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:  -1497.439  -2669.156    284.405   1727.567               -152.388                 48.035                108.363    899.709       -981.947            -5.976                 -37.501   -951.030         -152.973        -80.842       -234.279       -121.313     -67.802       -6.362                   23.472      6.575        35.494       224.497        420.438   -113.906      74.482   -101.507       0.000         46.225        280.281   8491.000 HKH_2021_1IRA_run_2_complex.733_chain_B_7_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.733_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.733_chain_B_7_0000200002_0000001_0
RT 0.593375 -0.120664 -0.795831 -0.704863 -0.555318 -0.441351 -0.388684 0.822838 -0.414563 -10.9728 -13.8728 -33.395   HKH_2021_1IRA_run_2_complex.733_chain_B_7_0000200002_0000001_0
RT -0.122204 -0.695908 0.707657 0.958817 -0.266964 -0.0969549 0.256391 0.666665 0.699872 -9.81999 -3.72239 -11.2284   HKH_2021_1IRA_run_2_complex.733_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]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.733_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.733_chain_B_7_0000200002_0000001_0
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LUp5FC59myG03oClQUp5GC59myG03oClQUp5FC59m6G03oClQ HKH_2021_1IRA_run_2_complex.733_chain_B_7_0000200002_0000001_0
SCORE:  -1500.748  -2608.423    267.383   1692.252               -150.436                 47.260                107.647    884.889       -965.139            -6.062                 -39.189   -942.889         -152.428        -81.254       -240.258       -120.501     -61.609       -6.249                   24.324      5.014        35.252       224.889        416.173   -114.795      75.713   -101.507       0.000         46.542        262.653  13593.000 HKH_2021_1IRA_run_2_complex.787_chain_B_7_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.787_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.787_chain_B_7_0000100001_0000001_0
RT 0.347694 -0.179117 0.92034 0.937591 0.0723748 -0.340125 -0.00568728 0.981162 0.193103 -21.5885 -1.25053 -39.797   HKH_2021_1IRA_run_2_complex.787_chain_B_7_0000100001_0000001_0
RT -0.223541 -0.896844 0.381707 0.950759 -0.286889 -0.117266 0.214677 0.336697 0.916814 -11.6613 -2.35816 -10.661   HKH_2021_1IRA_run_2_complex.787_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]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.787_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.787_chain_B_7_0000100001_0000001_0
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L8EV1BFVSsGEV0fiQ3QA3BN9ejGEWFniQGDr1BhTnYG0rrniQTnPzBxXeXGkD2qiQvBC4BNUdlGEQx9iQe5q5BN0AvG0g9/iQPqi4BxoY4GEvqGjQCSV8B1G2uGUuC7iQ7OC6BlXbBHEHgIjQno09BBu93GE+u8iQP+q8BBMOBHUHfDjQMFizBpZbtGENZniQ22r4BRk5iG0pTciQQOV2BdBJmGEBmIjQIbN5B14jeG0d7CjQy2Z2BtNn4GU4bKjQWjP9B1LZnGUCq1iQSsF5BBO0IHkDxNjQeY7/Bpu33Gkdo4iQLI29BNKYIH03uEjQ HKH_2021_1IRA_run_2_complex.787_chain_B_7_0000100001_0000001_0
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LQ+v5B5aTBEkUEikQfBW7B14ccDEVRckQeom5BV202CEbuVkQ7+A6Bh7ZkC0joEkQpcs3Bx5QsCUm8gkQI2O9BNc7LD0qPukQb9+/BdLzkDURCykQYUSAC1yABEkptlkQsbyACZ7zXD0TNAlQ57W6B9VYLEU5EukQMsl8BxB8kDEsmOkQcXI8BZ7yMDkmU9kQzHq9B98mqC0AMrkQ HKH_2021_1IRA_run_2_complex.787_chain_B_7_0000100001_0000001_0
LMhjEClsHnG0xtKlQMhjFClsHnG0xtKlQMhjEClsHvG0xtKlQ HKH_2021_1IRA_run_2_complex.787_chain_B_7_0000100001_0000001_0
SCORE:  -1489.798  -2638.249    275.206   1698.192               -152.662                 48.139                108.590    891.869       -967.374            -6.131                 -37.471   -923.412         -152.879        -77.933       -236.103       -121.902     -72.447       -6.292                   24.089      4.278        31.496       223.992        424.010   -115.312      76.029   -101.507       0.000         47.808        266.177  21714.000 HKH_2021_1IRA_run_1_complex.609_chain_B_18_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.609_chain_B_18_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.609_chain_B_18_0000100001_0000001_0
RT -0.824903 -0.0339369 0.564255 0.0816947 -0.994874 0.0595956 0.559341 0.0952572 0.823447 -37.7504 3.9569 -37.3401   HKH_2021_1IRA_run_1_complex.609_chain_B_18_0000100001_0000001_0
RT -0.238081 -0.754684 0.611367 0.951797 -0.306627 -0.00785411 0.193389 0.580027 0.791308 -13.4503 -1.48863 -7.89807   HKH_2021_1IRA_run_1_complex.609_chain_B_18_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.609_chain_B_18_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.609_chain_B_18_0000100001_0000001_0
