SEQUENCE: DKCKEREEKIILVSSANEIDVRPCPLNPNEHKGTITWYKDDSKTPVSTEQASRIHQHKEKLWFVPAKVEDSGHYYCVVRNSSYCLRIKISAKFVENEPNLCYNAQAIFKQKLPVAGDGGLVCPYMEFFKNENNELPKLQWYKDCKPLLLDNIHFSGVKDRLIVMNVAEKHRGNYTCHASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLICNVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKHPFTCFAKNTHGIDAAYIQLIYPVSSKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPHALFLGIHGGKMCLSCVKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAACPGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQEDX
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:  -1466.773  -2618.181    277.012   1690.597               -152.825                 49.485                111.279    878.955       -963.149            -6.085                 -38.305   -918.672         -152.256        -79.399       -238.645       -107.044     -68.338       -6.530                   26.007      5.432        32.261       221.566        418.770   -112.814      75.662   -101.507       0.000         48.768        261.181  54816.000 HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
FOLD_TREE  EDGE 457 196 2  EDGE 196 1 -1  EDGE 196 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
RT 0.507829 0.728375 0.459978 -0.117888 -0.470171 0.874667 0.853354 -0.498407 -0.1529 -21.8756 -26.4148 1.23642   HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
RT -0.67419 -0.585575 -0.450077 0.681727 -0.72783 -0.0742421 -0.284105 -0.356883 0.889898 -6.5175 -8.04594 -12.3972   HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
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Lm8iXCxq4XF00krhQa1CXCNhANFEQmYhQ2MjVCtVLJFUo+ZhQ/PEVCR/t+E03EphQvEwXCRTn3EU6cVhQfJOZCBZN5EUXKQhQzy0ZCltDjE0vqMhQ9KUbCVVYkEUhYHhQDq6bCFMyOEkLFEhQn38XC1USPFEEi3hQBfOXCxQJXFUxpKhQYvpXCVeHuEk+9jhQI7QXCt54uE04gIhQBuVZCZDrCF0bnBhQApvZClGTBFkNJdhQSEsZCp5aZE0mDbhQOkTZC56MbEk0b/gQPhcbC1LxtEkd24gQ8c1bC1sUsE0jfUhQOj5cCBWWQE0RnAhQx+zbCFx9FEUOiRhQfscbC1GXHE0M03gQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
Lmj1UC5DRRFUezJhQH7YTC5waPFUovIhQti3SCV1UHFEmvzgQdHdTC9kaKFEZyigQuOtSCpEFlF00MMhQTy/SCBkjuF0lpghQSY/TCNnf9FU5eihQT7TSCdhZoFEoeyhQlkSUCVQGDG0sy1hQ4znSC1O+wFU4xFiQv8mTCFL6/FElcHiQmqUVCFC+ZFUwP+gQElETCN2UEFUL+UhQBSBTCtHJwFUXr/gQx/nRCd2DjFki0KhQNkjUCRiJBGExRUhQZWhRCd2fcFk4DxhQVnFVCp09IG0W82hQKfFSCpG6rFUI5TiQNh2TCdVTDG0/uWiQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
LpJuRC5mf9EUmj0gQ5fCRCNWE4EEWGhgQE4EQCtFUKFEQqdgQuWgPCRMkSFUJHtgQlMVQCNKWjEkwajgQo+NRCpPjQEEJClgQkDsRCZMBKE0dv4gQPuiRCx9TFEkJ0SgQWAfSCd4kwDEJ75gQNfVSCJRNnDkSKUgQXxzSChVLaD0songQhWmTC5JW2CU+IpgQyyRRCZKW6EkQ9ChQbPvRChsY3Ek6uTgQI5vPCJrQkE05yxgQdvqPC5BNhE08+VgQ7+aRCNU2SEE+PHhQxbKRCBreKE0cTDgQMf2SCBrwlD0I/IhQvYlSChLaVDUK1FgQwQqTChYuoCEBZbgQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
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LPZFNCJIRWFk0bifQEaWMCxLOPFkZR8eQjbKLCVYCdFEPkveQywNKCVjefFUwBIfQdB2LCZ3V4E0rDDfQdNFLCVfMvE0+RdeQCznKCZTvYEU9skeQJ+7JCJqpTEUGTEfQ/s/KC5ejKEkNcHeQwlrMCNuJUFkFLAgQO9CNCR0LPFk1eheQ9GsMC1T1tEUVlJfQKtMLC99z3E06tefQrDMKCxS24EU8ZXeQaUuLCJiZvEkUIBeQKUuKCFnX2D0mIKeQi2iLCJTKPE0mRudQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
