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:  -1508.920  -2650.992    281.084   1693.440               -151.642                 48.951                108.301    881.903       -969.179            -5.916                 -36.790   -924.044         -150.658        -80.971       -239.608       -114.967     -61.545       -6.073                   26.007      4.020        33.111       222.651        417.026   -115.034      74.301   -101.507       0.000         44.115        265.094   7692.000 HKH_2021_1IRA_run_2_complex.282_chain_B_7_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.282_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.282_chain_B_7_0000100001_0000001_0
RT -0.664787 -0.387631 0.638593 -0.673127 -0.0599021 -0.737097 0.323974 -0.919866 -0.221102 -28.63 -13.0322 0.209008   HKH_2021_1IRA_run_2_complex.282_chain_B_7_0000100001_0000001_0
RT -0.12946 -0.73453 0.666113 0.96257 -0.254408 -0.0934617 0.238115 0.629081 0.739972 -10.6323 -2.54354 -12.237   HKH_2021_1IRA_run_2_complex.282_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.282_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.282_chain_B_7_0000100001_0000001_0
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LvYoECl6EfH0MsllQQsgFClByZHU0bWlQ/5rGCR9SgHU5rOlQ5jqGCdHFqH0OxNlQUwvEC9HgWH0JNClQX8pDCB2EPH0hKGlQUNYCChmxSHUcYIlQ+C5DC9BXEHEiMIlQK5WBChE8LHE6gMlQyk3CCBUi9GkCgMlQAemBC5pUBHE+oOlQWUQECJFdmHU9zhlQqV6FCdtxSHk/DelQr6VEC9RodHUof6kQLRcFCJlySHkNA3kQHgLCCFcWbHU9AHlQSE6ECNgXBHk3cGlQITWACFGEPHE2VOlQj/DDCt8D1G0HROlQIuyACZS77GkcFSlQ HKH_2021_1IRA_run_2_complex.282_chain_B_7_0000100001_0000001_0
L8AuHCBiyaHEfSIlQtY0IC9w2fHkXd9kQhVfICZ3SeH0GHmkQxh8HCNs7VHkHJgkQLEHKC55laHUvEDlQKIhKC1ZBcHUDiZlQ1GJKCZbfUH07aolQTCSLCl7tkHkaeflQGFiKCVgmVHE0F9lQ0wqLCVW2lH0gY0lQS2SLC5jTeHktMDmQ1urLCpoVfH0EMYmQDhuHCtNvSH0vOKlQbj2ICltYoHkJFBlQqO/JCZ4KSHk6NAlQ5a5KCRjjdH0ku4kQh1iJCdelNHkwmjlQk+kLCJSrqHkWoTlQedQKCZ1sPHkNjImQzSRMClBqsHUkL5lQIVOMC5aplH0jyZmQ HKH_2021_1IRA_run_2_complex.282_chain_B_7_0000100001_0000001_0
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LqRyEC58npGkczykQqRyFC58npGkczykQqRyEC58nxGkczykQ HKH_2021_1IRA_run_2_complex.282_chain_B_7_0000100001_0000001_0
SCORE:  -1477.232  -2640.598    283.101   1699.486               -153.222                 49.456                111.180    880.946       -971.613            -6.049                 -38.730   -927.448         -151.814        -78.763       -238.890       -111.450     -58.418       -6.150                   25.425      5.319        33.049       224.972        420.337   -113.253      75.496   -101.507       0.000         44.428        267.481  14967.000 HKH_2021_1IRA_run_1_complex.1660_chain_B_10_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.1660_chain_B_10_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.1660_chain_B_10_0000100001_0000001_0
RT -0.70738 0.702813 0.0752844 0.495834 0.569302 -0.655777 -0.503748 -0.426555 -0.751191 -34.4856 -21.2723 -14.1433   HKH_2021_1IRA_run_1_complex.1660_chain_B_10_0000100001_0000001_0
RT -0.0818782 -0.842079 0.533104 0.988072 -0.138583 -0.0671466 0.130422 0.521247 0.843381 -8.14649 -3.23691 -12.6701   HKH_2021_1IRA_run_1_complex.1660_chain_B_10_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.1660_chain_B_10_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.1660_chain_B_10_0000100001_0000001_0