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LcM3CCxgyeGUJm9lQcM3DCxgyeGUJm9lQcM3CCxgymGUJm9lQ HKH_2021_1IRA_run_1_complex.609_chain_B_18_0000100001_0000001_0
SCORE:  -1481.115  -2710.344    295.379   1758.925               -151.816                 49.412                109.133    925.368       -998.180            -5.452                 -33.814   -956.165         -154.334        -81.061       -241.366       -119.193     -69.536       -6.328                   31.914      7.115        31.842       218.189        421.371   -112.937      76.023   -101.507       0.000         55.947        280.301   6906.000 HKH_2021_1IRA_run_2_complex.715_chain_B_23_0000300003_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.715_chain_B_23_0000300003_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.715_chain_B_23_0000300003_0000001_0
RT -0.504084 -0.111213 0.856464 0.53728 0.736038 0.411799 -0.676188 0.667742 -0.311272 -33.6113 -17.4374 -39.7942   HKH_2021_1IRA_run_2_complex.715_chain_B_23_0000300003_0000001_0
RT -0.320725 -0.778127 0.54005 0.932685 -0.358797 0.036934 0.165029 0.515542 0.840822 -11.6122 -2.50229 -10.6453   HKH_2021_1IRA_run_2_complex.715_chain_B_23_0000300003_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.715_chain_B_23_0000300003_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.715_chain_B_23_0000300003_0000001_0
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SCORE:  -1486.443  -2640.206    282.160   1681.934               -151.259                 48.428                104.366    888.065       -965.827            -5.962                 -37.999   -927.340         -141.641        -78.594       -237.559       -112.565     -69.867       -6.511                   25.473      4.014        31.476       223.321        418.115   -112.458      76.414   -101.507       0.000         52.188        266.900   1581.000 HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.18_chain_B_4_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.18_chain_B_4_0000100001_0000001_0
RT -0.538641 0.404585 0.739038 -0.434454 0.618174 -0.655065 -0.721884 -0.673923 -0.1572 -38.4205 -13.1487 -28.032   HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
RT -0.210506 -0.758808 0.616359 0.944346 -0.320864 -0.0724965 0.252779 0.566796 0.784121 -12.203 -2.09543 -10.4878   HKH_2021_1IRA_run_2_complex.18_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.18_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.18_chain_B_4_0000100001_0000001_0
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LmHF3BdRDRFU1cUmQqTF5BldNUFEDDlmQiqq7BZiVdFkQ9bmQRB+8BdnTTF0GPOmQm2s5BhFA/EUyPwmQfVX3B1Vq0EE1f8mQ9sQ4Bx88fEUhnInQXqh4BdpQME0/n5mQ9kg5B5E1wDE7MFnQGb42BdBwCFkoONmQs0T4BV1qfF07twmQbRc6BFixzE0uhkmQV7R7BpazBFUQ27mQnql2BRLLAFEuDInQqDx1BtotwEEtUxmQmVM6BZ+yiEEDRQnQRgz2BRhQcE0ZDVnQzKl2Bdb0IEk9nymQ/J55BxH4PEE/DtmQsCr5BhDjXD09n6mQXbV7BNC01DkEoLnQiUQ4BVxToDEb9QnQ HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
Lpta8Bd4IwFkWRkmQEHy+BNgw7FEaJdmQslTACVv4BGUTfumQ7I0/BVEEEGEThAnQOND+BNK+HGEbqQmQ34h8BxsKGG0Iq9lQGB05B9iTHGkO99lQNfx9BFSJDGUKLrlQHIX4BtJhFGUwCslQhoU8B9kRBGEnWZlQMKn5BlyeCGEqtZlQX0L7B5tN3FEiUvmQCy7/BlRKxFUKGTmQQi68BFiTNGU2BbmQ2q4/BhqKMGE1MMmQqrz4BhDnJGEjzMmQ0/7/B9lOCG0h+qlQGlM2BVKbGGE8islQB3T9BF0m9FU46KlQOXd4BpBABG0QiLlQ HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
LkAjBCFFaDG0KuomQVTdCChpDJGUBj2mQE/cCCtTYUGUBgtmQGeYCCRRwVG0r7ZmQHy0DCh3LEGkOu1mQHT+DCJIdyFkMs/mQ0EuDCdxTgFkJszmQFwaECJ5fwFUbsUnQmC6DCpVdMFEPx8mQNxmECZAdcFknmdnQeIWECFKhKF0WnRnQgGjECduW2EUAxZnQzJ3BCB0GBGUL1ZmQJhFCCxINJGEE8GnQjdFECl6gDGkkElmQNshEC5bkJG0hS9mQRwYDCRmthFkzEjmQnMoECFcx+FU4HenQ6xuDCViO+EE3qzmQfi9ECB05aFkr/tnQWKOFCBsj2E0YKlnQ HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
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L77kECJ75vG0e97mQBumFCtM/0GkHUJnQ9ECGCNOHAHERWCnQRPjGCpylBHEXtwmQCO2GCl/ttGExDKnQK7EICdYPyGEbHWnQfP4HCxuRzGEfSunQotmHCxIVrGknS5nQEKBICNKF9GEgn2nQvZ1ECRm+sGkdKtmQvINFCptp1GkTfZnQZIlGCdPHmGkXaRnQOhKHCxABsG0Dx5mQEP6ICZBzsGkdgTnQSeVICJAI6GkN1PnQ+C6HCtQP+GkaMDoQ1IQICljiDHUR5snQ HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
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LB0vDCpmkkGEKFNlQB0vECpmkkGEKFNlQB0vDCpmksGEKFNlQ HKH_2021_1IRA_run_2_complex.18_chain_B_4_0000100001_0000001_0