LLZLLCxDXlFkXeIeQO2EKCNX7yFEED6dQYvzICFdulFEBj0dQ212ICFMkUF0hAhdQp/aKCJZx9FkClPdQnlaJChqMHG0xVBdQXX1JCl+GNGEzYacQxi8KCdpoLGUmdMcQQICJCF0BTG0GwJcQNK+LCt/xiFkcE1dQoo4JCV3O/F0/7ReQ20YLCNDgCGkABRdQyhdKCF5qxF0Vm2cQlfdICZySDGE/y6cQUwQJChl2MG0clbdQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
LY2rHCNQPuFEmLEeQ+2XGCFQGkFEjx/dQBQ8FCh2NiF05CRdQ6sRFCRppSFUPjFdQL71FC578yFUZj8cQEgSFCtcbwFExZYeQ9+UFCteCuFUAlJfQb+CGCB2pgFkdEafQe3kEC1Ym5FEYsefQT7wHC5ob8FUCXUeQSDcGCNt/TF00DNeQ4BZFCN/tAG0T+QeQFyTEC19ZrFEDDNeQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
LOnAKC9/hjG0GsNkQOnALC9/hjG0GsNkQOnAKC9/hrG0GsNkQ HKH_2021_1IRA_run_1_complex.790_chain_B_4_0000100001_0000001_0
SCORE:  -1484.362  -2598.742    272.531   1663.652               -151.973                 48.034                108.242    869.226       -954.919            -6.108                 -38.775   -913.687         -156.035        -79.036       -237.731       -109.057     -64.310       -6.444                   24.107      5.749        33.192       219.919        416.900   -112.866      73.612   -101.507       0.000         50.423        261.243   8494.000 HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
RT -0.469042 -0.853333 0.227645 -0.797954 0.298993 -0.523329 0.37851 -0.427113 -0.821161 -12.6515 -35.9411 -2.26387   HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
RT -0.178294 -0.790616 0.58578 0.96411 -0.259391 -0.0566489 0.196734 0.554656 0.808488 -6.25557 -3.34584 -13.613   HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QHKEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.834_chain_B_20_0000100001_0000001_0
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SCORE:  -1476.901  -2600.653    276.041   1671.650               -151.540                 48.153                106.460    886.805       -959.122            -5.829                 -37.160   -922.517         -146.798        -81.912       -240.268       -113.145     -72.014       -6.329                   26.030      4.966        28.541       221.077        422.717   -116.463      75.756   -101.507       0.000         46.276        263.887    270.000 HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
FOLD_TREE  EDGE 457 160 2  EDGE 160 1 -1  EDGE 160 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
RT 0.718298 0.33121 -0.61184 -0.691167 0.239085 -0.682002 -0.0796035 0.912764 0.400656 19.0167 -4.20395 -72.1758   HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
RT -0.776102 -0.309615 0.549368 0.562111 0.0552054 0.825217 -0.285828 0.949258 0.131193 1.41442 -4.63298 -1.78986   HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
