkfUHCRzTzFkKeOFw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LnFTHCJ/SmE0vilDwSwkHCVsgPEkbU2DwQBSGC5y0CEEwBMEwuTLGCVqBoD0SvcHwR0VICFHmIEELQr9vAByJCtPGREUrj98vhRWKC97yXEUFPhCwt5UKCBtWQEEEOuwvkmlHCRQzuEEhTRAwLZKIC1HGMEU3RYHw6GzHCRe+NEUTuS1vJHYICNhguD0v6W9v HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
L8CQFCp5QJEE8NKBwri/DCdDd7DUnDfBwuuWDCdP1AEkKT7Gw+wwCCx0rjD0CKiIwAKADCpkpDEU4hJ6vkEoBC9qntDE64n6vJo2BCpZ59CkYo55v5XwACF3U6D09GilvHLYFC1rVVE0PQ28vgLOECZ27ZD05TCBwkLeDCV3rAEUfu1pvmwyCC9aqUEkIfw6vJUIBCVF20DkpOEBwsK5ACx5PuC0QyT6vEgdCCtSgyCUqXNAwA4VCCltK2C0hWcpvjon/BhhRpD0PY5ov1HPBCtVpyD0XhfzPYxlACZX2NE0Td4ov HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LuDdDCRgBUEkJfmIwg42CCFpfXE0CONLwDwhDCx+cJE0Y0QNwJN1CCJ0IAEEu/6Owh38CCxExuEEtoGMwHaFCCZXe7EEVsTKwTtgCCp9DxEkPkDPwEPQCC5V7SFkp8eKw0j6DCdzTgEUtRMHwSlzBCB3HTE0qZGLw8k+DCRZb0E0342LwKHFBCd1U3EktctKwtlTCCB5z2EEiUTIwAFlCCxkkBF0ZCoPwH4JDCJ4vnEU6/LQw1OfBCpkmrEUymRPwkzmBCdHgaFUViCJwZFSDC5oeWFksABKwk8ACCpq8YFEqMdMw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
L0d3ECBcFIEESAPNw98iFCt6E1DE3ZLPw5aFFCJ22GDUTB6OwQ+1ECxjNxCE6mdQwwyCHCF/s3D098xOwx5ZFClM4QEEjE4LwNmSFCBpHAEEkolQwvUjHCNt4jD0D/HQwXBWHCJ5QMEEYxBPwTITHCt+qsD01JxMw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LRX6ECBuD4CU18aMwaGaECxLMNCkT98LwfGDDChEyGCkWbHNw4k0CC9laOBUmkgOwPTXECRH+BCUH6AJw69kDClOFzA0PCbIwVtHECdpZH/zMq4IwWXSCChek5AUkRxGwOyYDCRtuY7TmfTIwcIkBCFuEj/DcroFwOAHCCBHMK8juogGwwPZBClXfX8rnQSFwRSLFCRV4KDkz40KwQWEFCx6ztBU628Mw2aYFCh4b5BE0fWIwai8DCxXHcCE3MvHwl/HFCJe17+zJ7rJwZY2BCNkG4BEh6CGwTe0DCRzWP8L2+pIw06jAC5iRu/TAFBEwtrgAC1ynw67uBHEw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LJTICCtPCkCEPSiMwtJyACtjKfCEVVgNwlLwAC9fKiCkPBRQwFjCAC1UJKC0n+6QwuAx/B15JCD0ovUMwOTP/BhXnADkbhQJwTYu9BRLZpDUAicIwYvr9BtueYC00ShIw7TYCCBtd9CU14VLwOGbACVMi/BEmI8MwV0VACJzFhDkeXxMwRm19BFAqADEJiUNwJAkACNcUADEekMIwMGY9Bt6HpDUrflEwAt6+B9fuCEEK69IwpK07BJtwqDEEGfJw+TV9BVKNYCUfawEwYRy7BFZNYC0YukJwH2z+BNpz4B0JUDJw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LbBjBCdlP+CUM23QwoveBC9goBDkCsUSw094BCZjfXCUDf9SwDwRBCNF8ICU+h7TwWUUCCB55mD0Rn1SwKHICCBQcvDUNEVUwEX3CCd3lLEEPzwUw8OnCCJIvQEkr0OWwy2VDCp2XkEEBBqWwbIJCCxhcSDk9cVQw+NdAChLGHDUTvnSwTWECCpx6BEUINSSwo3XDCJlMgD0/upSwMLfCChdGUDU905Uw56DBCZ8jzDUUCiUwyHiCCVANZEU3+JUwhw7DCJSYJEkOymUwlh7CCZmWDEURe2Wwk0iBC5mVTEEv4XWwYTJDC1frnEUwtnXwoTCDC9eAxE0bIEWw6IVEChkSiE0RQiWw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LL45CCRlcCC0QlaSw1kQDC9cvyAESo+SwqOPCCp5Lb/jHRlSwVEtBC9UeA+TzYbTwxkqECp3GaAEY+gSweHMFCNfkI+Tl1BTwe/oGCZh/g9jyvmSw4bKHC5/jM8bgV2SwTxMHClAuw9rJSTUwixcDCV42PCEqnpRwHZQDCd4M4Ak0HEUwwZXFCFFsLBkOu0Sw2qrEC5+cYA0P6aRwNalECRhi/5z58nSwRQHFCZKdF+TWcHUwvTRHC5qoK/DimJTwj1tGCtZ+M+TiejRwWDLICR3Bc87TscSwhyhGC9nzg+7IIUSw/yjHC9DRw/LeVYUwo2PGCh2ct9rtutUw0lyHC5zcf6LaJ0Uw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LjW7BC1SdN/z+FTRwfLEBC1AZM8T2qyQw4GT/B1vAS8jueWRws4M+Bd4Gx77uAuRwoO/ACdUNo8Tt/jOwRUWCC5biPAU2goQwaShBC91MO7rIJERwaNZACJ41g4rm/0NwVV/BCBSRa8jASuNwOEiACB+SN/T4bAOw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LSYM+B1+gg/z3djRwJAb7B1gHx/D8s9RwHMF7BpS9m/jBWeTwy934BhMY//TCTAUw9sK6B1zAMBEK7ZRwFpe7Bxf4KCUuQ6RwcYQ6Bhc5MBEMFvPwcsN/B5iLmAEr/TRwSAV6BphDG+ThvhRwScJ4BZJXPBU/quRwffY9BFsUICU6uwRwPCV5BBKsDCkQABPwipK5BhyqVAUz5+Ow/5T8BZyMKBEI7CPw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LhZT9Btj1Q/zqmMUwBHM9BtTr9+T9woVw/AR+B55f83jFYFWwkYz+BZBIL2b3iRXwn+m+BZusnAE00VWwApF9BJG96BktoQWwYlB7BRogCCkSh7Ww2LC+B98AbCkoceVwfNI/Bd4lC/z3UvTw1RG7BhSjB/TtR8VwEcSAChxowAkwc4VwJU7+BtIhXAkrtYXwTuG9BNLC3C0zFZVw5Qt/BxrBVC0A27Uw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
