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:  -1760.313  -3179.198    321.472   2103.022               -161.339                 47.873                108.430   1137.894      -1199.834            -5.595                 -35.968  -1149.581         -166.135       -121.025       -272.541       -153.297     -75.840       -2.254                   32.796      6.841        37.260       239.213        416.646   -142.279     189.485   -114.818       0.000         66.583        311.873  14443.000 HKH_2021_1WEJ_run_1_complex.207_chain_B_3_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.207_chain_B_3_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.207_chain_B_3_0000100001_0000001_0
RT 0.937335 -0.0544397 -0.34415 -0.257486 -0.773669 -0.57891 -0.234743 0.631246 -0.739205 -20.4208 44.2448 -47.3415   HKH_2021_1WEJ_run_1_complex.207_chain_B_3_0000100001_0000001_0
RT 0.513039 0.774715 -0.369606 0.294966 0.245253 0.923497 0.806093 -0.582811 -0.10269 -35.6547 -6.21969 -63.6602   HKH_2021_1WEJ_run_1_complex.207_chain_B_3_0000100001_0000001_0
RT 0.0427635 0.991061 0.126372 0.994104 -0.0295937 -0.104313 -0.0996408 0.130087 -0.986483 2.31555 -1.82277 -9.98425   HKH_2021_1WEJ_run_1_complex.207_chain_B_3_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]DVEKGKKIFVQKCAQCHTVEKGGKHKTGPNLH[HIS_D]GLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.207_chain_B_3_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.207_chain_B_3_0000100001_0000001_0
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SCORE:  -1766.114  -3176.230    316.942   2118.055               -161.538                 48.054                108.781   1122.932      -1199.739            -5.794                 -36.514  -1152.148         -168.158       -122.712       -266.426       -159.089     -71.505       -3.311                   29.159      6.725        39.311       240.010        421.585   -141.789     186.585   -114.818       0.000         59.013        316.507  19141.000 HKH_2021_1WEJ_run_2_complex.823_chain_B_8_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.823_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_2_complex.823_chain_B_8_0000100001_0000001_0
RT 0.88545 0.0786699 -0.458028 -0.277407 -0.701256 -0.656723 -0.37286 0.708555 -0.599104 -18.9543 45.637 -46.5815   HKH_2021_1WEJ_run_2_complex.823_chain_B_8_0000100001_0000001_0
RT -0.384244 -0.76828 0.511959 0.907581 -0.416006 0.0568857 0.169274 0.486503 0.857124 -17.4897 -14.9173 -28.8995   HKH_2021_1WEJ_run_2_complex.823_chain_B_8_0000100001_0000001_0
RT -0.0865818 0.976325 0.198226 0.9924 0.0670596 0.103174 0.0874388 0.205653 -0.974711 -2.60214 -1.66994 -1.99425   HKH_2021_1WEJ_run_2_complex.823_chain_B_8_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]IQMTQSPASLSASVGETVTITC[CYS:disulfide]RASGNIHNYLAWYQQKQGKSPQLLVYNAKTLADGVPSRFSGSGSGTQYSLKINSLQPEDFGSYYC[CYS:disulfide]QH[HIS_D]FWSTPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVC[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.823_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_2_complex.823_chain_B_8_0000100001_0000001_0
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SCORE:  -1759.928  -3115.444    308.367   2070.843               -161.311                 47.273                107.369   1110.266      -1179.614            -5.762                 -38.485  -1138.886         -159.686       -119.692       -269.342       -148.583     -71.460       -4.250                   24.746      6.166        35.885       235.659        415.515   -142.972     188.309   -114.818       0.000         60.442        299.538  12931.000 HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_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.1024_chain_B_5_0000100001_0000001_0