SCORE:  -1487.472  -2657.515    279.245   1728.951               -152.084                 48.559                109.155    898.847       -980.021            -5.758                 -36.151   -955.561         -144.528        -79.893       -243.967       -115.425     -64.643       -6.342                   31.396      5.448        33.437       220.281        418.437   -116.639      74.627   -101.507       0.000         53.434        270.746  14007.000 HKH_2021_1IRA_run_1_complex.793_chain_B_12_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.793_chain_B_12_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.793_chain_B_12_0000200002_0000001_0
RT -0.0316672 0.583233 -0.811688 -0.128364 -0.807743 -0.57539 -0.991221 0.0859707 0.100445 -27.616 2.48284 -44.2801   HKH_2021_1IRA_run_1_complex.793_chain_B_12_0000200002_0000001_0
RT -0.188079 -0.736986 0.649213 0.955177 -0.291114 -0.0537546 0.228612 0.610003 0.758705 -12.2362 -2.90182 -8.6166   HKH_2021_1IRA_run_1_complex.793_chain_B_12_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.793_chain_B_12_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.793_chain_B_12_0000200002_0000001_0
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LET+ICJ5PrGkDXYlQYdSJCdnbtGUQtulQ2tGICJEfrGEVu9lQpLEHCl2pwGkj47lQa8tJChcR5Gk2mwlQqyDKC1cZ8GEH6HmQ6r3KCtkS7GUXvhlQH8XIChFdwG0uZQlQdVHKCJKQoG0NezlQUL5ICZ7P+GkytrlQ0iVKChL3EHE8RImQSgMJClSP7Gk+JSmQeJ5KCxHm3GE0sNmQeNJLCldnDHkihilQOltLCRkW2GE+ZmlQFClKC9GZ5GkCXRlQ HKH_2021_1IRA_run_1_complex.793_chain_B_12_0000200002_0000001_0
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LhGG+BpLGGIEi64oQ9a09B18wLIEOu7oQaCQ9BFJfMIUqnHpQo7P+BNSRQIUIgMpQAdM7BREcKIU4GLpQ1Em7BRRhOIEdV1oQacQ8BR36PI0PhpoQ5Yj+BhlrPIUfGmoQV1Y6B5+cRIU0+joQDyn8BJ/QEIU+i0oQAbr/BJQzNI02/5oQGC25BFs5LI0jT1oQmDB7BZmLSIkac5oQ HKH_2021_1IRA_run_1_complex.793_chain_B_12_0000200002_0000001_0
LIgZECpu5oGklCxlQIgZFCpu5oGklCxlQIgZECpu5wGklCxlQ HKH_2021_1IRA_run_1_complex.793_chain_B_12_0000200002_0000001_0
SCORE:  -1483.583  -2683.885    288.306   1710.019               -153.615                 49.474                110.089    899.904       -979.359            -5.949                 -36.838   -928.541         -147.000        -81.076       -237.345       -112.293     -65.245       -6.156                   29.167      5.658        34.516       231.778        420.700   -113.518      76.263   -101.507       0.000         43.636        269.237   9922.000 HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.775_chain_B_2_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.775_chain_B_2_0000100001_0000001_0
RT -0.909923 -0.403674 0.095326 0.066278 -0.368378 -0.92731 0.409447 -0.837463 0.361951 -23.9722 -4.13162 -10.0265   HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
RT -0.0435887 -0.701005 0.711823 0.986043 -0.144781 -0.0822 0.160681 0.698305 0.697533 -9.16761 -2.06253 -12.4682   HKH_2021_1IRA_run_2_complex.775_chain_B_2_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.775_chain_B_2_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.775_chain_B_2_0000100001_0000001_0
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LweDDCVikzGEwADoQgO8DC5j24Gk5eKoQx90ECFeSBHk75EoQFMDGCdxHBHUWSGoQmv0ECljQwGUSgPoQXCGECpS9nGkhQWoQ5NLFCpBLdGEUxaoQF5QGCl7hjGUgFkoQXrcDCllVwGURc4nQReWDCt9v8GUlrQoQ3TWFCh6DsGUNUJoQxWjFC12C0GEPfUoQuRqDCpD3rGkUOdoQdUSDCRMckGUnqRoQ+k9GC5SsdG0WXnoQVE0GCxDtpG0CGgoQGzrFCtmDnGkulqoQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LN9PECJcMJHkFI+nQgw9EC50WRH0e+xnQlczFC1N4YHEA0/nQeSzGC9vWdHEme4nQvB0DC5jrXHUQknnQLVnCC1EqVHk8p1nQHvxCC5bWKHkiH9nQnDQECdBJJHEg29nQs1lFCltcNHUHzlnQp7EEC9WPgHU71mnQnvoDCd+BVH0dPXnQpqlCCJqgbHEpeBoQgUsBC5b4WHEPjsnQv+SCCJ2UJH0OZGoQmgWCCZNDFH0sxwnQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LwTcFCJyyZH0xJKoQbpIGCtI9gHEHcRoQAZJHCFqUbHECnYoQ6UsHCpBSgHES7foQT7GFCRjqmH0WcYoQgwLECldEuH09GSoQdopECNJ2zH0sSLoQ1DADC9TstHUwGUoQqrnECdeCWHkZ9MoQZlqGCBg6mHkGtMoQPIgECRzvgH0umcoQ0BoFCpfYrHEHgeoQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
L7rZHClkBRHUUnWoQxOWICl+ALH0cOdoQEOzJCJhbOHk4LboQYpoKCpTCOHUlVioQ7TMICdqA/GE/cboQ+/BJC5yy3GEAGjoQd/kIC9aY4GkQkuoQhldHCt9m7GUTYwoQiZVJCpPf1G0ie1oQkN7GCB1MNHErbQoQ7hHICFaqMHURmloQnMKHCBhA9GU60coQ8EaIClYE9GEAMToQSs+ICtZjvGUsZgoQcZEKCJXM6G0/tioQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LUhIKCVrURHUoPRoQehgLCNoZUHkrfOoQsjXMC9vHLHEQfKoQNJlNCBaRMHEjJJoQAvaJC9pmRHkliLoQgbeLC1gnaH0TYIoQF8+LCRHAYHk6eVoQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LBmvLCN66BH0xkIoQ+JeMCZ8f4GkSxEoQX9GMCByl1Gk/YynQ5L0MCJfkvGUd0nnQXyMMCFJFvGkJWMoQBYsMCFtlxGEwbXoQkDxKCFLysGEmmMoQd8vKCRBrBH04zJoQDqiNClBO6GEiDFoQ/cuMCl7UoGU9tJoQPdgMCpCzqGUVscoQ/XvNCxlAzGUdCXoQ2MMMCZio4GEtlaoQD/mKCRnZmGEi0RoQWSPKCl3kzGkDYPoQI+aKCpmsqGkt5EoQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
