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:  -1782.935  -3169.431    312.125   2125.415               -161.433                 47.306                109.699   1136.576      -1201.463            -6.198                 -38.963  -1186.701         -166.416       -119.473       -263.975       -162.390     -72.276       -4.042                   28.283      8.330        35.502       242.167        420.851   -142.691     188.680   -114.818       0.000         59.057        313.343  34327.000 HKH_2021_1WEJ_run_2_complex.447_chain_B_10_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.447_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.447_chain_B_10_0000100001_0000001_0
RT 0.784056 0.265101 -0.561229 -0.367191 -0.530898 -0.763753 -0.500427 0.804903 -0.318911 -20.4082 43.1217 -48.9674   HKH_2021_1WEJ_run_2_complex.447_chain_B_10_0000100001_0000001_0
RT 0.622493 -0.0295157 -0.782069 0.754727 0.287071 0.589896 0.207098 -0.957455 0.200976 1.52144 -16.4167 -31.9736   HKH_2021_1WEJ_run_2_complex.447_chain_B_10_0000100001_0000001_0
RT -0.696143 -0.157331 -0.700451 0.435044 0.683681 -0.585932 0.57107 -0.71262 -0.407494 -1.87126 -3.44531 -2.33801   HKH_2021_1WEJ_run_2_complex.447_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.447_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.447_chain_B_10_0000100001_0000001_0
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Lnn1oBvnxtGEeK6qvmpEpBHOCoGEdPm2Pz9gnBL6StG0RJ9/Pe1koBL4EvGk94UEQjpMoBfxhcGUfM20PYwznBL6JXG0/ckAQrr9pBDFuTGkargDQ6NOlBbfrVGkk/hCQYdjpBz1xOGEjUMIQk80kBbn1QGE9PYHQlH+mB7EVNGUFWJJQf2kmBTeUIGUa4jLQNCIoBDs7pGU8wZ5vfhJrBjBMoGkH/t5POixpBbFSYGUPBcpP4rXmB3C2bGEFkNmPX7+rBbz0UGUpw/BQAqgjBjJaYGUlYNAQojQrBfCAMGU8oWJQc+ziBLMvPGktrcIQf6skBXNdIGUMWAMQ HKH_2021_1WEJ_run_2_complex.447_chain_B_10_0000100001_0000001_0
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LNxalBDcvFHEpbjAQCrXmBrRXQHUkbBCQiMooB7DiPHkI+FGQGfvoBDgqVH0Qn+IQ7RMnBPxxWHU9VO6Pcn4nBXDZiHk/nu8PCEaoBfGqoH0awcqPmL9oBHSa0Hkvb/xPg1YpBXUn6HkBB9xvoZZlBP/VDHUPaT5PDfxkB7eqUHkgz+DQVuklB3HqWHk3PvwPVI7oBLs+SH0H0A1P51ppBrWsiHUKn6AQEvNmBf2BmHk3AhAQm9pmBz5GoHURegqv/kHqBLlQlH0bcjkv9ztqBn4H1H0DPE6PVDPnBLUv3H03aM5PW8spBr+LBIUtMHtv5xsnB7L25H0ZHr5vm49qBDUr3H0bJ/4v HKH_2021_1WEJ_run_2_complex.447_chain_B_10_0000100001_0000001_0
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LC6bvApoUTG0lPX5vC6b3ApoUTG0lPX5vC6bvApoUbG0lPX5v HKH_2021_1WEJ_run_2_complex.447_chain_B_10_0000100001_0000001_0
SCORE:  -1748.505  -3143.449    318.439   2096.882               -160.878                 47.550                107.015   1123.780      -1188.851            -5.814                 -38.114  -1159.078         -161.634       -117.566       -268.349       -161.800     -75.078       -4.114                   32.136      7.569        38.742       243.070        419.958   -144.579     191.832   -114.818       0.000         50.871        317.772  21672.000 HKH_2021_1WEJ_run_2_complex.1578_chain_B_12_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.1578_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_2_complex.1578_chain_B_12_0000100001_0000001_0
RT 0.938726 0.199112 -0.281333 -0.0590213 -0.71133 -0.700376 -0.339574 0.674066 -0.655992 -24.8588 44.9671 -44.7194   HKH_2021_1WEJ_run_2_complex.1578_chain_B_12_0000100001_0000001_0