RT 0.822394 0.22615 -0.522039 -0.328595 -0.560253 -0.760356 -0.464429 0.796852 -0.386437 -18.6514 44.6608 -47.8461   HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_0000100001_0000001_0
RT 0.682065 0.676325 -0.278157 -0.21902 0.551827 0.804685 0.697723 -0.487926 0.524511 3.26195 16.1889 8.08991   HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_0000100001_0000001_0
RT -0.520025 -0.704532 -0.482917 -0.069561 -0.528567 0.846037 -0.851314 0.473553 0.22586 4.29981 2.18931 -1.48046   HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_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.1024_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.1024_chain_B_5_0000100001_0000001_0
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LOnpZB1FIhG0cwwgQA7MaBlB5lGkAgbgQeGNXBpolwG0uZagQnYVZBRAd4GU4pRgQaiYYBpTBeGU4FKgQH+6YBBEWiG0VPnfQnd2XBZjFaGU2yEfQl10XBRtSfG0kGZeQdZRXBFktXGEPX1dQ/mgYBdcSZG0MVygQpEZeB9CnnGUHpYgQy9taBdCqWGEPULgQM9NUBBF7bGkarMgQgVTWBFaSpG0elifQWn+cBJtzkGU02jfQRDJbBVFZUGk9iFfQd/IUBRx6VGkLpKfQHnlUBRv/kG0G/XeQcddbB51WjGUeAVeQpzVXBx50bGEQwZdQkKaaBxilSGEzB2dQdy0TBZCeTGU872dQ HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_0000100001_0000001_0
LQsVSBxi5wG0svjgQ6GIPB9dt6GUXNlgQ4qVRBF6oCHUEa1gQkeOSBtZEMHEEIxgQJEcJBZTN4GUOqtgQFwtFBlU3BHkqZwgQQdVABFDX+G0CT5gQPwn4AVmiHH0j36gQgAh7Ax5gPHE1xLhQ/k2QBp90pG0bwpgQ1r/OBJxg+G0KgVgQXWbHB1b2yGkpXjgQm+tJBdyO0Gk9D9gQX4eHBhKyHHk/F7gQO0GFBRvhFH0SHhgQE/f9AZqY4GEs+ugQyC6ABlc36GkPHJhQLIS4AB9kLH04lrgQWdwwA98QEHU3c+gQueD2AtlbVHkCCMhQlny7Ax4+LH0UKahQS2bBBBP3SHkfgIhQ HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_0000100001_0000001_0
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LqerPBxohMGkqDONQqerTBxohMGkqDONQqerPBxohUGkqDONQ HKH_2021_1WEJ_run_1_complex.1024_chain_B_5_0000100001_0000001_0
SCORE:  -1789.971  -3100.951    298.075   2054.369               -161.295                 47.304                108.489   1109.196      -1170.717            -5.333                 -35.698  -1148.021         -163.275       -119.141       -265.320       -154.867     -77.246       -4.164                   21.004      6.361        35.161       236.493        412.205   -143.514     188.476   -114.818       0.000         54.663        302.596  32627.000 HKH_2021_1WEJ_run_1_complex.248_chain_B_12_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.248_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.248_chain_B_12_0000100001_0000001_0
RT 0.820704 0.213367 -0.530018 -0.32688 -0.585493 -0.741854 -0.468609 0.782095 -0.410771 -19.1461 46.2602 -45.9955   HKH_2021_1WEJ_run_1_complex.248_chain_B_12_0000100001_0000001_0
RT 0.722039 -0.343042 -0.600817 0.582029 -0.16831 0.795559 -0.374034 -0.924118 0.0781339 -0.739749 5.59714 21.1015   HKH_2021_1WEJ_run_1_complex.248_chain_B_12_0000100001_0000001_0
RT -0.53227 -0.698902 -0.477729 -0.0695963 -0.526273 0.847462 -0.843709 0.484327 0.231479 2.98405 2.9764 -1.21558   HKH_2021_1WEJ_run_1_complex.248_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.248_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.248_chain_B_12_0000100001_0000001_0
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LK+nKBR3aGGU9WyNQK+nOBR3aGGU9WyNQK+nKBR3aOGU9WyNQ HKH_2021_1WEJ_run_1_complex.248_chain_B_12_0000100001_0000001_0