Lo+/KCBW85GUuZqnQx8iKCpGH4GkuhUnQfRSKC1stCHU6HKnQQUyJCBVIKH03cUnQ3yRJCR7XxGE1yTnQ4jeJCJMSmGkg2anQt1/HClt7eGE1PfnQ8WhHCpqAkGUk74nQd7bKCpVx+G0hmznQtYVLC1CH0GERfLnQ7igICRvI1Gk4SdnQxA7IC1jExGEoZDnQ2DFKChxIiGEY5OnQw3AKCNgbmGE3PpnQr3nGCJ+4fGUXb+nQ9wTICdlliGU3/BoQqbVHCtImsGkUJ4nQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LVDlKCF4VDHEst1mQXuVKC9tBNHEOEqmQzxEJCJnoMHk4EdmQUq9ICNYbGHUY/NmQFIgLChSFPHE0kamQ2nQLCZK9YH0F8NmQOKyMCdU7PHUVjmmQaMALCR/28GEZYumQdbRKCB0nTH0+a1mQbukLCFrfIHk3aPmQz3FMChu7ZHErhDmQPoWKCxgRYHktaEmQPsLLC53yfHk+hYmQdUlNCJhORHE5IbmQ9HvMCFqjWHktuxmQna9MCdQgIHU6JvmQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LzjJICBLwTHk1UimQGn4GCBIyUH0q+WmQsE8GCds2eHEqjJmQPLDGC5KChHk/q8lQZCtFClOnVHUwsmmQpl5FCl5xeH0nY0mQrdmFClhnLHEC5zmQw+SICt8aYHUGYvmQ+kvGCN47NHUxeMmQ21xEC5XsWHUgrdmQHFGFCpGBgHk6f8mQCVxECdSLMH0Xq+mQVDcFCpQGFHELOpmQYGhGCBXXKHky98mQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LMBCIC5SskHk1lMmQ/kTIC1t8uHUizCmQMNEJCFygtHkD9tlQV6NKC5zvpHU64tlQYvIJCFqe1H0lkSmQb4aIClwj3H04vnmQo8UJCNRJ9HkTz3mQYvoICR+t+H0QxNnQcDdICBab0HkSAanQ58sIC18phH043WmQXKXHCl3+yHkhS/lQGCFKCZYcxH00yVmQaeXJCpKP9HUOeLmQcijHCZWq8HEvokmQFEEICBYDwHUmaumQcQPKC5ae4HUU/5mQbgmJCl/fCIUYhxmQLfPJC9QECIUtXXnQJEqHC18JBIUaKLnQV6/HCpe71HUDOonQVc4HCxtRvHURlRnQnlWJC5KCxH00xcnQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LWVaICVZjwHEcbclQsU9ICxEQvHkxBHlQax8IC5OT5HkDq5kQuyIICdfRAIUrc8kQN7LIC5TvmHEQV6kQLeQIC9FubHkDMDlQuhUHCFHQYH0AtRlQJWQJCBosUHkT38kQRxXHCRNGOHUG3ZlQocTJCNofKHkdFFlQRzWICpLOHHk9oTlQ/VdHCVogzHE5AelQWJ/JC54wsHkzlIlQMxIHCx7EpHUeb5kQ/jkIC16jmHUF/pkQg2hGChIudH0Y1WlQ1DAKC5GVXHUiOxkQWAoGC5XkLHEDXllQYsFKCtPDFHUUIAlQQpYICRJP/G09PalQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LTy2JCFKx5H0QnqkQe00JC97GBIkqBbkQvUJJC9xN9HENzHkQpfUJCpBozHEFpDkQ+BNLCp1CDIkZ+VkQl94LCJtvFIE3EokQUl2MChRDDI0+qzkQXrjLCxc6KIUKZtkQYneNCdSmFIUzXElQUmLMCFAYNIkDQ+kQs5INCZjsKI0xyJlQaZwNCVqLNIET3alQSmjKCJD4zHkZOpkQuwNJCBTbEIkvtgkQA8xLClpM/H0FuRkQ2gKLClTwFIUphIkQo6HNCV+49HEMcvkQkyyKCJ9DNIENXkkQS8OOCN/pDI0yNNlQpR6LCpEbRIEkaClQkqZOCt60KIkkKilQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
Lt0WIC5htBIUwH8jQidpHCdGs+Hk3LqjQ+mbHCJplDIUI7YjQYd1GCB2xHI0PNdjQVLVGCJzZ6HUYvzjQGndFCh0EzHUfPnjQJv1FChGqoH0LAljQIUQEC5sO2HEIFfjQTzCFCxTZhHU8vajQD0bDCxg9uHkmmUjQKY1DCR8fkHkChSjQbePICpIoFIEZs/jQOMPICNfL4HUhljjQU0kGChbP2HklhCkQvKuFCpZnAIEaU4jQ7iyGCVrOmHU4yrjQXv8DCNud+HUvAhjQH1XFCdIOZHkNWZjQpaeCCZtgxHkpCOjQVmMDCVSveH0mWKjQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LEd8HCR7kCIUojFjQOI1HCdKfGIU59ziQTZUHCZzEEIk5UfiQFprHCJsO/H0SpZiQxvLJCRuDJIUL6uiQdpxJClxbMIU7TAjQy/HLCdb2OI0Zb5iQqE0LClmtMI0lGriQDEgLCB9QTIEVjDjQjubICln/9HECbDjQ/WIHCZZmJIECz4iQvt5JChP6FI09MriQMdFJCBriLI0QmgiQWmFJCR1rPIEP6DjQXy6JCll+JI0RcOjQWkXMClrCVIUA0/iQCp6KCJN2UIEU8OjQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LUGhGC5RHHIURjTiQ3CAGCZsPFI0RA/hQ7PDHCRX6FIEJsthQ93uHCNYBKIUHSthQt/uEC5VUII0m44hQ8d/DCxLCGI0qylhQuYtCCNw2II0+ZhhQLrXCCZiZMIU1XthQn3DCCJKgHIkf/RhQ2FQGCdCyKIEC6YiQ3QwFCNkABIkBNAiQe7DECBhiIIUgMGiQYhAFCJuZMIkKx0hQb0nECp/VGIkkmXhQw8yDCt2yBIE/tohQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
Lq/KHCdO8BIUchfhQR1EICx9VCIkhLNhQcBxHCFEQHIU7f/gQeLsICxuxJI0eR3gQhgqGChoVHIEnv2gQZJAICd0w6HEes+gQfFuICJpjwH0e0GhQWkcJC174wHk4VWhQU2jICxyXoHkAX8gQunmGCBjI9HkdkhhQgAGJCNSuCIk2MThQHy8GCBPv4HUbU8gQTJaICxKz8HUCEvgQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
LrpIGCBWfkGUwd/kQrpIHCBWfkGUwd/kQrpIGCBWfsGUwd/kQ HKH_2021_1IRA_run_2_complex.775_chain_B_2_0000100001_0000001_0
SCORE:  -1452.216  -2659.023    291.228   1713.403               -150.273                 49.242                106.369    890.006       -974.838            -6.093                 -37.978   -945.314         -143.591        -80.242       -241.698       -117.253     -67.396       -6.043                   41.920      6.146        36.851       222.263        423.149   -116.371      74.245   -101.507       0.000         58.012        282.570  34087.000 HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.458_chain_B_11_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.458_chain_B_11_0000200002_0000001_0
RT -0.362805 -0.0770206 0.928676 0.630901 -0.753739 0.183962 0.685811 0.652645 0.322053 -42.6557 -4.40995 -15.7925   HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