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LJRMICB5nKHERc2lQUNMICljjUHUwfqlQlS8HCt6gdHU/P6lQyGzGCFMsfH02TAmQAtGHCpNAUHUnbZlQxnMHC1C/bHEtSIlQsKSIC5MnbHk8v6kQI7NGCxvjjHU62ElQd+ZICl+jiHkwZqkQzDWGCZNtqHEfJ0kQqjcHCxAIqH026mkQphiHCZViJH0LnCmQOzKJCtFxVH0CKjlQSvHHCBrQMHkBeSlQVkIGCZk6UHEAFhlQ3hDJCJkiVHUHV9kQMYWFCly1jHkqfPlQX9QJCBYCiHUtHgkQnFlFCloxwH07XxkQWijHCR1lvHU6tZkQ HKH_2021_1IRA_run_1_complex.1660_chain_B_10_0000100001_0000001_0
LARBJCl+ViHk/0BmQ+/5ICB8NqHU16SmQsmWJC50P1H0ivMmQQhhKClIF3H0t4HmQINsJClbfmH0wbmmQRWxJCFGQuHUSY5mQ/KdICJoIwH0lXEnQda0HCxkyoHk37MnQ5UCICNFH6HkYOEnQ/67JCR2PgH0Fq7lQE72HCJywqHEegXmQNJQJC9NHfHkINsmQnQtKCBF4kH04ihmQ6wcKCxE6qHUPJFnQ/WKKCxL51HEcD0mQtGLHC5NI8HEIRLnQ+wnIC9t7/HUY98mQ HKH_2021_1IRA_run_1_complex.1660_chain_B_10_0000100001_0000001_0
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LuhzKCNXeIIkVQPmQ6u0LC95nKI05PdmQPvLLCZalOIUpbsmQRbtLCNcjPIkGt9mQkKZKCRi2RI0t1kmQsR8MCtEUNIEKiQmQ8X6NC5JbJI0FQFmQNG8NCdAvEIUQFKmQgspOCFsTLIE/h3lQNc1KCZsKJI0UI/lQY6PMCpyWHIkXnmmQJPfMCpT2PIkbQEmQUOgNCt07PIkZBbmQ HKH_2021_1IRA_run_1_complex.1660_chain_B_10_0000100001_0000001_0
LyQ5HCpWbsG0qhqkQyQ5ICpWbsG0qhqkQyQ5HCpWb0G0qhqkQ HKH_2021_1IRA_run_1_complex.1660_chain_B_10_0000100001_0000001_0
SCORE:  -1486.480  -2684.190    298.320   1713.936               -150.779                 48.578                106.363    901.174       -980.808            -5.754                 -35.845   -930.710         -156.142        -79.475       -241.664       -119.155     -65.651       -6.217                   39.956      4.419        35.483       217.441        424.915   -117.315      73.578   -101.507       0.000         52.886        271.681  10012.000 HKH_2021_1IRA_run_2_complex.141_chain_B_11_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.141_chain_B_11_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.141_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_2_complex.141_chain_B_11_0000100001_0000001_0
RT -0.224914 -0.508006 0.831471 -0.864962 0.496978 0.0696664 -0.448613 -0.703522 -0.551183 -19.5688 -35.4677 -12.4008   HKH_2021_1IRA_run_2_complex.141_chain_B_11_0000100001_0000001_0
RT -0.20491 -0.763636 0.612268 0.937903 -0.332083 -0.10029 0.279909 0.553698 0.784264 -9.41028 -2.96907 -12.5354   HKH_2021_1IRA_run_2_complex.141_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]FAKNTHGIDAAYIQLIYPV[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.141_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_2_complex.141_chain_B_11_0000100001_0000001_0
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LOgbHC9auoGUBM1kQOgbIC9auoGUBM1kQOgbHC9auwGUBM1kQ HKH_2021_1IRA_run_2_complex.141_chain_B_11_0000100001_0000001_0
SCORE:  -1476.318  -2669.566    286.005   1705.533               -150.730                 47.979                106.537    892.698       -975.088            -5.621                 -34.699   -929.943         -148.141        -77.334       -239.646       -123.196     -56.577       -6.453                   27.686      7.205        32.330       227.656        418.152   -112.131      75.061   -101.507       0.000         51.281        276.190   2761.000 HKH_2021_1IRA_run_1_complex.354_chain_B_6_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_1_complex.354_chain_B_6_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_1_complex.354_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.354_chain_B_6_0000100001_0000001_0