SCORE:  -1706.737  -3245.168    344.139   2177.810               -162.062                 48.766                108.008   1163.540      -1230.953            -6.491                 -41.691  -1187.514         -159.475       -120.526       -268.869       -167.287     -65.838       -3.570                   53.094     11.184        40.911       242.562        419.665   -143.223     189.426   -114.818       0.000         73.609        338.031  18526.000 HKH_2021_1WEJ_run_2_complex.8_chain_B_3_0000100001_0000001_1
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.8_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_2_complex.8_chain_B_3_0000100001_0000001_1
RT 0.800923 0.331547 -0.498596 -0.43312 -0.25417 -0.864757 -0.413436 0.908556 -0.0599708 -19.2011 43.9463 -48.5939   HKH_2021_1WEJ_run_2_complex.8_chain_B_3_0000100001_0000001_1
RT 0.000502594 0.837815 0.545954 0.909762 0.226258 -0.348052 -0.415129 0.496863 -0.762099 -2.87534 -11.5513 -9.25934   HKH_2021_1WEJ_run_2_complex.8_chain_B_3_0000100001_0000001_1
RT -0.158461 0.963272 0.216788 0.984058 0.172032 -0.0451081 -0.0807458 0.206184 -0.975176 -3.35351 1.13694 -3.22965   HKH_2021_1WEJ_run_2_complex.8_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]TVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.8_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_2_complex.8_chain_B_3_0000100001_0000001_1
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Lo8JzARWhSGkVgS8vo8J7ARWhSGkVgS8vo8JzARWhaGkVgS8v HKH_2021_1WEJ_run_2_complex.8_chain_B_3_0000100001_0000001_1
SCORE:  -1771.080  -3161.954    313.410   2128.974               -161.098                 46.110                108.132   1132.391      -1201.657            -5.916                 -37.275  -1176.347         -164.073       -118.789       -262.844       -156.993     -83.563       -3.572                   28.105      5.944        37.194       239.598        418.589   -143.053     192.960   -114.818       0.000         57.768        311.694  22404.000 HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.755_chain_B_11_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.755_chain_B_11_0000100001_0000001_0
RT 0.885426 0.0771229 -0.458337 -0.283455 -0.691912 -0.664011 -0.36834 0.717851 -0.590776 -18.5898 45.2897 -47.2684   HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
RT -0.694145 -0.100439 0.712794 0.714165 0.0279475 0.699419 -0.0901695 0.994551 0.0523303 -13.7537 -19.2822 -7.92919   HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
RT -0.0340098 0.919252 0.392198 0.9973 0.00566196 0.0732111 0.0650789 0.393629 -0.916963 -2.60541 -1.50214 -2.21368   HKH_2021_1WEJ_run_2_complex.755_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_2_complex.755_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_2_complex.755_chain_B_11_0000100001_0000001_0
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LbCBCBvxicIEEs8EQ8C8CBPYuYIkPvvAQqK1IB/YuYI0FUi+PO/PKBv6YYIkJYVyPTZRBBHgHTIUg4mCQf3a2AXwKSI0ajpDQwcA1AHXmMIkWbHGQdzIwALaxSI0JgA9PVinAB/GVbIk4kTIQyErABz85ZI0S9g6PzHZDB7RQSIEJ8UGQvHiCBnqPQIU+wM/PkWezA3qEVIkHbhGQvsjsA/w5LIU418GQTqh5A3fXMIUPF7IQk453AfXkJIEGZWDQlatnAr9ESI0w2m+PATAzAft5PIkBTU2PguFxAbPwWI0Ul65P HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
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LewoJBTgibIE7SIAwWxtKBH31WI0pnXDwWebQBfBnWIEObjFwyHCSB79mSI0A8/HwPVdJBvKsRIUb6LAw3B1MBbtKRIkYJn2vrRjDBjGnRI0LNw8v30GKBfMObI0KCO4v/BAIBHi9WIUwKyGw7CRKB7kYOIklWrCwGSvMBzobUI0GH1svM3xCB3U7NIU43b4vSz/ABHo0RIEvF5Bw71uCBHV/UIU+wI3v HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