RT 0.463537 0.861336 0.207929 0.015696 -0.242607 0.969998 0.885939 -0.446366 -0.125977 -14.545 24.5571 8.85746   HKH_2021_1WEJ_run_2_complex.1578_chain_B_12_0000100001_0000001_0
RT 0.0294729 0.990681 0.132978 0.99413 -0.0151972 -0.107118 -0.104098 0.135355 -0.985313 5.02263 3.82793 4.28654   HKH_2021_1WEJ_run_2_complex.1578_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_2_complex.1578_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_2_complex.1578_chain_B_12_0000100001_0000001_0
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LsRBpBdJ/FI0ivuEQ/afrB9qAIIU9hLHQvK+tBhsgGIUIzCEQpWDuBd2aCIkZFUBQxKwrBxM5FI0TOZKQCr9oB5OXCIkSOzCQhYYrBxfXMIUuhTHQZ7jtBFWiHIESUULQEuAqBdnJHIUAefLQHu3rBh5jBI0WGXKQ HKH_2021_1WEJ_run_2_complex.1578_chain_B_12_0000100001_0000001_0
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LMPLVBVO+6FEf0pKQMPLZBVO+6FEf0pKQMPLVBNHfFGEf0pKQ HKH_2021_1WEJ_run_2_complex.1578_chain_B_12_0000100001_0000001_0
SCORE:  -1766.514  -3175.017    315.350   2106.442               -159.827                 46.404                105.913   1125.967      -1195.269            -5.680                 -36.957  -1147.072         -158.830       -119.322       -264.295       -158.972     -76.084       -4.213                   29.277      6.349        38.514       244.518        415.398   -138.646     188.139   -114.818       0.000         58.913        307.302  12117.000 HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.86_chain_B_0_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.86_chain_B_0_0000100001_0000001_0
RT 0.773724 0.452764 -0.443121 -0.467174 -0.064668 -0.881797 -0.427902 0.889282 0.161485 -34.0403 14.6881 -57.9009   HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
RT -0.563154 0.824263 -0.05872 -0.815826 -0.543269 0.198211 0.131477 0.159528 0.978399 -3.33502 38.1152 -29.2915   HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
RT 0.105091 0.992977 0.0543461 0.990036 -0.0993161 -0.0998267 -0.0937281 0.0642954 -0.99352 5.81259 3.68965 -2.2293   HKH_2021_1WEJ_run_1_complex.86_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_1_complex.86_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_1_complex.86_chain_B_0_0000100001_0000001_0
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LKY1oB9sxWAcdODfv26ioBNFot9bHlErvMCPrBdiX65LrfZYv64DsBh8Kp8TLk30vBGQmBxjft6b9hjvPqjvlBtz2U+TGYRmP6ahjBhoIm/TsgD4PRXIiBtWPO+jiQn9PcDPjBZ6FAB0Zew2PMxonBtaJ2AsrQfwPM8DoBpaKG9r9tL7vYbakB159c9rIJumP5nmmB9WnG8LJLN8PzEknBVGJd/j2myrPa4LlBN5re+zw330v HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
LeJpsBlPSu8bfG73PykPvBJ1Jy2bFYU6PhNSxBdl2/6rcXqjPKspyBVlTL8TmQGpvB+WwBVHrg87PdZCQSi9uB18It4LG3NHQg1XwBBUAq7bBeLKQ/1lwBRMew/7TJzKQkUxuBtWqoAMyeJMQmMisBt8uIAs5/ENQz1QvBRK96BMA0iMQpB1rBZp7x+byY88P7I/uBdmN99jOMA7PR6RwBB7Xa/72+WCQY/ayBpL5j6rZGzCQQZyuBtRLk9zdM2GQauAtBV1Ng8LsyZHQGjYyBdP9U1LzAGKQuISvBJxPXzjdkxLQBfQyB1XAWAM20LKQRCDsBFHFT+byg5MQ0ILrB9govAsGzAOQgR+wBtIoKCMuZ3LQEK7tB1JgPCsoqjNQ HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
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Lncl3BVTgv+ToAeJwdTZ4Bt/lX+D57PMwDn13BxzLbAUMo6NwWog5BVW60AkwzjPwFD72Bheorxz0BcNwzzP2B95t48TMFnIw4di6Bhiw99zOgSMwBLj3B9JcT4LmifPwRiY3B5/ja9bQIRMwTLx0BpBkR5j7nYNw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