RT -0.235439 -0.705447 0.668516 0.941033 -0.337417 -0.024643 0.242953 0.623293 0.74329 -10.382 -3.44766 -10.6424   HKH_2021_1IRA_run_1_complex.458_chain_B_11_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.458_chain_B_11_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.458_chain_B_11_0000200002_0000001_0
LM7CyBV+gSD0A7maQ7mkvB9+WUDkIZ/aQkNQvBNE4/DkuXUbQG3KxBhI3IEUi1lbQpQlvBJf0xCkqAibQqXsvBxq+FCkRkObQTkYvBtvoDCUNXoaQSMKwBB93NBEQ2kbQ0jNyBZDt0CUWaaaQhK/xBl2KoDkH/OaQYxnzB10kYDkHJ6aQf94tBdzKPDEOzpaQdZSxBpvS2C0/S3bQeXxtBd/k0C05M1bQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LZM0sB1NcIEEM1UbQrSXsBNPldEEVunbQ9uDsBhCFcEE9EYcQ475pB5orfEEVnpcQ/z4pBxKDoE0NJUbQGJJqBtYMtEkJkkaQX4lnBNye3EkKQTaQoh1nBpKu8EUrqjZQ8TVlBpjaGFU0TSZQ9GRrBp8gAEktVHbQCHGuBZ4onEEG/gbQHsKoBRgjdE0mYYbQrXdpBV272EEU/kbQJM0rBZvI4Ekj1faQXEjqBxTkeEEl1SaQSg6lBFuksEE/7XaQN8LnBNLMGFkJ1kaQVsepBlv6HFEEEfZQ0DRoBBYEuEEzDSZQm2klB9toJF0Y2yYQT9yjB1rE8EUXEWZQJN7kBlDIUFk9IiZQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LwFSuBFEzWEkbvscQb/cuBh8BTE0RqadQHPiwBlrchEUA4vdQUEwxBhFwbEUUVQeQ+bIvBZGM3DksvidQjKpsBttbSDEUMPdQnp6vBRIXUEEyBacQHngsBtIdWEkwqodQF/BxB9AcvDUAgTdQFyWvB9r3xDUaqEeQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LL2AxB1LJ0EUbYcdQKR5yBVFDFFk8eqdQHq31BN26+EkxtodQKva3B9ZpJFEb6SdQYUNyBttGNF01gXeQKRlvBpTbZFEH/ZeQZ4DvBZXohFUqAHfQCWcsBR55tFUf8JfQat7rBVJr1FUOV2fQiq7vBlJB3EkCpBdQTXpyBZNlSFkh0UdQN+GyBlD6/EkSCueQvKzzBRztXFkJeieQ1NpvBNl4mF0p2DeQXq8tB1I1OFUZlQeQiZ8uBh2MUF00mcfQvlswBF19rFUSGRfQ8fgsBddk7FUQW0eQ1tzqBRgYjFE4YAfQgKLqBJMp9FE8S3fQEz2rBZR/oF0xNFgQkPbtBVzk/FUyj/fQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
Ljmj2B1KttEk2b/dQDkL5B18wjEk0xEeQ2S86BN6nvE0s0keQHCO8BtCt/EkusaeQ2fq6BdQ2hEUuyZdQ7fS9BxZXVEUHCcdQJkp+BhtSTEEQ0wcQjve/Bl1SjEETMgcQDIx+BtNxBEUy3fcQmtB1BxLsmEkTPPeQjN34BdVoTEEHLReQS1X5BxdLaEUnSCdQgaL7B9YlxEEwvNdQ3vp+BpRhdE0e4xdQ1H58BNqjFE0qDpdQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LLzE7BhYFnEkkxLfQvMx8BVAWwE05AtfQs7y+B5EGgEkwP8fQFPR+BN12ME07w7fQY3I7BBtu4EEecJgQntz8BRLLEFEfQbgQMdH7BdJsPFkfHrgQMat5BF/+BFEMH7gQWoJ3B5E3FFEqNChQgcu1BVswVFkwt5gQjVA2B9SR6E0+pRhQzU75B5g1ZEUVNSfQ1w29BJo19EETZffQ5Ao5Btr1DF0juDgQc4H6BNIprEUP1QgQJ679BlkQ4Ek4YkgQY6L+BtqmPFECGUgQCVZ8BpWwaFUf7zgQ7Jq5B1ovYFUTMigQkoz6BhG71E0MqChQXme2BVPCfF0UKugQ0FzzB5poYFURD/gQyf82BBUvtE0QdZhQgkF0B5++9EEVHWhQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
L65jACJ8xnEUMlEgQJUkBCZjuZEEekNgQQV6BClI9hEkktjgQIV/BC98b1EEV5mgQ8f0CC9GmZEkK2+fQLzlCCRDDSE0mkQfQg/3DCBHjQEEQ/2eQ/o2EClEcZE0okEfQM74DCdTiFEk/1WeQpzvAClmr3EUJuDgQ2FLBCx/hJEEoIPgQQoPDClxopEE1r9fQPfkDCNkIPE0XnGgQQcFCCVUyCEUDrQfQ6c7BCdOedEkB7AfQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LYSJCCZsbTEU9vygQr8iCCRyGaEEbJIhQbPDECRVBeE0nnIhQV6xECR2TWE0fs6gQDNDCCJ2hKE02GZhQldhACVUKJEUUmZhQq7s/Bd+reEkrkdhQBrYAC52YrE0lTphQOjn9BNLaiEkBXUhQ8EBCCZ3iDEUxOvgQelECC9ybpEUNkLhQrmcCCdEK1Dkq7VhQ9YZCCdZcPE01zohQcGLACtIoCE0EfKhQqwOACBRe8DUSWmhQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LuVgECRWyqEEFEYhQx55FCVAhxEk3tYhQkz7GCde2iEEQWjhQMkGICRzZjEE8EdhQxr9FCJXfHF0jcjhQP5LFCNRYZF0FmXhQ+4xFC9NRfFEfyBhQY47EC1OPwFUSv2gQ7MhFCpAs2Fk+1hgQGt2DC9sEwE0aWjhQpzOGCtcIzEkBOIhQH0iFCpeSGFUEczhQpLAHC5vdMF0EDlhQX0JEC1nOUFkKOVhQtfLFCJDunFUrmhhQf0yGCZedlFkm5DhQhM0FC94cRF0YU3gQ5K8DCRDupFUh/zgQpu2ECpgV+F0U9AhQ+h7ECdS4AGU57agQfzcGCdDM9FkXukgQmUmFCdR5pFEGIYgQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LDMkGCx4NWEEoZzhQLOnHCVsOJEkff9hQPoOHCN0ekDEEWAiQEuDGCRyWZDEx8BiQ5cDIC17nSE0I8SiQLzVJCJ2AIEklJciQwI6GCdcwPE071iiQlXAKC5NCVEkV2tiQXEmFCxr8VEkPt4hQEBfICtuVJE0iGzhQ+STICRuniEk9EQiQ3QGJCJsTxDkBGjiQvTEKCtc2FEEMYPiQq3JHCpbvWEk0FyiQDNDGCxXfXEUObciQbBsGCBU09DUAVliQvT5KCdflMEkaaziQjySKC1xmkEk/hniQ6PVJCt+QXEUuN7iQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
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LBvnvBFdpTHUwMJiQdPutBZ2ZMHUu0+hQ6pvrBJWZSHEakwhQKzHrBhHnOH0SEfhQCvMqBVTuYHEoP5hQC7HsB1H3FHEaQPiQsHotBd/a8GEtAaiQPixvBpXg5GUJTTiQr6gsBtX73G0X7oiQ2UyvBhHoTHEajZiQrg2uBdD4GH0D00hQKidrBxbQLH0G8biQvUVqB50uCH0wkHiQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
LIR1FCZiHvGkJ6MlQIR1GCZiHvGkJ6MlQIR1FCZiH3GkJ6MlQ HKH_2021_1IRA_run_1_complex.458_chain_B_11_0000200002_0000001_0