Lgrj+BhzzT9bwiJVwmzj/BFCyJA8a7gVwLBr9B95HRBcQ9EVwrEQ7BVU/KBM7ISVwCdm+BRtNLCM9NuUwXWMBCFB4YAMZK9Uwg3RCCt9n/+7MelVweHsDChF6i/L6bEVwBQ2DCZDdnAsd0NUw0TnECdvkQ+7CriVwC/H+BpqXi8LxaKUweQt/BRj0MA8VYmWwONMBC1rKMAsWV4TwCyeBCJMYbBM6dGVw42QCCtubT/rEbqWwl5BCCd5eq7LX2ZVw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
LEyyUB9C08FEcjTAwEyyYB9C08FEcjTAwEyyUBhBaGGEcjTAw HKH_2021_1WEJ_run_1_complex.889_chain_B_4_0000100001_0000001_0
SCORE:  -1760.358  -3128.127    309.279   2085.510               -161.617                 47.217                108.015   1116.883      -1182.604            -5.355                 -34.044  -1149.875         -162.617       -121.201       -266.466       -151.854     -77.488       -3.920                   25.657      6.023        37.544       240.964        417.025   -144.421     187.726   -114.818       0.000         56.464        305.739  12588.000 HKH_2021_1WEJ_run_2_complex.400_chain_B_20_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.400_chain_B_20_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.400_chain_B_20_0000100001_0000001_0
RT 0.767638 0.268321 -0.582009 -0.405068 -0.500609 -0.765056 -0.49664 0.82304 -0.275598 -21.2901 42.2333 -48.89   HKH_2021_1WEJ_run_2_complex.400_chain_B_20_0000100001_0000001_0
RT -0.340807 0.936957 0.0772087 0.215499 -0.00208216 0.976502 0.915101 0.349437 -0.201204 -9.94897 9.23786 13.8673   HKH_2021_1WEJ_run_2_complex.400_chain_B_20_0000100001_0000001_0
RT -0.556297 -0.673509 -0.486743 -0.0690159 -0.546273 0.834759 -0.828113 0.497967 0.257407 2.38005 2.51847 -1.4045   HKH_2021_1WEJ_run_2_complex.400_chain_B_20_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.400_chain_B_20_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.400_chain_B_20_0000100001_0000001_0
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SCORE:  -1690.450  -3203.614    345.602   2130.887               -160.156                 47.581                106.397   1131.675      -1210.008            -6.186                 -40.342  -1151.104         -164.680       -116.913       -266.543       -156.299     -79.901       -3.399                   37.300     10.148        37.434       240.070        417.383   -143.128     190.125   -114.818       0.000         72.533        359.508  16629.000 HKH_2021_1WEJ_run_1_complex.4_chain_B_7_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.4_chain_B_7_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.4_chain_B_7_0000100001_0000001_0
RT 0.890784 0.146249 -0.430251 -0.215937 -0.696846 -0.683942 -0.399844 0.702151 -0.589159 -21.9068 45.3766 -45.7137   HKH_2021_1WEJ_run_1_complex.4_chain_B_7_0000100001_0000001_0
RT 0.176639 0.843804 -0.506748 -0.91402 0.331642 0.233626 0.365194 0.42191 0.829835 -0.301936 39.1393 -32.5234   HKH_2021_1WEJ_run_1_complex.4_chain_B_7_0000100001_0000001_0
RT 0.248731 0.967366 -0.0483279 0.955116 -0.253258 -0.153668 -0.160893 -0.00793664 -0.98694 5.45757 5.01062 -2.86876   HKH_2021_1WEJ_run_1_complex.4_chain_B_7_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.4_chain_B_7_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.4_chain_B_7_0000100001_0000001_0
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