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LrtL2B5WTsEcuKioQ0kJ3Bpuv+EsiSooQjdK6B5vFCFcj0noQkkQ7BR74OFMw5toQhU31BxDlTFcDQkoQ/Gk2BZPmWF85LZoQEy2yBxazSFskdloQR7B2B1EvtEcsHaoQiim2Bdcd8Ec1pwoQ/ep2BxI/gFco5ooQzaT2B94ZlF8LVXoQ+3/xBpDmhFMxqioQKNZyB5R0QFstytoQHPCyBZEgFF8l4goQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
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Leh5ACdvH1E8PHtoQrMsBCJTSpEMd20oQtZMDCtn8rE8d4zoQGEuDCxUS8EMTNwoQp+UBCJfzvEc+WApQtr0/BBqurEM7kDpQbk79BlHW7Es5OCpQVQC/BFpbYE8f9HpQ2ZV7BFTF4Es2FFpQAsZ8BJiKVEcQzKpQ+mj6BNLClEs8YJpQ4WEBCNyHFFsUJsoQkdeBCRPiYEcgvzoQX9hBC5f0AFcqXBpQiy+BCNoOnEc56FpQt5g+Bl4qKFshs+oQYcQACtq1LEcbKJpQF/55BF+2EFc7yDpQkox7BdqFGEMIJOpQMVf4BpveiE8MoLpQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
LJC5DCdtkbEM6g3oQMvUFC5bNcEcf44oQUkhFCB1EmEctyDpQ6o4EC1DJfEsHgLpQYy6FClb8FEsP44oQInYHChGvFE8iu6oQGKQICNYoHEMfQyoQwg3HC906DEs+FFpQ6zmJCtPYHEM1E0oQaINJCxKvDE8R6GpQ5YFKCNsWFE8lc+oQWYcLCht9EEspOApQTOZDCBfROEcSG6oQ2PyFClEVmEM1zyoQ3ktFCliF8D8PRxoQ6ncFCBOB5DMLJ/oQfe3HCB8JJEsBIqoQrGLHC9CfCEMl0LpQ1LTKCRDuIE8eYtoQZwkJC1fHCE8jCPpQn+5LCRJ2GEcvj5oQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
LwbZGCxG71EMtwEpQL+kGCNaY/EcCSPpQPBBIClmGHFMggQpQ0gYIClZHYFMfbMpQkvkFClfsRFM0SQpQxcUFC1VyZF8aEbpQLUlECBZZNF8s4hpQpivFCReZtF8DYepQO0QEChcPUFsE3rpQlIbFChRn0FcIfopQTDrEClXxnFM9NvpQqk6GCJuT7EsyW+oQTbYGCxFWzEsxYVpQprnECpraMF8YBNpQkW6FCh9BfFswZLpQ35PECBpz9EcjEfpQ8wUGCpQN3F8T8YpQPNrDCd3JKFMlCxpQttwFCx7JCG8eGrpQtAaECdWGtFMNJ3pQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
LG+1IC9mU6EcU7VpQtISKCpBN/Ec+kWpQZ53KCxvAAFcjuhpQpDzKCpTmwEs10npQKnFLC1hQvEsJ5PpQ38nMCRLDxEshoQpQ+ENNC9TiFF8ODMpQZC/MC9XHLFsLuCpQZ89NCdk5QFcctSpQRvcICJvtsEsNVZpQr0bKC158OF8fDTpQQFzKC9FjwEsPhHpQ5S2KCdCXfEsUlSpQyuCNCVyzjEMHFMpQJb8MCZKqvEcG8YpQCbZOCJVheFMAQQpQpKIOCFNgLF8xdapQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
LptfLC1UFSFMrKkpQoJHMCFIFWFMQiupQy6PNClVdGF8ZrwpQjqEOC5+fCFcijppQjbpMC9i9sF80CvpQ4GJNCBXnzFMI85pQ5GkNCxKMFGclU6pQp0bNCRzlKGs1XypQglBOCFOlIGsAlCqQvwgLC1EvdFsBjepQ5TXLCFMNUFcLv0pQcX5LCp3D4FsGkspQlzeNCJMhuFcdgppQtr/NCFcrpF84L8pQtFWMCpf3wFsUw/pQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
LtgSNClY39EM5e6pQnAWOCJlMvEsW+9pQiTvPCxsj3E8ES7pQgqlQC1SGrEMEz3pQHcHQCV68HFsf1/pQZ4ROCdpArE8NHKqQuBJNCJRybEMJDOqQIneMChx1REcltHqQmu+MC5V0ZE8BtXqQVQiMCBAwBFcar/pQ+ANOCVzBgEM605pQL2JOCh/U6EczLOqQL9OPCRpckEMWuMqQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
L2LXECZewYEkdbUnQ2LXFCZewYEkdbUnQ2LXECZewoEkdbUnQ HKH_2021_1IRA_run_2_complex.628_chain_B_4_0000100001_0000001_0
SCORE:  -1429.361  -2683.395    305.009   1739.689               -151.803                 50.077                107.248    919.190       -987.986            -5.805                 -35.661   -963.404         -148.827        -78.680       -239.767       -113.933     -77.855       -6.176                   42.525      6.629        36.557       236.408        421.893   -112.266      74.213   -101.507       0.000         50.074        288.192  22604.000 HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