SCORE:  -1496.085  -2691.771    290.221   1754.206               -153.364                 50.875                109.505    921.556       -993.773            -5.213                 -32.236   -985.235         -151.553        -84.094       -244.604       -125.963     -72.705       -6.081                   32.375      6.908        37.350       234.326        423.888   -115.480      74.839   -101.507       0.000         50.019        281.425  15231.000 HKH_2021_1IRA_run_1_complex.764_chain_B_21_0000300003_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.764_chain_B_21_0000300003_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.764_chain_B_21_0000300003_0000001_0
RT 0.753078 0.642082 0.143544 0.656975 -0.74563 -0.111446 0.0354735 0.178233 -0.983349 -0.961177 -19.4891 -9.87124   HKH_2021_1IRA_run_1_complex.764_chain_B_21_0000300003_0000001_0
RT -0.694849 -0.609994 -0.380911 0.684963 -0.722733 -0.0921027 -0.219115 -0.324907 0.920013 -4.74324 -7.31461 -10.4622   HKH_2021_1IRA_run_1_complex.764_chain_B_21_0000300003_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_1_complex.764_chain_B_21_0000300003_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.764_chain_B_21_0000300003_0000001_0
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LIlTOCNpNxF022YlQ3y8MCtniqF0XjflQuk3LCFy6sFUbfOlQNw0LCl958FkCSDlQSplMCxbP2F0GW0lQUZLLCpd9yFE048lQ/yRKCpkUDGEmf5lQz/sKClHTMGU8H+lQn3EJC9f5BGkyoxlQiHjOCZmkAG0Y7YlQJ2/MCdZrZFUxmjlQlwRNC5HXxFkH6AmQOWuMCFgmDGk83xlQ9KtKChPWlFEoQ1lQuAQLCpt4vF0AhNmQJ5eICdKLIG0FHvlQKhvICt780F0qbtlQ HKH_2021_1IRA_run_1_complex.764_chain_B_21_0000300003_0000001_0
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LN2pLCNs4cG0rIqkQN2pMCNs4cG0rIqkQN2pLCNs4kG0rIqkQ HKH_2021_1IRA_run_1_complex.764_chain_B_21_0000300003_0000001_0
SCORE:  -1481.807  -2674.017    284.830   1733.075               -151.336                 47.883                105.767    903.726       -983.941            -5.470                 -34.918   -946.981         -143.120        -81.562       -237.183       -129.474     -66.325       -6.174                   30.176      4.682        36.712       225.866        423.173   -115.085      75.614   -101.507       0.000         45.389        278.391   7034.000 HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.606_chain_B_1_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.606_chain_B_1_0000100001_0000001_0
RT 0.520896 0.562727 -0.641877 0.852178 -0.299115 0.429328 0.0495993 -0.770629 -0.635351 -13.8793 -6.32381 -8.01773   HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
RT -0.00890196 -0.712357 0.701761 0.971289 -0.173008 -0.163299 0.237738 0.680159 0.693444 -8.36876 -2.24453 -11.9441   HKH_2021_1IRA_run_1_complex.606_chain_B_1_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.606_chain_B_1_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.606_chain_B_1_0000100001_0000001_0
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LyqdOCJuFpGUs0flQkgTNClUkiGECWklQ6VZMChoEhGEDPRlQFPzLCFEpoG0rIJlQUGiMChp2nGE8u2lQScRLCRc3hG0H57lQJDcNC1lWoGErTKmQTHYOCFKPxGkKChlQ0ypNCNHvaGEqmplQQ+PMCx18vGECAylQCMyKCZ7JmGkyzImQlcmKCNhphGELEulQyqgLC5DwZGUO4AmQES6MCZMOsG02NXmQTTuNC5KTgGUTIPmQXkVOCFu7sGkclGmQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LN7OMCRQCXGEN2KlQTZbLCt/BUG0Jc4kQETFKCZ4mPGUka/kQX8NJCloaNGUNIykQzJJMCFKMLGkXdrkQ7FSMCBwyBGkgl4kQqjhNC9O4OGUPwkkQdFwMC9VMRGkCUSlQk2QLCFZCbGkIeukQ9ejLC1eOJGUNTdkQ/fbLCdxU8FkYH5kQwtAOCJ9kIGELxbkQj7aNCdIzVG0v2akQfDIOCdO1QG0kuykQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
Lae7JCJ6GOGUiTUlQh4uICFTRJG0aTdlQlKpHCxBORGkAIjlQk42HClpcYGk/XwlQXsHJCFJ5CGUIAxlQw7HKCdZqzFkXItlQOokJCZ+LiFkgLelQgcUICVFpYF0wsnlQHf8HCtxYEF0JselQxorKCV/dQGU56dlQIQTIC1w+DGU0TRlQj3lJCRcSIG0xZ8lQvzOICp2k/FETq4lQB5BLCFmO6FEHBmlQuAZKChrZsFEEc8lQVBXJCZfhoFUCVOlQMLUKCd4iVFEsiclQ+6dICZnsWFkKs4lQtNgHCd0kjFEhyklQHCHHCtex+EkofmlQ5pxHCxhGFFkk9OlQz5sIClQM6E0lUhlQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LoQdGCxmePGkapZlQkbUFCBzlWGk1wclQED/DCtxaRGkV1hlQ9joDC5/wIGEMZalQi7EFChaOdGkolIlQm0NGCZ/wjGUZTClQBRFHCZ9IgG0t3ykQ1ZdGCZpatGEs3LlQWbKICJLCmGEkEtkQdQjHChzRzGUFHGlQjsZIC5vkvGEmr2kQFLYGCNVPJGE+DPlQxXjFC5u0bGkn5plQWm0ECNB7XG0AX7kQOhOEChhciG0hVLlQP75GCtZYYGENTrkQMvxFCpWUwGU/JYlQA91IC5a/iGU91gkQDvvHCRc36GUT0NlQF9QJChPL0GEQJykQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LwILDC9rKXGEBctlQWzzBC1W5TG0NcwlQ1MHBCl3yYGkDedlQlaaBC1M6hGEVoXlQUtQBChJOYG0J+EmQbN3BCJajTGUHcYmQQL9CCVQfYGU0rhmQltUBC9gbKGUiahmQ2dgDCpyWUGkh0zmQsb4BCpXOGG0ZozmQEO+CCNDKLGkF38mQ+2hDC9h/GG0pLPnQdpfDC5iKeGUz3zlQJ2tBCxiNLGESyvlQ5/cBCFMsgG0JIFmQUHMACZZ/WGEGcFmQtzXDCN6ufG0emamQhfdACVnjGGUwEamQpbWECNaSYG00F7mQRkdBCFuD+F0zw6mQ+YCDChsvAGUmhTnQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