LawuTBDvpaIUPmTEwLTOZBTwxaIkn0TGwfOaaBbQsfIU3C4IwsFFfBLJ8gIUwjYJwuxPdB74SaIE+/yBwaHddBzBxUIUscz+vbtgfBz4BRI0Kr7BwJWcbBblKUI0i3myvbWXSBLz3dI0iXJCwTHyZB7lUXIEF+cIw05LcBvNJdI0AvT9vgwmgBfoWbIEY3ODwajfbBPCnQI05L5lvoOwZBzOWXIUuW8kv HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
L7JPWBPXciIkdUyJwdi6WB/EMnIUdTdLwjDqTBzxzmI0eyBOw2SvSBTlciIE5rEPwQu8RBHC6qI0+pFPwwhcVBnmUsIEES7Jw9EHZBzZmtIUe1FHwj/zXB3N5yIkmBUEwlLJUBjhl1I0EA+Fw8piaBHEO0IUETfAwLJgSBHVOhIUURSJwSWHbBTFfnIU1TBMwYEYRBn98rI0QpJJw1ihVB7tuvIUDASLwWoOdBnHttI0hFQIwL0yYBPrXqI0OHMEw HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
LrhX3AJXqiGEnbt2vrhX/AJXqiGEnbt2vrhX3AJXqqGEnbt2v HKH_2021_1WEJ_run_2_complex.755_chain_B_11_0000100001_0000001_0
SCORE:  -1772.470  -3102.764    305.502   2056.417               -160.978                 47.337                106.317   1100.994      -1172.682            -5.908                 -38.822  -1138.801         -159.370       -119.803       -263.898       -152.205     -76.192       -4.265                   23.861      5.861        32.929       234.724        410.517   -139.792     190.102   -114.818       0.000         60.342        302.924  10909.000 HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_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.1744_chain_B_1_0000200002_0000001_0
RT 0.809423 0.241933 -0.535072 -0.355566 -0.523242 -0.774462 -0.46734 0.817121 -0.337501 -19.8466 43.7833 -47.8415   HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
RT -0.143136 0.390934 0.909221 0.634872 -0.66849 0.387374 0.759243 0.632686 -0.152508 -6.2145 9.95536 21.9991   HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
RT -0.525302 -0.700178 -0.483537 -0.0636289 -0.534342 0.84287 -0.848534 0.473528 0.236139 4.24715 2.89713 -1.46309   HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_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_2_complex.1744_chain_B_1_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.1744_chain_B_1_0000200002_0000001_0
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LilIQBhBjnGUMFkkQGD4VBdXMmG0wxhkQTdCXBtBggGE/lMkQoAuaBlwnjGE24AkQnyNYBhBNgGUG+0kQQuTeBBgGfGEuo0kQPPVgBpTjZGEFiHlQYx3dBdt0XGU9vWlQ5QpiB9drWGU0lGlQnoJOBBmLkGkfcwkQvHuXBtRGuGEPKhkQ8CJXB12bkGUUlDlQ3qaWBF0aYGUJ51kQ5elfBhLHbGEtHmkQ1z4fBl/CnGE8m0kQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
LgG0TBJoUYGEoHHkQvtrUBJe3SG0J0yjQU8wTBVweaGkrFgjQGD+WBBNsaGUBFRjQmG8QBBwYJGUMKwjQxLFSB1BMAG0+K+jQJ/OPBJVmsF0UK4jQx7YJBJ6LuFEkx5jQh4YGBF7wqFk6sLkQB7nIBB50lFEr4dkQScGBBZchsFUPzKkQd37QBJcqVGEQmRkQLOzYBB4BQGkHUyjQbR3MBdI7LGE6XzjQCuJRBFPjGGUeyfjQ/aSWBd5M9FkbD9jQRo/QBJAICGEUVOkQ3VOQB92WpFEv0njQx/lQB1HbfFEy+BkQlGbHBBvsxFUmNsjQ0mrMBVwBkFELOfkQbgXGBZh6jFE7drkQXPm+AB+NwF0s48jQfCy9Ate2pF0QGYkQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
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LTM2bBN3p1GEHLXiQ+lIcBlq7/GEwIMiQjV9gBZCaDHEnEJiQSkshBp4WHH0y33hQBmJZBdUWIHUivYiQgxzZBVVC1GUsVliQOsTaB5yB/GEub8hQ7GTZBxO+PHU0YQiQzPEVBN4xFHkiVaiQGa+aBdUNJHk5joiQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
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LETUmB5zqzGU59EiQssjnBVjStG0ln0hQf1bmBtsNwGEjqehQEk6nBtJlwGEv+OhQLkJnB1dZhGE/m5hQlwloBRd9cGkquNiQe5onBtbiRGEkqRiQflnrBZiVdG0xnKiQ/sKlB5kJwGUXnQiQ0nqpBxJDvG0Pe0hQVmAlBZv7fG0ic7hQMX5nBd20cGExOshQz/CoBRcthGkrrbiQzXnoBRpYOGkL9fiQxWelBdHhRGEODUiQ54IoBhFjMG0JAEiQ29ksBBQIaGkSsYiQm0KsBxRlYGUXv8hQzSSsBxMclGESUIiQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
L631jBNMtyGUU4chQRbxiBFug1GEW0HhQ/vSkBpXA/GU8e+gQ1f9kBhkK/G0LergQDLjfBl/B4GUHjIhQ1tJdBFye6GkFIygQnXJXBJAz8GkVtygQ+WGVBBEp/GkNJcgQ15SPB5soCH0V4bgQtEmiB5DMyGEfzphQoFEjBlP0uGEtD9gQV8ZdBRPPxGEBcPhQOo3eBtr5+Gk38ShQqvLfBh8XBHEOMrgQRL2dBpZlzGkZungQY0AVBFDt1Gkad4gQCnWWBlJbDHU4k9gQjOaXB5OWGHkP/VgQGnsVB5Wy4G0prRgQs8KOBNuiEH0FDMgQWi+MBBPl8GEMPhgQgbuOBVhFJH0vQlgQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