RT -0.289335 0.234139 0.928151 -0.665757 0.647472 -0.370873 -0.687788 -0.72523 -0.0314567 -30.4195 -21.0117 -35.5412   HKH_2021_1IRA_run_1_complex.354_chain_B_6_0000100001_0000001_0
RT -0.242018 -0.888357 0.390191 0.949763 -0.299148 -0.0919813 0.198437 0.348328 0.916128 -13.9167 -1.96365 -8.87   HKH_2021_1IRA_run_1_complex.354_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]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.354_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.354_chain_B_6_0000100001_0000001_0
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L0j+CC1b+hG0jztlQ0j+DC1b+hG0jztlQ0j+CC1b+pG0jztlQ HKH_2021_1IRA_run_1_complex.354_chain_B_6_0000100001_0000001_0
SCORE:  -1483.604  -2634.332    278.817   1683.497               -152.073                 47.975                108.682    884.321       -965.050            -5.542                 -34.366   -915.746         -151.956        -78.862       -238.062       -115.981     -64.295       -6.309                   29.466      4.012        32.008       226.672        416.518   -115.209      74.532   -101.507       0.000         47.292        261.894   6985.000 HKH_2021_1IRA_run_1_complex.611_chain_B_5_0000300003_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.611_chain_B_5_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.611_chain_B_5_0000300003_0000001_0
RT -0.398718 -0.622125 0.673784 -0.720638 -0.241857 -0.649758 0.56719 -0.744625 -0.351894 -23.1464 -20.1113 0.476496   HKH_2021_1IRA_run_1_complex.611_chain_B_5_0000300003_0000001_0
RT -0.234105 -0.735296 0.63603 0.938955 -0.340646 -0.0482075 0.252108 0.585918 0.770157 -9.34851 -4.5579 -12.2282   HKH_2021_1IRA_run_1_complex.611_chain_B_5_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.611_chain_B_5_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.611_chain_B_5_0000300003_0000001_0
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SCORE:  -1488.361  -2660.669    289.182   1700.584               -152.388                 48.704                108.529    887.031       -972.301            -5.947                 -38.026   -932.125         -150.074        -79.418       -239.591       -123.147     -59.973       -5.905                   34.374      7.561        36.421       223.649        414.992   -113.630      74.691   -101.507       0.000         41.249        279.370   2901.000 HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_1_complex.482_chain_B_13_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.482_chain_B_13_0000100001_0000001_0
RT 0.313316 0.00988524 0.949598 -0.947288 0.0737264 0.311786 -0.0669284 -0.99723 0.0324638 -25.3969 -31.7867 -9.17932   HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
RT -0.270436 -0.759608 0.591489 0.930085 -0.364792 -0.0432316 0.24861 0.538444 0.805153 -9.86908 -3.75154 -11.8483   HKH_2021_1IRA_run_1_complex.482_chain_B_13_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.482_chain_B_13_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.482_chain_B_13_0000100001_0000001_0