Lw0NACFK6SG0/VTlQCkD/BhLTXG0I3AlQs7I8BhMxTGkHcClQqUc7BJVyKG0OV8kQNvQACF/LTGklCtkQfzAAC9GsYGEFyYkQHChACJP0iG0sAWkQ1Fu+BJG6TGUCXIkQHfXACVhIoGEGKDkQyNa+BFpIZGERL1jQd0b/BJDXjGk6pyjQuUAACF4bLG0yiYlQ+LI/B5HBgGU4WBlQsKVBC9lqTGUDIwkQmrBACdpwKGUDzqkQRODBChZgmGUrPjkQVR89BxV6LGU5mKkQqmxACFBFwG0qUBkQSVX9BpHMVGEBJojQF4N/BZUmnG0oqjjQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LIFf6BBNraGUk5LlQemt3BlQ+XG0yVRlQ8Bl1BZCEdG0IeDlQ+gO1BtB0mG0rZDlQNeJ3B9y5aG02wolQEQO0B5DNZG0MQwlQMQXzB5LdNGUaywlQ7Yk0BN87GG0kI8lQLnRxB1ntKGUWjklQXyP7BRuDiGkLtPlQA7f3BtbVPGkawPlQP3c4BVyPWGksKzlQAGo3BF/RjGU8MrlQbMD0BxRUcGETcAmQoD2yBNqhdGkvyllQytnwB1/IDGkfaklQeUTwBVrXQGkCRblQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LU+F0BF2XWGkoM4kQIaAyBJWGaGkaypkQa2svBtoGfGUrN2kQQm0uBpEoaGEweGlQhd9wBNcvQG0KjckQmLHvBVJwTGEBkKkQc5buBRJaKGEeH9jQoglvB9qDCGkpgAkQRiusB1iYLGkHovjQsEe0B1mbOG0NQ5kQMQ1yBl3FgGEIEfkQNokyBJqJMGk6UWkQdI1vBBedLG0GCnkQWQRtB5XHXGEdGRkQaGFwBZH5ZGUnyAkQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LKKtuB5bMoGUCOukQAMYsBdTktGUQf3kQAr5pBVacmG0Ss2kQjDRoBRkvmGk6aFlQKpIpBZgsjGkh0kkQqrurBlBH4GEd5rkQZNltBd4zBHkr4wkQwYKvBhweBHUYf/kQ+LTtBh30JHkX5lkQzfovBJ0brGUZGhkQTQ0sBVdWvG0hMIlQNa0rBFaq2GkhrakQidrpB1vY6GkcmvkQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
LPWxGCtdsnGk9dukQPWxHCtdsnGk9dukQPWxGCtdsvGk9dukQ HKH_2021_1IRA_run_1_complex.606_chain_B_1_0000100001_0000001_0
SCORE:  -1481.906  -2644.818    283.052   1715.540               -151.823                 48.394                107.913    901.627       -977.495            -5.724                 -35.652   -944.304         -153.223        -80.251       -241.534       -121.343     -70.279       -6.538                   31.155      7.257        33.280       219.318        420.637   -112.957      75.100   -101.507       0.000         53.180        269.089   8630.000 HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_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.420_chain_B_3_0000300003_0000001_0
RT 0.788894 -0.171508 0.590111 -0.554838 -0.611623 0.563979 0.264198 -0.772335 -0.577665 -16.3346 -25.9498 -6.91323   HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
RT -0.032578 -0.736134 0.676051 0.976332 -0.168139 -0.136034 0.21381 0.655619 0.724189 -8.64617 -3.43431 -12.0018   HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_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.420_chain_B_3_0000300003_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.420_chain_B_3_0000300003_0000001_0
LUHHwBxvKJD0TnPaQkTRuBFXNHDkiqzaQD5gtBNQ2zDkjXCbQiEOvBxGDIEkEHGbQK5jvB983uC0xqYbQlNCwBZZpACE9FNbQV42uBZXblBETquaQ6jrxBNteXBEbwgbQ4fgwBlI5qCUA/FaQHzQvBxujZDE5U3ZQcw0xB5EtXDUmlYaQXTdsBxum2CU1opaQKmdxBpc19CUjShbQyxQuBxkewCEds0bQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
Lz/9qBFGi6DEuUMbQwyFqBpnbSEkpZabQbZgqBtnXVEULPKcQqhloBlXOXEEqlicQEkJnBd+6VEUmJPbQRVkmBp7cWEkbPfaQE6ljBVQ3ZEEHjWaQgn/iBhzcaE0romZQoOFgBFxYdE0q3dZQ1unpBVDhiDU/1JbQ/QSrBJUheE0xBKbQto8lBtsPJEUMadbQueemBRvClE0kzcbQK/snBVzbjE0goQaQg1MnBJIdHE0KwQaQd5ciBlB6ME0BLlaQmM9iBlM7oEUt4kaQgHGkBBgnnEUIJYZQwopjBReeLEU7KYZQenifBRBsdEUA69YQgIFeBd9IRE082qZQgE6eB9rUrE0azqZQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LVTCtB10vVEUy2WcQ0z2tBlZxXE0BWDdQDYuvBN4zqEETuIdQIzQxBh6BwE0f0rcQy/NvBVNNDEkuXSdQvMGtBd/NXDUFKOdQKGcuBRcSUEEif/bQbnFsB5aeaE0q1WdQZnBxBxWaAEEpe/cQ450vBtI8EEE3pzdQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LbTpvBdRF1E0tBudQpwYxBhVqHFEaE2dQFdb0B5ofDFEIW0dQSQ61BJgGRFENrkdQGiuwB9PVRFkcaheQRlFuBpELdF0KwkeQv4utBdJomFUV9RfQbwGrBJ51yF0BWWfQXU0qBta98FEUzAgQBrQuBRiBwEUdGEeQKQ8wBFViTFkeiddQK/iwBJtTEFULE3eQGWWyB9DjbF0pXseQ5lBuBxu9pFk9ENeQ2CdsBZKCSF0gSeeQN2vtBNnpZFEYZpfQaFZvBhWYxFkfCZfQmQBrBdbS/FUuA+eQvscpB1FxnFUZZRfQCoDpB5RbCGU/gBgQB03qB9ZwxFUmeMgQXIVsB50tDGUsIDgQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LscT1B5lFxEECNFeQ0AH4BRedpEEVdHeQik65BZ/g2EEttleQeN76BNFqHF0fQaeQ1dY5BJ4moEE3vadQMnA4Bt5RZEUcU7cQRrM4BxcFCE0R4HdQeI25BVIU5DkFzhdQuEt2BNsWrD0a12cQ5O5zBRuanE0jGReQXmE4BZoHZE025TeQLwa5Bhaa4E0TZMdQTAd7BVNcjE0t2ddQuJ61B9FodE0iz4cQMA64BFmabEkS5bcQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LfAe6BxrttEU3pLfQ4bM8BFAI4EEMTrfQ7VD+BllknEEPAAgQbFu9BtCSUEU0S5fQpSj6BFahDFkkwGgQdwu4BBZqVF0+h9fQCqM6B9F0oFEDtufQ5bW4B5Nz5FE2VjfQxvL3BRMM8FUEZ8eQdbq3BdznuF095ceQdvh1BhYOGG0k71eQXqo5BBlMfE00PTfQzVc9BdM2DFkgCbfQnvS5BBnW4Ek/ROgQj137BRGDKFkx9SgQEse3BdW9PFUqijfQZIc3BlQraFkV5LgQvSe7BZInuFkQPEgQuEb7B93KlF0UDTfQRP63Bl4WCG0kL6fQtv74BxkshF0ZYgeQwTx2BpwewFEC6/dQokJ1BVvdLGUlzNfQfhp0BhvNHGk7GZeQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