LXi4kBdUCHH0spLhQq+amB1z+PHUKVDhQlAapB9JINH0ORBhQWjoqBhfmOHkvfwgQ2sEmBVLwZH0q2RhQREjnBpK4jHkabKhQ2Q6mBJoUtHkOGZhQnFmoB93T3H0t+ThQe17nBFDQ8Hkzs+gQLDLkB9T8GHkGHbhQYDrlB9x7RHUBczgQnB9jBxppbHEXIThQCbxmBlovXHkK+hhQQMtpBBeeiHU3fKhQ1f8mB9ZwlH0yF6gQQ7ykBVXWvHErtXhQEqTnBtA+qH0fcphQPlPoBdwN9HE8cghQnPtqBFAI1HU1BUhQxSGpBljXBIEQf8gQ7KToBF392HUFPygQcMAmBtZc+HkfY+gQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
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LGexsB9lE3Gk3y7gQwHntBNLCvGkodsgQUH6sBtFwxGklMVgQ33RtBdkHrGU+yGgQtOesBJS9jGE1sygQFLopBFk1jGE6KygQJ6atBBCugGkyNJhQ5e8qBhLS2GEayChQBRyvBRmcuGk5btgQWLJtBlMTeGEETngQ/67oBFvipG0GE7gQ26nsBRP5YGUlCNhQYImvBNJegGENcJhQPptsBdBfmGUu8UhQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
LXMsrBl6I7GkaYRgQ84/qB5/d+GEVH3fQu9VsBNV0IH0iWofQksdrBJBoNHUM2IfQM9/nBpcW/G0u7wfQJEmmBhEy0G0qrtfQq24mBddNvGkKCNfQ3zFlBFc7xG0v1GgQEBWrBVCaAHEHtdgQHEtrBNCR4GUvThfQJJKnBZvwDH0KAGgQhRknBpC8DH0OKUfQVOGkBJCCrGEqiGgQ0x9kBF5w2G0I4TgQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
LkFcuB19SMHkmg+fQQZ1vBFPHWHUURyfQ/K2yBRZTUH0ysvfQfNwzBBjXMHExYdfQu9Y0Bt6saHk0RAgQC8MvBpPXfHkHqIgQJPPsBpY3iHkjFJgQ2CrrBlhisHEqoXgQnuhtBhV/wHksXggQJIWpBtwZvHki7ZgQdCEvBhJEIH0tJMgQ6qJvBBEfYHUNiSfQNnvvBJn+cHUI5YgQB8ZwBRoUmH0jgEgQTInrBJqukHUKnxfQxdCrBV4HcHENoOgQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
LZWoPBhLZHGU1xENQZWoTBhLZHGU1xENQZWoPBhLZPGU1xENQ HKH_2021_1WEJ_run_2_complex.1744_chain_B_1_0000200002_0000001_0
SCORE:  -1762.430  -3126.576    317.665   2063.604               -161.013                 47.778                107.170   1116.621      -1180.182            -5.189                 -36.149  -1152.139         -164.204       -120.391       -266.663       -158.823     -72.167       -3.819                   36.274      7.950        34.516       238.317        413.284   -141.766     186.886   -114.818       0.000         58.399        313.005    557.000 HKH_2021_1WEJ_run_1_complex.658_chain_B_4_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1WEJ_run_1_complex.658_chain_B_4_0000100001_0000001_0
RES_NUM A:1-437 B:438-542 HKH_2021_1WEJ_run_1_complex.658_chain_B_4_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.658_chain_B_4_0000100001_0000001_0
RT 0.867925 0.119732 -0.482047 -0.339214 -0.566045 -0.75135 -0.362821 0.815633 -0.450671 -21.4019 36.2624 -52.9878   HKH_2021_1WEJ_run_1_complex.658_chain_B_4_0000100001_0000001_0
RT 0.308828 -0.693078 0.651359 0.675419 -0.322362 -0.663244 0.669653 0.644768 0.368563 -16.9634 25.3789 17.2329   HKH_2021_1WEJ_run_1_complex.658_chain_B_4_0000100001_0000001_0
RT -0.557871 -0.677307 -0.479619 -0.0746071 -0.534637 0.841782 -0.826568 0.505389 0.247727 3.90755 2.66236 -1.49306   HKH_2021_1WEJ_run_1_complex.658_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]TVEKGGKHKTGPNLH[HIS_D]GLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_1_complex.658_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.658_chain_B_4_0000100001_0000001_0
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LzkyNB5xyHGUDJxMQzkyRB5xyHGUDJxMQzkyNB5xyPGUDJxMQ HKH_2021_1WEJ_run_1_complex.658_chain_B_4_0000100001_0000001_0