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LP9BGC5ciOHkvQhoQGS6ECtC/KHU24noQBwnECZYD/GU8rmoQWOKECxY05Gk4IuoQ57pDC55YRH0rVloQHOaCCds/OHk8SsoQiJkCCNgbSHEu13oQ3gaDCZD+YHk795oQpq0BCVfpOHELc+oQ4d1FCRvaSHEhNaoQhzKFCxafMHU5OwoQNP5DCxXsZHkNemoQdnZDCVAWQHUEHdoQz3jBCl9NTH0F3ooQSuLCCZffGHEO/roQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LpG0ECZFx6GkABdoQ8/bECdAuvGECxaoQKp/CC93FvGEsuWoQboYCC9ekmGEsrWoQ0KPFCZjL/GEvIXoQhPHFCl9ZsGklxUoQ5CjECJW6qG0J/hoQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LV6cCCpMW4GU9sToQJ5FBC5Io5GEakPoQJZ8ACxrT3GkqhDoQQd2/BRx/yGUaGAoQ0TkACFU/EH0LgSoQSNTBClFIOHEWPMoQP/I+BNggFHkgTQoQL+CDCNyy+GUxXUoQ6edACpv6zGUQ0ToQrJwACRlSGHEC9aoQqx5ACR10VHkn3OoQ1KXCChx6NHUrxNoQ66IBCh7ZNHEM1DoQWaY9BlxUNHEQpSoQD2v9BFzPEHEF0HoQ0CI9BpeU/Gkt6UoQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LQA8BCZri6GkMV6nQM/9BCpWU5Gkv+inQneXDCZws1GUB1cnQnLVECtnY4GUS9nnQmKoBCF/vDH0BYXnQ64MACF0KIHEqaanQEA19BppXAHEyTNnQ/FS+BZ+SDHUXOxmQZcvCC1e79GUQpAoQx7QBCJgHzG0FFenQxCVCCdW6JHUcJcnQaHxBCBnaCHkhjGnQN36/BFDcIHU7IrnQBBKAC1MSQHkKMUnQv6y8BZIA/GkQ0nmQ1VD+BRB3LHEqgumQELIACtz1AHUeKsmQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LoifDCdX1vGU9PLnQQZzECdDJsG0OfEnQQTaFCNJXzGUqhzmQqj7ECd8zzGUHchmQGYrEC5wwgGUg/6mQZACGCRcgcGEMozmQJaDECZ+aZGEI6KnQbNqCCJC2tGEviCnQShdFClF9rGUeYSnQNtCECRdHhGEYEtmQ164FCtwjUGEM0smQNQdGCxDuhGEWdnmQ2GtGCBY/bGkPNBnQTg8DCR/mRGkMoDnQ1brECZA4YGELDZnQHoEDCNfbcGU7NPnQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LifhGCJVj4G08A5mQYaNHCp15/GUnbqmQCAZICNcY6GERKgmQsVEJChe0+GkLUSmQOuxHCNIlJHE9h2mQy6vIC1g7FHUZ0FnQ/FsGChmZPHU89BnQ0G4GCVS33GkpLInQCVhGCZafCHUZ/dmQ+4QICNI5OH0hOrmQmUVJCNU0LHUddJnQLqGHCpVJWHUxTKnQe2+FCpAJSH0ea2mQdnMGCl1HKHUpWNnQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LT3nIC1GywGUp0nmQ2CuJCNS2pG0aUimQnMcJCl+tiGUHHPmQ8LeIC5ihcG0JYPmQYS/JC5vNjGEbG2mQHCgKCdodpGUFyInQ6FpKClgViGkQ/bnQqNYLCJg5nGUmQunQftkKCB1xwGEcS4nQuD9HCVXNuGkWrymQOqlKC9xyuGkRiemQ1MEJCVAhfG01H7mQaCqKCZAFdG08nymQcTeLCtY1sGkKqEnQtQ0JCht/vGE3TMnQTgpJCdyFgGEbmhnQRJKLCF+GbGU7ZXnQdJnLCxm/hGEiN6nQn4TMCFbNrGUDIonQxhGLCZ1K0GUNICoQR8WKCl/a2GkKOtnQKmtJCto0tGEHT+nQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
LEHTKCh0mjGU6o+lQEvJKC1xwdG0iiqlQwLYLCJhOYGkLBhlQpBiMC1tnbGUS7ilQ3DpJCF1RlGkh5YlQypUICdXGqGUyLdlQfyOICF26zG0MomlQGqKHCx0zkG0RBYlQfNBHCt7V4GEr1qlQA98FChKMpGUuaclQmI4FC5G/yGkS1llQ6EDLC59FpGkAw/lQlNbJCZpkXG0ARtlQjNXKCh+trGExoWlQGQlJCJz3gG0g1JlQANJJC1KN4Gkv8qlQ1sOHCR5AdGkcZQlQaT+GC9qIAHEPcylQt5CFC5z3kGkjdYlQyg6ECZdf2GEtWplQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
L1SFLCpV9PGUhnUlQyFCMC1p4KGUXPGlQu8AMCh0gRGEhCykQMe7KCFUvTG020pkQbplLCpfQ/F0HOAlQyodMCtIs0FUdrvkQplmNCVj2pF0Wf1kQsJHMCJ3N2FEFOakQwGYOCh+QgFEkEmkQUj4MClCysFkW8KkQjyAOCBrohFUn1QkQyZyOCB0tXF0MlBkQAhHKCJNVNGEtXUlQtMCNCxjBLGUXDNlQm+jLClUI1FUxYOlQZwkKCB33/FED65kQZr4NCBGqoF0oGGlQoeNLCtt5+FEZiVkQbhRPC9WgXFkzlqkQBRmMCxc7tFUDM6jQnhhPClplQF0XZIkQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