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L46l3BVGWyCE9t1LwjMe5BR5YTDkk3KLwDDP8BRx5HD0XVOMwPfs9BNynjDk6SKNwBEh5Bh+PaD0h9IIwdk62BFe+sDkSbvFwNFN3BZqSsDk+RZ/v7hZ2B1XPNEUzUxHw5zp2BdhHhCUFKXKwtt24BR+jwDEMxIMwxu65BZZb7CEyGYGw1ZI7BJcGwDkTlVHwGxN1BVtvYDk77xGwpQY1BRFq4D0W8v7v0Fi3BBCcLDkRNu8vz044BtFCAEE+QB9vzxl0BhXZTE0lA7FweRF4BhFcXE0jzuGwKtI2BVmTNEUcVBKw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
LtlA9BFUKfCEUeMMws5q/BZ3jUCUSCMNwQ29/B5RkiCk3/CQw5/ABCF/H0CEXNcQwvGJAC5VLKBEEb2MwHDlBC5K1yAkDhlNwc+3BCZyGs+zLr/MwT4UDCZ8y/9z/LoNwWloDCx38S777y9Mw/m07BVqIICkCOXLwBnkACdXUmC0VGEMw8r6/B5QO3AkXRyKwea7+BBiFlAUA1GOwBvvBCxII/AUDTtPwgsQCCtOEbBUtubMwc7rBChNrS+jXA4Kwp6NBCRcq18jehLOw/ahDCdQpV+D7bvPwvb+DC9epS/zUkcMwqWmECp+md87QlWNw/WcDC12AN87JS9Kw78CDCxsjD+7lCCOw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
LkS69BpHGcCEmS3Qw5KJ+BpmfrCE4wOSwVxw9B1hWcD0sHTSw65X/BdtfzD0mK4SwXSF8BNfTVCkKCITwmHK8BRhsiCE41mUwRwJ6BJXuICERsaVw+J05BVG4YCU6T3WwAAS8BRW/TCkVNtXw/1Q8BlfaLC0+CiQwViEACx8DkC06KmSwNbY8B1FplB0n0ETwF0E6BdszbCUBPvSwoLr7B9WsEDkf3sUwo0K+BdttdC0T//Uwmpv6BFJROB0fnbVw2tP4BxjVLCUHe7Uwg3M4B5GzGCEU2UXwQ8Q5B9fp6CUv21Ww5n57BR8+eC0XRUYwkO29BRkolCEzSUXwoX08BdkJqB0kawXw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
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L07Y+BRu/VEUExKQwcyJAC5LIkEElqCPw+MkBC9BOiEEr2GQwcvhCC14ZrEUpuJPwUfLAC9+RgEU9e+Lw4jmAC5kMLEUHOWLw82m9B1tUkEkmSvKwwrF+BdjTHEU90hPwnho/BNei0EUKkXPwIu4ACJh3qE0ZVHLwp4DACRz/AE0FEUMw8Pu9Bp8xhEE/7lIwUhB9Bxmt0EEggJLwHYJ8BtGbZEUw8lLw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
L2MvBCN0tUE0juIRwQjCDCBGTSEUEEyRw2lBDC98dYEkdvQTwYb8DC1WuSEEuOAUw7DmDCFf13DEKQmRwC9EECZRkvDERzMQw+fHFCx+dAE09OmPw+IYDC5JzVD0g/6OwTD8AChBnMEUYYiRwICvDCtqRdEk/JTRwBzzCCViqgDUgd1RwDkaEC1XcyDUmkSSwagqDCtTLPDkkRENw2zhCCFcyIDUhRqPw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
L71/BCFGHkE0KRsTwxX5BCZ5yqEkVpFVwHgpBCppxCFkwbNVwKeVCC1bkPF0iqkUwy3zACVViJFUpWAWwbgzACxoIeEkFN1VwnDGBC55BGEExd9Vwd6DAC9QIzDEZoxWwa0O+BR3/CEUKUQXw8yOACBymMDEZZ6Ww/URBClVVoEU+NCTwcF2CCFGXnEUTElVwOot/Bxd2fEk8KTVwc/qACRFokE0bT1WwuvECC9ODEEkG1aWwHRJBC9dX+Dk6j9Uw HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
LBCoVBNrx+F0LOX5vBCoZBNrx+F0LOX5vBCoVBl1YHG0LOX5v HKH_2021_1WEJ_run_1_complex.86_chain_B_0_0000100001_0000001_0
SCORE:  -1754.835  -3164.134    313.602   2107.248               -161.574                 48.662                108.780   1130.832      -1195.343            -5.663                 -37.251  -1153.351         -161.151       -118.910       -268.680       -152.972     -71.510       -3.808                   25.911      9.258        36.058       239.593        413.597   -145.653     187.912   -114.818       0.000         61.318        317.212   5282.000 HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
RES_NUM A:1-437 B:438-542 HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_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_1_complex.846_chain_B_14_0000200002_0000001_0
RT 0.789645 0.331186 -0.516505 -0.299719 -0.526331 -0.795703 -0.535378 0.783129 -0.316352 -16.1272 41.9075 -51.3216   HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