LVoDAC1c5uEEMRLgQmV7ACFDofEUnEWgQGtNBChPimEEFvsgQ2yNBC5So5EEUyxgQCxQCCR8AdE0xMKgQliKDChzCxEE4vJgQa9bEC1YatEUmb6fQ3WhEC9lPdEkQglfQbfVFCleq6E0Kj8fQQWNACVuy+E0PFNgQTnbACNgIQEkD3WgQeR1CCdjHQEERuRgQCRECC1PPYEkcczfQuVnCC19S+EULrCgQjWbDCxcc1EkRHagQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LcUeBCNhwWEkdK6gQHq4BCN1zZEUnKQhQu8YDC9QAbEUcTRhQ1mFECtvmMEEKyJhQ6+VBCt/MIEkjrehQve2BCR5gJEk7x1hQphhBCNsceEUePAiQppYAClhikEkIjAiQ1zcCCVmDpEEX6GiQ1GbBC1bbHE0Oj0gQS/eBC5YBpEEY0VhQUrQAC5G1IEksvehQO6oBC5CoxDEXSYhQoLZBCtqg5DkOA/hQlH7CCZTyGEkCB2hQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LcI5DClATsEkKcahQifUFCxycvE0NrbhQEA/FCVJ7hEkcLthQszJHCVdYcEk3BrhQ5wmFC98IHFU6kfhQRCHFCdFmWF0csNhQxi0FC1htTFEnS4gQmhXFCpV6kF0jZogQkmAGCNbdiFkOETgQv8QDCltp3EkTPghQJiwFC5dnqEE8eMhQPeJFCd+BMFExuuhQXmrGCVzZJFUMShhQD1CECRBzTFE4DLhQ88OFCthAnFEA5ShQlq5GCd4rUFUGf6gQFukFCllHEFUvaxgQzVSEC1F6jFk1cmgQ98nFC54n0F0p0ugQU7rFC5qFuFEMMJgQeoAHCZGkjF0qrUgQJqwFCdHsTF0ZgMgQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LaLRFC17ncE0Ji+hQDX5FC9UuQEE4HQiQfCHGCxHXyDkOFMiQV8KFCNyoaDE9XHiQvcEFC5kuSEUCLliQVfEFCNY7pEUlusiQLOnFChbcDEEbw2iQD9GECNANvEUZo+iQ6KSEChURhE0M7/hQHT4GCNeeXE0NBTiQQ5BECNXjOEklvhiQfbEGCpjvtEk7PyiQT20ECh9O0Ek6KfiQLKBFCtwyEEkHGFjQWJkFCpv8lDk2dxiQFlpGCZ9fHEkjc6iQ/yNEClLHAFkpdCjQJxFDCdF+rEkAS5iQLwUECRz4lEUawMjQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LfEWHCpRPkDkatPiQbapHCpK32CUODOiQTRiHCNTYkCU6ZkiQkZJICtXw0CkDdziQsKEJClW8tC0CcFiQXPNJCJBSBDUG2uhQLJUJCpvt3BUnQFiQv0nKCJydCDk9RmhQ4lFICZvJ6DkDGTiQwb6GCJXRnCUFxDiQSPzJCp9j9CkkrPiQLAnICxQLvCEeAkhQzA1ICJgNiDE4MvhQasTKCRvdpBUOY/hQ+aOJCFkpdBE6VViQ3zkICF0tYB0A86hQJUnKC1P+QDEebWhQbbPLCJQzVDED/whQHHCLCNodiCEbKlhQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
L9euGC1ZYDCkw3miQbPlGCtadgB0S/7iQXedHCRG8RA0g19iQ7+THC9Nwo+zgnxiQ5SHFCZ6vLBkY6AjQ9HIECR27MCUL/BjQGzsCCd4d5BkynFjQqWhECFT4qCEkUUjQTzPGCdruuBEgmZiQSS8GCZ9tGCkE4HjQ7XwEC5LPiA0oV0iQv+DFC5vVpA0bFQjQWFKECFDeeCEK2yiQ8GBCC9w5XCkNTGjQMZaCC5tIQBUok4iQEhpCCNuLWB0IrUjQaw0DCxThFDUwzUjQlueECd1iZC0SZjjQjOhFCBgY3CUWASjQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LWFZICpgLVA0wJNjQ5eXJCdzZi+TFSQjQAsHJCVZfN8TLUljQXmDJClT8X+DUN2jQ8szKCtBbp/jhwQjQpP0LCtZBn8zo0TjQq/FLCxaWnAkyo8iQjhbIC9lqJBEPpWjQq5RJC9KwP8TfPDjQEt6KCVrGfAkteejQ27zMCBJHG+jVXUjQ60nLCJpYv3TMmijQt+uLCluDh0rcYGjQv7GMCVkrABE4d9iQ2FALC1Ty+/z3GviQG0YKCdRRcB04R7iQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
L4CAJCZxbD9bxGkjQxrxIC53ZK/LkJ3jQ+hcJClW+7AsTI1jQ4qCKCJxjQBMTokjQ5pTHCRQng/b0C8jQveqGChewhA8bssjQ13CJCp9IY+b+JVjQVfOJC11FJ+bkyEkQgGMHCVHTOAM9pLkQ0C1GC5uFH9bn88jQXCyFCdPbtA8YAzjQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LBbaJCBOctB8NUGkQfPDKCVuagCMbXGkQNGVJC9exCDs3S5jQDkGICZe6GDcBa5jQusMKCFeawC8OKdkQzYDLCJyAWCM1QpkQZc6ICxsqaBMjjTkQ2KDLCR+fcCs5u/jQaCOJClElxCskqkkQfmlKCJIGRDsI5ckQnRMLCVqFlCc/i2kQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
LozIKCVX6cDsk4ujQQduJC16gBE8QYjjQ2XhJCJpWTEcEwzjQDYFKCJFfSEc8RFkQILwKCFGkHEMGrSjQC8HLC1wYVDMGGvjQFVxICJRz8D8CibjQzFbKCF53VEc5RKjQe03KChpB1Ds5WHjQYusLC5GqKEs8eajQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
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L4EEHCZRVuGkiT4kQ4EEICZRVuGkiT4kQ4EEHCZRV2GkiT4kQ HKH_2021_1IRA_run_1_complex.420_chain_B_3_0000300003_0000001_0
SCORE:  -1423.731  -2658.705    289.375   1702.304               -150.350                 49.953                105.737    898.484       -972.978            -5.713                 -36.018   -926.070         -143.550        -79.820       -239.851       -118.325     -67.765       -6.566                   35.056      9.764        36.567       232.265        422.578   -114.146      75.367   -101.507       0.000         52.264        287.919  10437.000 HKH_2021_1IRA_run_2_complex.1644_chain_B_23_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.1644_chain_B_23_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.1644_chain_B_23_0000100001_0000001_0
RT -0.183621 -0.202246 0.961967 -0.911294 0.401923 -0.0894475 -0.368546 -0.893059 -0.258108 -30.0799 -29.5199 -22.2553   HKH_2021_1IRA_run_2_complex.1644_chain_B_23_0000100001_0000001_0
RT -0.259511 -0.840792 0.475102 0.957843 -0.286871 0.0155168 0.123247 0.4591 0.879794 -11.1071 -2.64472 -10.5096   HKH_2021_1IRA_run_2_complex.1644_chain_B_23_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.1644_chain_B_23_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.1644_chain_B_23_0000100001_0000001_0
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