Lo+KNCxzlUGEKcpkQ2FHNChLuaGEuoVkQ+zWOCRcrYGU2EIkQHkdPCBpicGEnzMkQse7MCN/hmGkpMbkQQHeMCZeftGkRjJkQQPRLCFkPrG0UcAkQmgJNCJwd2G0a8CkQDcvKCF0exGkrJxjQPznMC9W88GE0PzjQyrZLCp9W6GkWZqjQsgDOCR+tSGEpVwkQ2NQMC9T/XGUMfMkQtFNMCR3NnGUbJokQ5d3NCtSqpGECChkQqouKCJTRkGUe9FkQB9EOCBBb4GUNVKkQyiyJCBdWvGUTiqjQ3BKNCRmFEH0gAujQjX9KCdiV/GElKejQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
Lh7LOCVFMSGEzX3jQycVPCpxqOGkCkqjQZ+KPC9oWPGE+hSjQFsOOCxf/KGUuRJjQ7JtPCB0LDG02jwjQHQ0QCxgs7FkNNjjQAUMSCFxwCGkAtljQVcuSCtu1DGkia3jQMKySCdZvFGkoiTjQQ7ONCp2iPGk9F0jQggLQChhwTGE3vujQBu+PClGyCGUVaBkQBL1OCRbn8Fk7RujQhw4QCVfIrFk8aojQQNjQCNPA8FEbVSjQ71sTCdW+IGkFwTjQinSSCJgpEGEHGFjQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
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LoQePClSCKGEI8UiQtIgPCpUaAGUMmHiQbD6QCdCC8FUxY/hQmATRCtNXpFUyW+hQ+AaRCpsrEGktUzhQcKkOCx4YBG0MI0hQ6HCNCJz//FE5V4hQ3RoMCdNl5FEqbJiQUpRMCdC+BG0BaphQr3zOCZrBQGkwbRiQVGLPC9/UzFU+TRiQxetOC5TSJGUtBthQYe3OC5mF3FkoJohQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
Li1yGCpjAuGUvDClQi1yHCpjAuGUvDClQi1yGCpjA2GUvDClQ HKH_2021_1IRA_run_1_complex.482_chain_B_13_0000100001_0000001_0
SCORE:  -1483.849  -2647.615    280.951   1690.358               -150.894                 47.623                105.859    890.796       -968.262            -5.732                 -35.791   -916.143         -142.280        -75.605       -242.434       -110.139     -71.185       -6.501                   25.680      5.134        31.524       226.136        413.585   -112.684      74.379   -101.507       0.000         47.113        263.787  11098.000 HKH_2021_1IRA_run_1_complex.192_chain_B_6_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.192_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.192_chain_B_6_0000100001_0000001_0
RT -0.322233 -0.440677 0.837836 0.93929 -0.0386075 0.340946 -0.117901 0.896835 0.426364 -32.1266 -2.52058 -38.8235   HKH_2021_1IRA_run_1_complex.192_chain_B_6_0000100001_0000001_0
RT -0.12688 -0.908476 0.398213 0.972796 -0.192415 -0.129016 0.193831 0.37101 0.908175 -11.8542 -2.87027 -10.2821   HKH_2021_1IRA_run_1_complex.192_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]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.192_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.192_chain_B_6_0000100001_0000001_0
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LSEugBB+XRGEzmukQSJdgBJoDMG0OcDlQtu4fBFr//FUaLClQzb4cBB7h4FURV0kQZracBhIWRGUSUQlQ8WHcBts2NGkYmnlQTLIYBF79TGUiO0lQqR8VBhVgbGUo5rlQkdKXB9OBRGUkOGmQDpbeB9LGWGESSpkQOMUiBh2NNG0+OMlQzkxcBdZ3ZGU1uPlQKQmYB1qTPGk7BJlQtNCbBtObFG0cZolQ+RCgB1byOGkN1ulQ HKH_2021_1IRA_run_1_complex.192_chain_B_6_0000100001_0000001_0
LMzNhBda9zFEmsQlQ77ugBZL7cFEiPTlQ5x8bBhtlYFkYqclQXeVZBhAFJFkGfWlQTdCbBBjBgFk3fulQ/i1iBlJHSFUmchlQ4HnlBd08NF0cCXlQQs8lBBH9PFUxvDlQfPZnBtezHFEj+ilQbMiiBRUe7FUcwalQbBzgBN/VVFkFrDlQSCKjBNNMcFkxhvlQEvCiBxg7CF0UKnlQ HKH_2021_1IRA_run_1_complex.192_chain_B_6_0000100001_0000001_0
LmC3DChTBsGEZqSlQmC3EChTBsGEZqSlQmC3DChTB0GEZqSlQ HKH_2021_1IRA_run_1_complex.192_chain_B_6_0000100001_0000001_0
SCORE:  -1452.811  -2663.748    292.874   1720.298               -150.843                 48.477                107.707    897.813       -979.923            -5.543                 -34.263   -948.102         -149.655        -80.768       -235.501       -111.661     -65.413       -6.544                   38.543      6.999        36.104       220.976        420.651   -113.499      74.462   -101.507       0.000         50.394        278.861   6143.000 HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_1_complex.425_chain_B_3_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.425_chain_B_3_0000200002_0000001_0