SCORE:  -1757.793  -3160.714    318.631   2082.074               -159.787                 46.929                106.012   1113.743      -1190.030            -6.236                 -40.386  -1130.249         -168.285       -120.503       -266.174       -150.544     -67.615       -2.112                   33.632      7.359        34.500       238.318        414.742   -143.488     188.740   -114.818       0.000         66.346        312.123  19976.000 HKH_2021_1WEJ_run_1_complex.831_chain_B_14_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.831_chain_B_14_0000100001_0000001_0
FOLD_TREE  EDGE 542 359 3  EDGE 359 215 -1  EDGE 359 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.831_chain_B_14_0000100001_0000001_0
RT 0.878781 0.0474567 -0.47486 -0.20944 -0.855744 -0.473114 -0.428812 0.515218 -0.742072 -20.2895 45.0202 -48.0362   HKH_2021_1WEJ_run_1_complex.831_chain_B_14_0000100001_0000001_0
RT -0.435659 0.33617 -0.83498 -0.522154 0.661219 0.538651 0.733183 0.670656 -0.112533 -8.81983 7.20028 -74.9712   HKH_2021_1WEJ_run_1_complex.831_chain_B_14_0000100001_0000001_0
RT 0.79295 -0.459605 0.399992 -0.163915 0.471371 0.866569 -0.586824 -0.75271 0.298437 0.833899 -4.25796 10.1798   HKH_2021_1WEJ_run_1_complex.831_chain_B_14_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.831_chain_B_14_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.831_chain_B_14_0000100001_0000001_0
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SCORE:  -1763.910  -3162.838    320.431   2128.854               -161.063                 47.176                110.328   1140.866      -1202.847            -6.117                 -39.597  -1191.728         -170.829       -119.479       -262.725       -171.228     -74.667       -4.063                   35.451      7.585        38.800       235.253        421.242   -140.013     190.736   -114.818       0.000         65.213        316.169  17419.000 HKH_2021_1WEJ_run_1_complex.601_chain_B_20_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.601_chain_B_20_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.601_chain_B_20_0000100001_0000001_0
RT 0.885884 0.0888835 -0.455311 -0.282579 -0.674988 -0.681572 -0.36791 0.732455 -0.572845 -19.1596 44.8056 -47.5515   HKH_2021_1WEJ_run_1_complex.601_chain_B_20_0000100001_0000001_0
RT 0.660444 -0.744337 0.0988693 -0.738606 -0.62029 0.264011 -0.135186 -0.24739 -0.959439 -21.7607 -12.4216 -12.131   HKH_2021_1WEJ_run_1_complex.601_chain_B_20_0000100001_0000001_0
RT -0.23944 0.947404 0.212354 0.970904 0.234503 0.0485223 -0.00382736 0.217793 -0.975987 -2.33961 -1.79274 -2.07634   HKH_2021_1WEJ_run_1_complex.601_chain_B_20_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.601_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_1_complex.601_chain_B_20_0000100001_0000001_0
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SCORE:  -1793.751  -3104.523    309.454   2044.747               -159.630                 47.578                105.396   1105.170      -1168.491            -5.660                 -38.003  -1142.334         -163.946       -120.106       -263.469       -162.402     -73.080       -3.605                   22.552      5.697        36.211       234.374        411.394   -143.778     185.676   -114.818       0.000         58.074        303.770   9260.000 HKH_2021_1WEJ_run_2_complex.221_chain_B_11_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.221_chain_B_11_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.221_chain_B_11_0000200002_0000001_0
RT 0.756202 0.392173 -0.523793 -0.293169 -0.512589 -0.807034 -0.584988 0.76384 -0.272648 -19.4942 43.7749 -48.7463   HKH_2021_1WEJ_run_2_complex.221_chain_B_11_0000200002_0000001_0
RT 0.0342323 -0.268828 0.96258 0.509326 0.833379 0.214632 -0.859893 0.48292 0.165449 -5.91653 10.4455 26.0657   HKH_2021_1WEJ_run_2_complex.221_chain_B_11_0000200002_0000001_0