RT -0.238 -0.589515 -0.771899 -0.413921 -0.657392 0.629687 -0.87865 0.469371 -0.0875535 7.2971 34.5673 -27.5103   HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
RT -0.652435 -0.189983 -0.733645 0.538905 0.564332 -0.625389 0.532833 -0.80339 -0.265807 4.42291 0.957958 -3.0214   HKH_2021_1WEJ_run_1_complex.846_chain_B_14_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.846_chain_B_14_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.846_chain_B_14_0000200002_0000001_0
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LV/tNB5yM0HEF2oKQRc6SB5zdyHErQdJQuXUWB51G8HE7zGKQt3UUBBIkCIUz1PKQlRiSBNG1wH0FW6EQgPtQBB0E6HUchSCQgQbMBJez7HEaGyKQqusUBVDfrHEzfXKQfcfWBZenuH0eeXDQPl2PBdfLqH0o4EEQY4wQBtGW4HkcHG9P HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
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Lr/BCCdnWvD8HFoFwfswCCFe/IEsuHIIwN4qDCpSwAEcQNWKwT5MEC5pDeD8TXMKw0m6DCJJRMEMX7RMw9MzBCpRCaEsipPJwT1/ACFaQmEc+wOGwLLHACFYC4EclNQIwR9FACN8+6EMJPpKwVp5+BNCsCFskCZFwPagBC1RLaD89t3HwQLZDCNowQEcuKSFwsJFBCN+VSEMvDlKwr6WCCpZslE8FnaKw7dsBC9WKtEcxiXDwJuXAChm6aEsiPFEw HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
Lw2uSBpXptF0cm0Aww2uWBpXptF0cm0Aww2uSBpXp9F0cm0Aw HKH_2021_1WEJ_run_1_complex.846_chain_B_14_0000200002_0000001_0
SCORE:  -1786.766  -3138.897    307.580   2078.731               -160.516                 47.447                106.596   1119.665      -1186.677            -5.721                 -36.949  -1147.299         -162.503       -121.890       -265.947       -154.120     -79.208       -4.350                   21.767      7.104        34.680       238.680        418.177   -141.012     190.041   -114.818       0.000         59.723        302.950  13992.000 HKH_2021_1WEJ_run_1_complex.403_chain_B_2_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.403_chain_B_2_0000200002_0000001_0
FOLD_TREE  EDGE 542 253 3  EDGE 253 215 -1  EDGE 253 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_1_complex.403_chain_B_2_0000200002_0000001_0
RT 0.804166 0.269703 -0.529696 -0.352349 -0.501402 -0.790219 -0.478715 0.822105 -0.308181 -21.2483 42.119 -48.9401   HKH_2021_1WEJ_run_1_complex.403_chain_B_2_0000200002_0000001_0
RT 0.177514 0.749537 -0.637717 -0.225547 -0.599773 -0.767724 -0.957923 0.280117 0.0625881 15.4666 23.6124 24.7693   HKH_2021_1WEJ_run_1_complex.403_chain_B_2_0000200002_0000001_0
RT -0.310681 0.396715 -0.863768 0.757668 0.652083 0.026972 0.573948 -0.64607 -0.503168 4.18965 -2.4751 -0.448015   HKH_2021_1WEJ_run_1_complex.403_chain_B_2_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.403_chain_B_2_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.403_chain_B_2_0000200002_0000001_0
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L8CUMBtuXCG0lOENQ8CUQBtuXCG0lOENQ8CUMBtuXKG0lOENQ HKH_2021_1WEJ_run_1_complex.403_chain_B_2_0000200002_0000001_0
SCORE:  -1771.915  -3100.824    304.846   2051.319               -159.299                 46.859                104.434   1098.924      -1170.755            -5.529                 -36.552  -1133.577         -160.142       -120.364       -265.275       -148.845     -71.584       -3.760                   23.060      5.760        34.352       238.226        411.976   -142.151     187.267   -114.818       0.000         57.363        297.173  16175.000 HKH_2021_1WEJ_run_1_complex.1024_chain_B_2_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.1024_chain_B_2_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_2_0000100001_0000001_0