RT -0.802154 0.225429 0.552929 0.193706 0.97416 -0.116149 -0.564824 0.0139361 -0.825093 -28.7504 -28.5829 -26.5267   HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
RT -0.270715 -0.94316 0.192774 0.944158 -0.299206 -0.137992 0.187828 0.144653 0.971492 -9.09444 -2.6 -12.5946   HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
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LcsECC9A/JFUa9fjQyG7BC1v7RFEre1jQWB8BCVbIqFE0L3jQ5D+CC1wW0FkFE0jQIPFDCFoNJF0nCDkQdZ+CCFy+QF0f7ZkQUDGDCVBSxEEX2BkQ/AADCdj2JF084YjQnp+ACB7AMFkB37jQgKBECt7IPFU+o8jQnpzDCBSiKFEIBjkQaOADCVWdiFUvxakQb1CCCtoPLFEbagkQYD8DCFknrEENJLkQwYKCCBnDrEEVPIkQlYNDC1VFsEEKPxjQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LJNzACdmNzFEPm9jQ1MqACVnMFGkMCAkQEbkACFS8HGkiiXkQ6FhACdUTRGU7mdkQXlv+BlwcJG0Gm1jQg8e8Bh7tEGUSDAkQ+7r+BV8vGGk9PejQU09/Bhx3pFkMy/jQd2hBC50KJG07P5jQYQp+BBsHSGE1d3jQGLO8BFsUIGkZmNkQr838BxOyJGUSMXjQ/nLAChReKG0ezWjQ4Wy+B5HQ8Fk/BcjQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LCSdACZlQ/F0GikkQGyRAC9syAGkTY7kQPCoBC9j0AG02bGlQynbCCNBuyFkLuDlQJ6u+B5p2vF0soDlQhd57Bdk5wFkXZ6kQPjG6Bdk1eFU1oClQMTN3BVRzgFEnv5kQ5qB3Bh+ybFE1MikQMOiACpumwFUV+dkQo6m/BxAgIGErm+kQ7Nl/BNscgFELv/kQq+k+BRzDxF03+UlQazA7BNAIAG08x+kQpxA8BlIFwFkhCpkQ+176B12bPFUh09kQk+B6BlCYfFk1EUlQF751B9q5VFEQdClQj7g2B5CIxFEER8kQ7JE1BxPedFkMzckQ2AM4BlNxlFkFtZkQSin3BpdsMFkHbfkQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
Lq22BCVYSJGUo0SlQ7xHDCpg5KGkksdlQ/2BDClOyNGkvB1lQ2+CCCV+OSGE+w8lQ/N6DCx9CUGkuTTlQ+kMECNWcSGUhp8kQnIaDCtWLXGEPWtkQtUOFC9gCMGUhT2kQ/DqDC16jVG02IYkQ9fdFCNWSKGUwDhkQe3rECVqEPGkyASkQzSIBCtUCPGUh6TlQljrDC1OjDGknkclQZZWDCZRebGkDEVlQZ62ECZAEVGUYxblQtikCCxrOcGkxNykQxD2FCdwUIGkBZClQbRBDChwXZGU/SMkQr3QGC10CFG02IckQyT4EClxrNG0IYBkQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LxTFEC54aLGk5fAmQH7NECl3XPGkR/VmQQlCFCZFcZGUgOTmQgDAGCFZlZGU4wGmQCP4ECFlMHG0vFkmQuVAECJLr7FEkLpmQkf7DCtYdqF0kXbmQ4WTDCZOZ7FEAU8mQZ5JDCBZEZFU6+gmQcQiCC5+7pFE2nBnQq6dCC1P2YFUU+zmQzVuBCJKLHFEyP5mQ0M3ECVjTHGEY45lQ3jPDChxgRGkGjcmQDtwFCt8PEGE93bmQi9MFC1/3KGkU/ymQUVfEC98fqF0YXMmQXTXDCF7dEGkMPHnQ10FDCpicLFkHzWmQFd/BChyopFUhqQnQttwBCh+/8E0ZttmQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LnFqECBF+hGE5EemQxRYFC9Y7rG0VZbmQiNVFCtd3xGUfjwmQVxQECRla1G0fY3mQ1IrEChrAyGUGdJmQm4WFC9xF7GU0//lQBoWGCZGJ5G0FmxlQs6/ECt5WFHEXREmQfk/GCV3PBHkfZnlQgWoFCR/pNH0w/5lQIzoGCF6dLHEaXrlQ0c3DC1+jhG0cGomQT1aGCZ1TqGUmPXmQjXdECBJasGUOk8lQ5ttDCNw00G0YaPmQxVnGC9B4wGEGUulQLHNECpV3GHE3pPmQGjxHCVDi/G0yBclQ/dVFCxM3VH0iY9lQfcJHCBjzRHk5BjlQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LfdeGChRnyGkwV7mQ1wgGCNUZ3GkNzQnQvqlHC193/GkPbTnQW8pIC5+M/G0oyJnQituGCl9nuGkckhnQ1GoFCJYKmG0eminQ605FC1k0dGEJuznQ/bEHCxDDcGULP5nQC62ECJDwYGUy97nQDvUHCNIevG0be0mQNXjFC96P7G0P4TnQ2tqHC9yjqG0ZRenQwX0GCh3SyGEiXxnQOarECZOFqGU1GmnQPikFCtAFiGEJOTnQhX/ECRFMTGEypDoQin7DCNbeaGkW42nQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LYbVHC1kqHH0nKhnQsTTICpHIQHEFllnQn4jJC9RuLH0Y8vnQbfdJC5ymEHkzr9nQDVrHCN2PYHUfC1nQV+eGC9DReHE/VsnQ+BMFClZIYHEfKunQB/NFCRFPPH0O91nQgYLEC1UKcH0/bnnQzgbGCd18HHUc4onQ+qkICZ5CUHU8kWnQv3XHCh9KUHkx0BoQ5ybIClGHeHUuf5nQjBYGCRbplHUYU1nQiDsGCJPXgHU2DcnQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