RT 0.925079 0.377811 0.0385811 -0.367788 0.865921 0.338987 0.0946646 -0.327779 0.94 -11.7525 -33.4576 -27.141   HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
RT -0.172511 -0.810623 0.55958 0.975645 -0.218763 -0.0161283 0.135489 0.543169 0.828619 -9.76402 -2.07293 -12.0127   HKH_2021_1IRA_run_1_complex.425_chain_B_3_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_1_complex.425_chain_B_3_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.425_chain_B_3_0000200002_0000001_0
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LBK7sB9srMEU2sPcQPbptBhBbPEE/b8cQufhvBxQYiE0vUBdQ5HFxBt1OnEUXfkcQKP+uBpRQ2DEhpNdQ8A4sBJW9GD0AGKdQHmYuBN+1KEUHZ5bQx71rB5SmSE0CuOdQjC0wBJGAwDEE67cQr+gvBRf56D0QEvdQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
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L4hgCCRkvTEELsjgQ6MDDCJppbEE453gQeUjECJmXYE0gc6gQHsJFCFU1KEk9wvgQobQCCR/dSE09ZKhQcb0AC1o7ZE06+JhQ12wACFEYxEEVrMhQQnqBCBlx5EEhjWhQG1s/BhcO7EkW3EhQlkUCCZttDEEc6hgQ8e5CC944sEUyL4gQHeRCCBHCBE0CqJhQsBtCCNRTXE0nPZhQyYZACVW9VEUMr6gQPBPACVCLSEEPZWhQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
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Lo06HCNNDaDUzVJiQaB3HCxTirCkynJiQ+aOIC5+pYCU2KfiQz+ZJCR15TC0wLkiQgCzICpIMYC0bi4hQj4XIC1C6pC0ldihQZYwICxGFLB0wc5hQmfRJCFv5dCUyBQhQ8JwICJJppDkHKOiQBm1GCNrkhC0JCGiQaL0JCZY9iCEyd7hQAKXHC58YfCkRbfhQSpXICVFrMDkIMjhQZiaJC1ayvAkQithQKgEJC1swzAEbFJiQUOwHCx6/1A0Qf2hQl34ICl+dsCU6aBhQf9RKCtKwpCUSHThQYSTJCB+B3BEVCOhQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
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LVaRJC9XBNAEG0JjQzXAKCJi159TKgLjQn2jJCtGJc6TuCgjQdzoJCdP1p9TZJxjQVygLCN3xe+zDTMjQo5PMCxBMo17ZkOjQcT8LCdJW7/Dkd4iQSSmJClol/AU+fSjQKgxJCBCVy6zB69iQDEvLCxgns/jWJajQcpTNCRPeC4jlUPjQ547LCpEIO8LmAdjQ8fBMClnQv8r21AjQC0ANCJSGKAkmQ5iQVguLCdmSu+jO7qiQ18ZLC5zc6A0sG3iQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
L/GFJCBNmr9LW6djQnnkIC5GxZ/r+1vjQm9YJC1PW9A83WyjQ32EKClbQYBsHZjjQPBIHCdwmGA8tmsjQSbRGCVZDA+LOOrjQqjEJC9xfn+7uuOjQZCqICh5OO+r2c+jQG8CHCxZPrAs2HejQ9gzGCJL/vAMjp5jQhRYFChpFx+72wojQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
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L+1LKCdrAZDMOmxjQFCzJCFqY/DMF/ljQCmhJCFrVREcBP2jQznCKCNlmQEMXIIkQg73KCtyOGEc2NWjQn/KLC16zRDc6iyjQpy3ICRc94DMwSdjQhyjKCB8lUEcOuNjQWCDLC5J1yD8r1KjQQTyLCF4bJE8U3ejQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
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LdfwGCFBkbEMxuLkQ6lyFCdZhSEcUhakQg8gECJSaMEMDAPkQpzfECtyXJEMlc7jQY1UGCBek+DsonmkQCedHCRRVEEscE1kQ6RsHCtv1mDsUSElQm7PHCtIRDDcNUAlQVBRICdZGwDcMzUlQ1W7GCFQxTE8019jQyKiFCpjpeEMBYmkQUwqGCZBemDMyNbkQ2rhFCZERwDseEwkQ31RHCR82SE8+V9kQoyWICp8gGEs7UrkQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
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LsamGCNToiGkYoAlQsamHCNToiGkYoAlQsamGCNToqGkYoAlQ HKH_2021_1IRA_run_1_complex.425_chain_B_3_0000200002_0000001_0