RT 0.76129 0.430661 -0.484736 -0.305243 -0.421529 -0.853897 -0.572071 0.798025 -0.189449 -21.0916 40.6695 -50.7758   HKH_2021_1WEJ_run_1_complex.1024_chain_B_2_0000100001_0000001_0
RT 0.0988208 0.913094 -0.395592 -0.175292 0.407295 0.896317 0.979544 -0.0192307 0.200307 2.7277 16.0723 9.25922   HKH_2021_1WEJ_run_1_complex.1024_chain_B_2_0000100001_0000001_0
RT -0.556664 -0.685836 -0.46878 -0.06567 -0.526199 0.847822 -0.828138 0.502737 0.247877 4.53681 1.99587 -1.42922   HKH_2021_1WEJ_run_1_complex.1024_chain_B_2_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_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.1024_chain_B_2_0000100001_0000001_0
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L1rvQBJenNG0kiONQ1rvUBJenNG0kiONQ1rvQBJenVG0kiONQ HKH_2021_1WEJ_run_1_complex.1024_chain_B_2_0000100001_0000001_0
SCORE:  -1767.480  -3124.700    314.642   2072.735               -161.919                 48.249                108.409   1115.368      -1181.663            -6.000                 -39.988  -1152.045         -165.665       -122.713       -266.992       -159.575     -74.926       -3.770                   24.579      6.103        35.203       239.247        419.508   -140.978     188.694   -114.818       0.000         66.631        308.905  12348.000 HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
FOLD_TREE  EDGE 542 253 3  EDGE 253 215 -1  EDGE 253 437 -1  EDGE 215 214 1  EDGE 214 1 -1  EDGE 1 438 2  EDGE 438 541 -1  HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
RT 0.744766 0.426505 -0.513242 -0.306605 -0.464419 -0.830848 -0.59272 0.77615 -0.215114 -21.4364 40.3921 -50.8659   HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
RT -0.309656 0.911031 -0.27228 0.201833 0.342806 0.917468 0.929181 0.229144 -0.290028 19.914 7.45831 19.2846   HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
RT -0.314329 0.385672 -0.867442 0.768112 0.640284 0.00633989 0.557854 -0.6643 -0.497499 2.40779 -2.87883 0.108858   HKH_2021_1WEJ_run_2_complex.1941_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]DVEKGKKIFVQKCAQCH[HIS_D]TVEKGGKHKTGPNLH[HIS_D]GLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.1941_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_2_complex.1941_chain_B_3_0000100001_0000001_0
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Lvu2EAnjOdE0oJQjQdF2ZArb0mEEAcMjQu0qZAfRe+EkJMSjQtsThA/vvLFkjeGjQEDTlAH1XbE0elZjQUvVDArJfQE0/XajQwppdAXxSlEEZh7iQJWJtATKUiEEkoWjQ9YTlAHQ0KEE68UjQlEWjA7V1cE0nlqjQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
LELxOAH0DEFUBujjQib1MA7EXaFk1qpjQHOGCAzwFnFkHsYjQxyKKAX363F04fSjQkO7AATLedFkub+jQQfO0/+6W0FkHTCkQJWhIADEuBGkTRJkQWxCn+SAJ6Fkps+jQz0xBAnrHMGkZwMkQ0C4194rYHGE4BCkQ+VLS/i+4OGUoIJkQtGyu+SwNZGkPuMkQyYVIAfHZ4EEUUtjQRXycAHn2gFEpdrjQ3IvLATmLZFkIKLkQsQ7l/2LITF0qL/jQmnFZADCB/FUyKMkQ5bT0+QaOuFEvJ5jQbFINA/OGSGElZSkQCeak/ICmJGUvF/jQsQOD/8N+ZG0XOIkQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