LLhuKC1OLQHE28pnQrz9LCp3NNHk610nQSIyLC19mNHEdhGoQA0NMCBvVGHENRMoQ14RLCtFpVHEVlKoQ70KNCd5UUH0BKvnQ0i6NCplzRH0QIanQn6pNCFlvJHEkFQnQxZ1OCNyrXHk3CVnQnCvKCdnqVH0dudnQdqNMC5HIFHEJGwnQEQ1MCdZncHUwVunQuR4NCt83TH0YJ8nQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
L1qSHClGwnGEUG7kQ1qSIClGwnGEUG7kQ1qSHClGwvGEUG7kQ HKH_2021_1IRA_run_2_complex.380_chain_B_20_0000100001_0000001_0
SCORE:  -1461.579  -2661.250    284.201   1714.468               -153.678                 49.857                110.153    893.874       -977.340            -5.985                 -37.803   -935.299         -147.258        -78.580       -236.408       -116.348     -69.357       -6.455                   35.621      5.658        35.864       229.073        422.332   -114.249      74.668   -101.507       0.000         49.770        274.399   8543.000 HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
RT -0.549826 -0.835269 -0.00410832 -0.62917 0.410914 0.659769 -0.549396 0.365343 -0.751457 -18.775 -31.8906 -27.2971   HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
RT -0.344764 -0.85171 0.394623 0.931807 -0.36134 0.0342001 0.113465 0.379503 0.918206 -11.3378 -1.78453 -11.5429   HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
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LAEhFCByyhGk47HlQAEhGCByyhGk47HlQAEhFCByypGk47HlQ HKH_2021_1IRA_run_1_complex.622_chain_B_6_0000100001_0000001_0
SCORE:  -1504.121  -2647.330    279.689   1697.674               -151.237                 47.650                106.769    886.240       -972.206            -5.648                 -36.530   -929.925         -154.307        -80.020       -238.143       -119.204     -63.873       -6.360                   21.841      6.850        33.218       224.078        426.805   -115.434      74.849   -101.507       0.000         42.028        269.911   3094.000 HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
RT -0.180619 0.183907 0.966206 -0.940439 -0.319958 -0.114902 0.288014 -0.929411 0.230744 -37.9874 -16.4365 -11.4964   HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
RT -0.170815 -0.728029 0.663925 0.954238 -0.290101 -0.0726052 0.245464 0.62114 0.744266 -11.5096 -3.67097 -9.32174   HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPHALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
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L8rlECNjIyGkOfelQ8rlFCNjIyGkOfelQ8rlECNjI6GkOfelQ HKH_2021_1IRA_run_2_complex.55_chain_B_7_0000200002_0000001_0
SCORE:  -1478.581  -2666.364    290.957   1731.352               -150.846                 48.174                107.365    910.666       -980.726            -5.696                 -35.358   -968.399         -140.723        -82.440       -244.405       -120.582     -70.286       -6.620                   32.094      7.673        33.497       224.411        415.793   -113.902      74.529   -101.507       0.000         52.304        280.459  13878.000 HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