RT -0.53116 -0.698659 -0.479317 -0.066248 -0.529739 0.845569 -0.844677 0.480887 0.235092 1.81567 2.31772 -1.05901   HKH_2021_1WEJ_run_2_complex.221_chain_B_11_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_2_complex.221_chain_B_11_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.221_chain_B_11_0000200002_0000001_0
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LNJ6FB1OjLGU8R9NQNJ6JB1OjLGU8R9NQNJ6FB1OjTGU8R9NQ HKH_2021_1WEJ_run_2_complex.221_chain_B_11_0000200002_0000001_0
SCORE:  -1742.145  -3210.150    330.813   2150.076               -161.322                 47.507                108.109   1146.968      -1215.059            -6.096                 -40.935  -1178.202         -158.548       -121.620       -265.234       -160.550     -78.344       -3.604                   41.714      8.887        39.345       246.221        420.301   -142.164     185.761   -114.818       0.000         67.125        321.675  17602.000 HKH_2021_1WEJ_run_2_complex.129_chain_B_11_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.129_chain_B_11_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.129_chain_B_11_0000100001_0000001_0
RT 0.80821 0.216037 -0.547837 -0.375306 -0.527928 -0.761865 -0.453809 0.821353 -0.345596 -18.836 44.4918 -48.0683   HKH_2021_1WEJ_run_2_complex.129_chain_B_11_0000100001_0000001_0
RT 0.348953 0.502884 0.790784 0.926851 -0.309896 -0.211924 0.138487 0.806891 -0.574238 -6.28697 -11.8231 -9.22989   HKH_2021_1WEJ_run_2_complex.129_chain_B_11_0000100001_0000001_0
RT -0.415397 0.584404 0.697077 0.869579 0.480036 0.115748 -0.266978 0.654245 -0.707591 -5.7329 -0.581763 -4.59143   HKH_2021_1WEJ_run_2_complex.129_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_2_complex.129_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_2_complex.129_chain_B_11_0000100001_0000001_0
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SCORE:  -1743.237  -3141.137    318.613   2071.063               -160.571                 48.589                107.627   1118.327      -1183.794            -5.706                 -37.596  -1131.471         -165.271       -121.696       -264.563       -154.542     -70.458       -3.642                   36.162      5.408        36.136       242.779        413.383   -142.444     184.136   -114.818       0.000         60.540        311.707   1645.000 HKH_2021_1WEJ_run_2_complex.845_chain_B_10_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1WEJ_run_2_complex.845_chain_B_10_0000100001_0000001_0
RES_NUM A:1-437 B:438-542 HKH_2021_1WEJ_run_2_complex.845_chain_B_10_0000100001_0000001_0
FOLD_TREE  EDGE 542 255 3  EDGE 255 215 -1  EDGE 255 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.845_chain_B_10_0000100001_0000001_0
RT 0.783466 0.42391 -0.454403 -0.47084 -0.0722961 -0.879251 -0.405575 0.902814 0.142952 -32.0095 15.1974 -58.3302   HKH_2021_1WEJ_run_2_complex.845_chain_B_10_0000100001_0000001_0
RT 0.385826 0.583099 -0.714937 -0.877561 0.471056 -0.0893973 0.284648 0.661893 0.693451 6.61619 45.4111 -18.8952   HKH_2021_1WEJ_run_2_complex.845_chain_B_10_0000100001_0000001_0
RT -0.618736 -0.332303 -0.711856 0.478653 0.559056 -0.677014 0.622941 -0.759625 -0.18685 5.29902 1.94677 -2.22246   HKH_2021_1WEJ_run_2_complex.845_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]TVEKGGKH[HIS_D]KTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.845_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.845_chain_B_10_0000100001_0000001_0
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