L/STf/ybXfF0zIRjQfn4g+q7CrF0XKBjQLRnh/SxXsFE2asiQyUyh/+Y28F0n0hiQh/Hj/AnTgFkHR9iQGk6BABAAhFE9EQjQpUKVAd7BTF0LUKjQ4nrIA9tB4FE+iUjQRTYH/qOURFUlLXjQAX8196JK7FER4GjQTwja/c5fPFECa5iQQHDy/EQ7nFUqoviQhiZ1/MEWaF0naejQA+SgAFbKTF03gXjQwJ0PAtLoCF0HfHjQGS0cABELZFULA8iQf1HUA9rH4F08ghjQO56PA9+z+FUoTGjQblM2/UCzAGUHGZjQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
LW//4/WUqbFkXWmiQY4QIAvnIdF0aOSiQUdGYAvHtvFke7SiQ3WcaA3Lr7F0RYDiQaRLTAvcCIFEn5MiQVrYdAbwjHFU4z2hQEF+iAzmgxEEq0xhQQlbnATJLwEUtObhQVBXrAfKUaEUWWWhQ+He4/2/sNFUr4uiQRka6/SAwgFkJdFiQj1jHAPHE7E026NiQbfifAP60EFEP0YiQB1MlADXLTFEYE2hQEtXRAPe5LFE+4qhQa1+YA/30lEE6bzhQryPpAnMatEkzL9hQRT9tAn8h7EUlUZhQneEhAPdK0EUy+PhQLTGuAr+iZEE6PHhQI8DlADSxPEE5RYhQk2OxArzSWEUljghQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
LQEbhA/XwyFkCDliQiLkoAPEhCGkRnmiQnXTiAfF/MGED5piQRkjjAD0rUGUq9diQOddwAbKwAGkfA5iQjRb4APl5JG03H9iQRxOABPfkGGEgQOjQiekDBnI/PG0JIXjQ0WGHBHAQVGUFzGjQRtrgAXA3nFkgTxiQvUBtA/PMDGEasXiQOhD1AvvBzFUW61iQpz8rAP9v+Fk6xHjQ9qI0AXPCRG0uiCjQunm8A743LGE6TuiQTg8CBbFmAGkPpHjQxrH8Ars9CG0mQbjQxBFGBHn5MG0O8jjQQs3ABPHAWGEGtdjQz+JJBzzMbGUo4NjQ/z2EBzFkYG0Jl6iQ1DrJBjQ6PGksoAjQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
LCbMWAPKENG0xc5iQRFMKAvLhWGk12/iQimt4/qoUbGERUuiQUMy1/SEFlG0xWsiQyA73/2dtTGk2iSjQhJPUAn7TGGE1LCjQruwVAPIjcG0Z0EjQ8azn/mswaG0ExXjQoCwFAPUkQGEoYfjQKY2g/yUxNGkvvNjQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
L9com/uqqUGULigiQrdLl+KpcYGEkKQiQj8+g/K0McGkUR8hQNgH2+6yqeG03yrhQy/KT/UbEQG0JvKiQfeNd+0dbGGkAiCiQmi00/YTlNG0KheiQ5nzq/29qMGESOiiQNfnb+Y1WfGUjnWiQBzpt/44UTGEEm+hQ90L1+OosDG0HjMiQ5gvGA143HGkDQaiQsotBA1z8UGUjGkiQ0F9g/45PKG0sEriQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
Lq8yFAPB1bGU188hQbKySAnr6fG0vqrhQzSSgAP4XpGEgOzhQ3kxnAviisG0uAohQfF9fAvCDXGEWnhhQo3XSA7NlPGEF7ThQK2tLAn22SGEtZChQyIGOALW7FGEq5ahQ9KkNAr/KZGUTZKiQlFMIAnIDjGkMUfhQDsvjArgWSGEzXuhQQcUmAftcaG001XhQHrQFA/LBBGUW+RhQ7wcTAfZVDGUUYphQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
LD0abAHoAuGkZBGiQGa4jAL2C3GkQdOiQL7eZAT2RAHEEIWiQAP3FAr9k/G0rGViQC/ygA7PIJHk63YiQm3NrAjqVzGkQ1giQYAB0APSWrGkRJaiQeSf7Abg9nGEjNsiQjpK6Aj2trG0U69iQRNSBBL1fhGUcGoiQZc8OAfsJrG0oDPiQlD9oAPOG6GUvqBiQ1oWmAjabvGEFGtiQ37CvAbiP6Gk3KoiQjFu4ATi7uG0kWNiQBjMwArGPkGkFtTiQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
LHBNFBVOlFGkH4DOQHBNJBVOlFGkH4DOQHBNFBVOlNGkH4DOQ HKH_2021_1WEJ_run_2_complex.1941_chain_B_3_0000100001_0000001_0
SCORE:  -1770.074  -3111.020    309.275   2058.496               -160.241                 47.378                105.805   1112.287      -1175.147            -6.115                 -40.539  -1145.301         -160.871       -120.782       -263.641       -156.768     -74.452       -3.647                   24.469      5.349        35.893       232.817        417.545   -141.355     189.479   -114.818       0.000         61.951        303.880  14187.000 HKH_2021_1WEJ_run_1_complex.995_chain_B_3_0000200002_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.995_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.995_chain_B_3_0000200002_0000001_0
RT 0.761735 0.396685 -0.512251 -0.271052 -0.523009 -0.808079 -0.588465 0.754389 -0.290872 -20.0392 44.9067 -47.4925   HKH_2021_1WEJ_run_1_complex.995_chain_B_3_0000200002_0000001_0