RT 0.11074 0.716132 -0.689124 -0.658968 -0.466148 -0.590311 -0.743975 0.519481 0.420286 -24.8287 -10.4932 -42.8576   HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
RT -0.167719 -0.773088 0.611723 0.981308 -0.19032 0.0285262 0.0943698 0.605073 0.790558 -10.9694 -1.85438 -11.3345   HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEH[HIS_D]KGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.569_chain_B_13_0000200002_0000001_0
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SCORE:  -1517.828  -2627.335    274.473   1686.304               -150.894                 47.659                105.861    896.382       -964.923            -5.870                 -37.067   -946.818         -147.267        -77.977       -239.110       -134.591     -71.771       -6.384                   27.192      6.620        30.648       224.607        418.182   -113.813      73.821   -101.507       0.000         49.002        266.746  12850.000 HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
RT -0.333423 0.389753 0.858441 -0.570094 0.641857 -0.512846 -0.750881 -0.660387 0.00818637 -36.1662 -22.442 -27.2663   HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
RT -0.170819 -0.707953 0.685291 0.953654 -0.293656 -0.0656549 0.24772 0.642315 0.725304 -12.0034 -3.02618 -9.18204   HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
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L5aTECRBqqGkhKglQ5aTFCRBqqGkhKglQ5aTECRBqyGkhKglQ HKH_2021_1IRA_run_2_complex.11_chain_B_3_0000100001_0000001_0
SCORE:  -1477.799  -2642.928    283.790   1694.705               -150.459                 48.073                106.607    886.788       -967.543            -5.728                 -35.738   -930.494         -146.563        -79.560       -240.073       -116.772     -65.237       -6.520                   27.455      5.023        37.362       221.804        419.383   -113.934      75.519   -101.507       0.000         48.807        269.941   9190.000 HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
RT -0.0269112 -0.348099 0.937071 -0.408016 -0.851945 -0.328194 0.912578 -0.391173 -0.119103 -30.7953 -5.07244 -8.38029   HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
RT -0.128424 -0.68912 0.713177 0.955069 -0.279635 -0.0982201 0.267115 0.66852 0.694069 -11.7637 -2.6851 -10.488   HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
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LbJ0DCVdRqG0OTLlQbJ0ECVdRqG0OTLlQbJ0DCVdRyG0OTLlQ HKH_2021_1IRA_run_1_complex.145_chain_B_11_0000100001_0000001_0