SCORE:  -1413.852  -2720.423    313.439   1741.355               -150.366                 49.991                103.922    909.518       -996.169            -6.103                 -38.837   -932.920         -144.681        -80.349       -232.819       -113.203     -69.097       -5.861                   41.142      8.581        40.243       228.670        422.352   -115.612      75.209   -101.507       0.000         56.946        302.725  11916.000 HKH_2021_1IRA_run_2_complex.129_chain_B_8_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.129_chain_B_8_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.129_chain_B_8_0000200002_0000001_0
RT -0.650932 0.265697 0.71112 -0.318611 0.754633 -0.573599 -0.689039 -0.599945 -0.406561 -37.6912 -28.5858 -16.0945   HKH_2021_1IRA_run_2_complex.129_chain_B_8_0000200002_0000001_0
RT -0.0476525 -0.826138 0.56145 0.994857 -0.0895533 -0.0473346 0.0893846 0.556307 0.826156 -10.5571 -3.37746 -10.6445   HKH_2021_1IRA_run_2_complex.129_chain_B_8_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.129_chain_B_8_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.129_chain_B_8_0000200002_0000001_0
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LIdiGCBQutG0y7RlQIdiHCBQutG0y7RlQIdiGCBQu1G0y7RlQ HKH_2021_1IRA_run_2_complex.129_chain_B_8_0000200002_0000001_0
SCORE:  -1476.849  -2667.687    294.244   1693.091               -149.984                 47.692                104.163    888.695       -974.782            -5.374                 -34.373   -914.908         -144.961        -79.237       -239.169       -123.165     -59.818       -5.554                   32.666      4.696        30.045       219.206        414.572   -113.601      74.765   -101.507       0.000         57.454        275.984   7093.000 HKH_2021_1IRA_run_2_complex.739_chain_B_14_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.739_chain_B_14_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.739_chain_B_14_0000100001_0000001_0
RT -0.382654 -0.714061 0.586253 -0.923818 0.303705 -0.233072 -0.0116201 -0.630778 -0.775877 -26.08 -22.7354 -7.7105   HKH_2021_1IRA_run_2_complex.739_chain_B_14_0000100001_0000001_0
RT -0.200176 -0.812179 0.547992 0.964984 -0.260204 -0.0331491 0.169513 0.522168 0.835827 -11.3166 -2.26125 -12.0378   HKH_2021_1IRA_run_2_complex.739_chain_B_14_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.739_chain_B_14_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.739_chain_B_14_0000100001_0000001_0
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SCORE:  -1470.666  -2647.980    285.880   1718.637               -154.060                 50.824                113.308    901.108       -976.538            -5.370                 -33.623   -958.344         -154.697        -80.358       -237.925       -117.454     -68.203       -6.084                   28.529      4.934        34.736       232.287        421.785   -115.352      75.248   -101.507       0.000         46.868        272.683  10616.000 HKH_2021_1IRA_run_2_complex.290_chain_B_10_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.290_chain_B_10_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.290_chain_B_10_0000100001_0000001_0