RT -0.342673 0.9143 0.215941 0.530827 -0.00120926 0.847479 0.775111 0.405036 -0.484921 10.8388 3.7796 25.0431   HKH_2021_1WEJ_run_1_complex.995_chain_B_3_0000200002_0000001_0
RT -0.529617 -0.688351 -0.49566 -0.0717205 -0.545909 0.834769 -0.845199 0.477657 0.239754 1.88054 2.42133 -0.823485   HKH_2021_1WEJ_run_1_complex.995_chain_B_3_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_1_complex.995_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.995_chain_B_3_0000200002_0000001_0
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L4adGBpfyKGEoWXOQ4adKBpfyKGEoWXOQ4adGBpfySGEoWXOQ HKH_2021_1WEJ_run_1_complex.995_chain_B_3_0000200002_0000001_0
SCORE:  -1730.580  -3170.240    324.220   2119.063               -161.530                 48.142                109.847   1130.095      -1200.279            -5.595                 -36.075  -1159.133         -169.701       -120.643       -262.464       -162.838     -79.801       -3.946                   39.314      8.230        38.106       244.382        418.091   -139.918     189.872   -114.818       0.000         64.518        322.519   8773.000 HKH_2021_1WEJ_run_2_complex.396_chain_B_15_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.396_chain_B_15_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.396_chain_B_15_0000100001_0000001_0
RT 0.890076 0.0861298 -0.4476 -0.292018 -0.646247 -0.705046 -0.349986 0.758252 -0.550058 -19.5034 44.6016 -47.6849   HKH_2021_1WEJ_run_2_complex.396_chain_B_15_0000100001_0000001_0
RT 0.526445 0.292411 0.798343 0.713272 -0.662926 -0.227536 0.462708 0.689221 -0.557562 -21.0803 -14.4114 -14.3127   HKH_2021_1WEJ_run_2_complex.396_chain_B_15_0000100001_0000001_0
RT -0.386824 0.869609 0.306834 0.922058 0.359963 0.142249 0.0132517 0.337944 -0.941073 -3.54413 -2.96533 -3.01914   HKH_2021_1WEJ_run_2_complex.396_chain_B_15_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]TVEKGGKHKTGPNLH[HIS_D]GLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE[GLU:CtermProteinFull]X HKH_2021_1WEJ_run_2_complex.396_chain_B_15_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.396_chain_B_15_0000100001_0000001_0
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L2+p2AZgkeG0rbq6v2+p+AZgkeG0rbq6v2+p2AZgkmG0rbq6v HKH_2021_1WEJ_run_2_complex.396_chain_B_15_0000100001_0000001_0
SCORE:  -1768.816  -3124.937    315.941   2062.055               -161.703                 47.602                108.222   1106.222      -1179.765            -6.110                 -40.202  -1131.078         -164.120       -116.955       -262.349       -154.859     -70.308       -4.049                   26.740      6.375        35.448       236.627        410.895   -142.900     188.248   -114.818       0.000         54.482        306.477  18132.000 HKH_2021_1WEJ_run_1_complex.341_chain_B_5_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.341_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.341_chain_B_5_0000100001_0000001_0
RT 0.814449 0.282197 -0.506988 -0.347824 -0.46192 -0.815873 -0.464425 0.84083 -0.278056 -22.3162 38.1321 -51.8378   HKH_2021_1WEJ_run_1_complex.341_chain_B_5_0000100001_0000001_0
RT 0.090891 -0.606096 -0.790181 -0.256533 -0.780938 0.569498 -0.962252 0.150945 -0.226464 -2.23912 2.31502 28.8241   HKH_2021_1WEJ_run_1_complex.341_chain_B_5_0000100001_0000001_0