SCORE:  -1496.325  -2642.994    279.340   1704.253               -151.991                 48.879                107.821    890.150       -970.404            -5.673                 -34.857   -931.510         -147.504        -80.446       -239.797       -115.665     -78.789       -6.320                   27.715      4.401        35.128       225.457        420.006   -114.937      74.502   -101.507       0.000         41.851        266.567  10675.000 HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
RT 0.315046 0.118908 0.941598 -0.87954 -0.336182 0.336736 0.356589 -0.93426 -0.00132818 -24.5956 -14.5212 -9.20471   HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
RT -0.0141511 -0.735227 0.677673 0.982369 -0.136577 -0.127662 0.186415 0.663918 0.724197 -12.2265 -1.77566 -10.4626   HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
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LDrLECteswFUApJjQsSpDC95/xFke8ziQg1pDC5fqbF0EpqiQb1qECxVxQFk0XsiQtxfECZxRAG0YxliQtd5DCZbSCGkE7PiQqbsEClY3JG0CqCiQRgqFCBDEOG0HZKiQVdWECVcWLG0UPwhQbWCFCtNj4F0sUNjQf8nCCtK53FU3S0iQTHrECtoxHGkZctiQ93dFC9eE5F07QjiQ2f0DClZc1FkRSHiQTx4CC9DbFGUeESiQ HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
LxdkCCBMCVFkXUgiQ6QgCC1bt/EUzvWiQGfCDCtgE/Eki4/hQd0YDC5m0tEE3I4hQjnvCCZMlNFkCgzhQ1BEBC5QP3EUqmWiQkyeACFy2vE0nmsiQrQNBCNRkqEkrH7iQpvh+BVTYvE0KNuiQJtwBCljEfF0fmfiQRKHDC9180E04cgiQASaACty2DFE/bQiQte/AChf3pEEiVLiQ HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
LdTiDCVLFiG0HYPlQdTiECVLFiG0HYPlQdTiDCVLFqG0HYPlQ HKH_2021_1IRA_run_1_complex.153_chain_B_6_0000200002_0000001_0
SCORE:  -1459.077  -2681.338    295.208   1706.588               -149.910                 48.223                105.107    888.333       -978.036            -5.510                 -35.233   -918.480         -147.311        -81.847       -237.558       -112.076     -63.178       -5.593                   37.017      5.668        34.288       225.429        421.032   -112.941      75.304   -101.507       0.000         53.696        275.549  12458.000 HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
RT -0.642477 -0.420668 0.640517 0.448311 0.47155 0.75938 -0.621483 0.775035 -0.11437 -28.464 -11.8245 -47.3366   HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
RT -0.236101 -0.712167 0.661116 0.956567 -0.290048 0.0291678 0.170983 0.639288 0.749717 -11.8961 -3.37267 -9.62319   HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
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L0MDFCNRUrGEo9ilQ0MDGCNRUrGEo9ilQ0MDFCNRUzGEo9ilQ HKH_2021_1IRA_run_2_complex.307_chain_B_19_0000200002_0000001_0
SCORE:  -1452.842  -2715.975    299.312   1743.327               -154.300                 50.165                112.801    900.886       -991.790            -6.035                 -37.946   -926.187         -156.913        -77.858       -239.174       -112.755     -59.418       -6.413                   35.099      4.062        36.297       232.440        423.921   -115.844      76.316   -101.507       0.000         49.837        284.810   9732.000 HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
RT 0.338194 0.197117 -0.920201 0.286132 -0.953062 -0.0989962 -0.896523 -0.229819 -0.378722 -13.0629 3.27467 -33.3337   HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