RT -0.796351 -0.0458778 -0.603093 -0.602746 0.143002 0.785014 0.0502289 0.988658 -0.141533 -23.1288 -26.0228 -34.06   HKH_2021_1IRA_run_2_complex.290_chain_B_10_0000100001_0000001_0
RT -0.299357 -0.914646 0.271676 0.936153 -0.336584 -0.10163 0.184397 0.223907 0.957007 -12.6086 -2.65654 -10.9031   HKH_2021_1IRA_run_2_complex.290_chain_B_10_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.290_chain_B_10_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.290_chain_B_10_0000100001_0000001_0
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SCORE:  -1475.905  -2644.284    280.138   1708.285               -153.178                 48.982                109.800    899.643       -971.842            -5.664                 -34.547   -930.015         -147.452        -77.542       -239.073       -126.027     -65.796       -6.472                   25.055      3.701        35.860       230.858        417.506   -115.691      74.067   -101.507       0.000         42.844        266.442   5426.000 HKH_2021_1IRA_run_2_complex.514_chain_B_7_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.514_chain_B_7_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.514_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.514_chain_B_7_0000100001_0000001_0
RT -0.743824 -0.630652 -0.221369 -0.643749 0.586906 0.491048 -0.179757 0.50776 -0.842536 0.114899 -36.9262 -28.3442   HKH_2021_1IRA_run_2_complex.514_chain_B_7_0000100001_0000001_0
RT -0.185992 -0.883712 0.429487 0.969358 -0.236427 -0.0666874 0.160475 0.403924 0.900607 -8.73584 -2.15308 -12.7243   HKH_2021_1IRA_run_2_complex.514_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]FAKNTHGIDAAYIQLIYPV[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.514_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.514_chain_B_7_0000100001_0000001_0
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L1edHCJB/kGEyrskQ1edICJB/kGEyrskQ1edHCJB/sGEyrskQ HKH_2021_1IRA_run_2_complex.514_chain_B_7_0000100001_0000001_0
SCORE:  -1471.455  -2644.075    279.676   1704.870               -151.757                 48.923                107.432    901.602       -974.092            -5.860                 -37.430   -935.411         -155.887        -76.865       -243.062       -117.482     -65.714       -6.475                   35.923      4.726        34.101       226.948        423.410   -113.809      76.382   -101.507       0.000         45.957        268.024   7277.000 HKH_2021_1IRA_run_2_complex.460_chain_B_21_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.460_chain_B_21_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.460_chain_B_21_0000200002_0000001_0
RT -0.550296 0.800821 0.236348 0.459214 0.52668 -0.715354 -0.69735 -0.285123 -0.657578 -24.0403 1.23456 -30.122   HKH_2021_1IRA_run_2_complex.460_chain_B_21_0000200002_0000001_0
RT -0.271643 -0.920957 0.27937 0.952752 -0.298337 -0.0570802 0.135915 0.250665 0.958485 -10.3558 -3.34013 -11.1744   HKH_2021_1IRA_run_2_complex.460_chain_B_21_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]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.460_chain_B_21_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.460_chain_B_21_0000200002_0000001_0
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