RT -0.521297 -0.703841 -0.482553 -0.0685808 -0.529082 0.845795 -0.850615 0.474004 0.227539 2.54216 1.7939 -1.23795   HKH_2021_1WEJ_run_1_complex.341_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.341_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.341_chain_B_5_0000100001_0000001_0
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SCORE:  -1762.398  -3163.528    317.538   2095.990               -160.389                 46.811                106.534   1123.227      -1191.927            -5.656                 -37.804  -1156.905         -163.692       -119.996       -262.370       -152.929     -74.870       -3.249                   34.632      8.735        35.689       239.598        419.483   -143.336     186.995   -114.818       0.000         59.860        313.979  20249.000 HKH_2021_1WEJ_run_2_complex.318_chain_B_6_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_2_complex.318_chain_B_6_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.318_chain_B_6_0000100001_0000001_0
RT 0.801213 0.0416636 -0.596927 -0.539881 -0.379859 -0.751156 -0.258044 0.924106 -0.281854 -32.7526 12.9812 -57.7582   HKH_2021_1WEJ_run_2_complex.318_chain_B_6_0000100001_0000001_0
RT 0.510796 0.776287 -0.369414 -0.85172 0.515369 -0.0946945 0.116874 0.363007 0.924428 0.492956 41.8531 -35.4443   HKH_2021_1WEJ_run_2_complex.318_chain_B_6_0000100001_0000001_0
RT -0.605612 -0.273932 -0.747125 0.517455 0.577711 -0.631261 0.604545 -0.768903 -0.208121 5.52357 0.887281 -2.90803   HKH_2021_1WEJ_run_2_complex.318_chain_B_6_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.318_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_2_complex.318_chain_B_6_0000100001_0000001_0
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LCW9SB5+BsFkcW2AwCW9WB5+BsFkcW2AwCW9SB5+B8FkcW2Aw HKH_2021_1WEJ_run_2_complex.318_chain_B_6_0000100001_0000001_0
SCORE:  -1753.565  -3126.294    318.360   2064.618               -160.304                 48.965                106.072   1112.446      -1179.138            -5.585                 -37.690  -1139.100         -169.820       -117.727       -263.325       -160.628     -77.864       -3.512                   25.278      5.501        34.713       245.482        420.970   -142.148     188.136   -114.818       0.000         59.094        314.756  15128.000 HKH_2021_1WEJ_run_1_complex.434_chain_B_8_0000100001_0000001_0
RES_NUM A:1-437 B:438-541 z:1 HKH_2021_1WEJ_run_1_complex.434_chain_B_8_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.434_chain_B_8_0000100001_0000001_0
RT 0.876517 0.0693351 -0.476351 -0.296163 -0.702437 -0.647201 -0.379481 0.70836 -0.595164 -17.8064 44.7623 -47.6545   HKH_2021_1WEJ_run_1_complex.434_chain_B_8_0000100001_0000001_0
RT 0.157839 -0.551005 0.819439 0.748347 0.608162 0.264793 -0.644254 0.571431 0.508335 -13.6241 14.5824 22.6139   HKH_2021_1WEJ_run_1_complex.434_chain_B_8_0000100001_0000001_0
RT -0.544896 -0.676564 -0.495327 -0.0491826 -0.563922 0.824362 -0.83706 0.473553 0.274004 2.50463 2.11867 -0.845689   HKH_2021_1WEJ_run_1_complex.434_chain_B_8_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.434_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.434_chain_B_8_0000100001_0000001_0
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