RT -0.281835 -0.808156 0.517158 0.938264 -0.344824 -0.0275283 0.200576 0.477472 0.855447 -11.116 -2.18088 -9.44112   HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
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LnIuMC574SHUZiJmQZERMCRM3PHUotemQczELC5fXIHUX3dmQJdCKCZdHLHUKCVmQPj0LCRm7ZHk57qmQyKTLC9oGXHkewAnQpa8MC1cnhH0ThsmQQbSMCxbSZHUoUCmQdrFNC1R+LHUOGnmQkrALCd/sdH0BPimQhZ/KCJugeH0QaInQyGcKC1dwRHULu/mQhqFMCV9UTHUZBKnQfTmMC9DsoHkPw0mQDBxNCFPCeHUCT1mQuURNCVmxjH0AgcmQ HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
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LnNEKCpVH7G08wNnQjrpJCBoz5GkqyjnQWYlICV3BCH0nNpnQaG1IClZwLHUaOonQm21KC5HI7GEo7ynQiT2LCZoyxGkxRznQaXDNC90NzGEZtjnQkTBOC5RB8GUxSrnQ1hUPCRaM8Gk53enQ4k0KCBGFAH0RGKnQKPOJCtA3xGUL0lnQwfWLCt1eCH0NGvnQJndKCN347GkXmBoQsnOMCdIxwGEwxBoQ6+ULClrfqGkWvunQHGmNCpivrGUXAjnQ+BtMCRbG1GkwxTnQaUjNCtOyDH0wfpnQU4OOCJLs6Gk5A8nQok6PCdlCCH0n0knQuRzPCdqH1GUJlgnQTkKPCRbh9GEsKPnQ HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
LOOZHC1j89GkKbunQKOOGC5yeEHEu0ynQE9jFC9pdCHEVGEoQ0hgFCFbn5G0AKIoQZGIFCV9eCHEoFinQFxeFCxG+EH0KgLnQGP6FCJe48GEbD+mQL+YFCBoPPHECeDnQsSPGCJ87+Gk+CpmQRbuFChCURHkLgumQdgJGCNCIJHEsPhmQLpTHCFa01GU6aunQmKhGCdHqMHUYnynQHu0ECRCI6GEr3inQRyQECltQHHkbbmnQZr/FCN1u0GEOTEnQnODFC1QsVHEP4NnQqLlGChfZ4GUwyemQlQqFCNwXZHkAaomQUfaGC1JwKH0MuQmQ HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
Las9ECNeiKHUHjIoQD/KEC1K5IH0TBSoQEnyCC9AFHH05PNoQSzaCCBAeMHEEgFoQFmOECJfnSHE0FZoQPwnFCd0UVHkkxcoQfmSGCla5cHUMFXoQraPGCJgZQH0+aloQXqiHCBxufHEJsZoQ2rjHClKPTHEVFooQRUNICZm9aHksJioQrOiJClSDeH0oTkoQ4qCFCVJ4RH0+OFoQXYfEClIxBHE2WWoQ8n3DC9cIZH0vdUoQSelDC9ImRHkTBgoQclzFCd2wgH0VUQoQvytFCdzUKHECAqoQFtAIC1YxlH06CVoQIOEIChpaPHUuuuoQEvBKC5OoYH0KkooQ HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
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Lj+TFC1RRmGkhqflQj+TGC1RRmGkhqflQj+TFC1RRuGkhqflQ HKH_2021_1IRA_run_1_complex.27_chain_B_5_0000100001_0000001_0
SCORE:  -1448.784  -2679.448    288.687   1742.459               -151.160                 48.943                105.454    906.017       -990.168            -5.928                 -35.980   -942.594         -148.805        -78.344       -241.454       -122.233     -61.587       -6.081                   38.808      5.600        37.174       231.851        423.172   -114.443      73.888   -101.507       0.000         50.028        278.868  10591.000 HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
RT 0.86596 0.0469225 -0.497907 0.334045 0.686665 0.645682 0.372193 -0.725458 0.578951 -7.66403 -7.40815 -20.0593   HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
RT -0.171362 -0.854095 0.491077 0.964101 -0.247997 -0.0948996 0.202839 0.457185 0.865932 -11.576 -2.28109 -9.5608   HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.148_chain_B_7_0000100001_0000001_0
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