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:  -1483.257  -2645.089    283.809   1697.634               -150.001                 48.531                105.865    886.002       -971.060            -5.751                 -35.255   -937.966         -147.334        -81.034       -237.516       -116.064     -62.329       -6.441                   32.857      4.462        33.723       224.549        418.326   -115.548      75.334   -101.507       0.000         50.197        268.349   6907.000 HKH_2021_1IRA_run_2_complex.456_chain_B_9_0000100001_0000001_1
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.456_chain_B_9_0000100001_0000001_1
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.456_chain_B_9_0000100001_0000001_1
RT -0.496737 0.489873 -0.716434 0.1379 -0.770443 -0.622415 -0.856876 -0.407973 0.315154 -23.8386 -6.7407 -26.4175   HKH_2021_1IRA_run_2_complex.456_chain_B_9_0000100001_0000001_1
RT -0.127539 -0.817908 0.561034 0.989775 -0.141377 0.0188975 0.0638609 0.557708 0.827577 -8.30268 -2.41499 -11.6893   HKH_2021_1IRA_run_2_complex.456_chain_B_9_0000100001_0000001_1
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.456_chain_B_9_0000100001_0000001_1
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.456_chain_B_9_0000100001_0000001_1
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LSFTHCps1sG07J8kQSFTICps1sG07J8kQSFTHCps10G07J8kQ HKH_2021_1IRA_run_2_complex.456_chain_B_9_0000100001_0000001_1
SCORE:  -1446.982  -2627.226    278.228   1714.236               -151.054                 47.946                108.300    894.920       -972.538            -5.906                 -36.800   -934.837         -145.704        -81.810       -238.441       -111.515     -60.152       -6.669                   26.627      7.541        32.814       226.524        415.421   -112.158      72.841   -101.507       0.000         49.453        264.483  14150.000 HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.161_chain_B_17_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.161_chain_B_17_0000100001_0000001_0
RT -0.857155 0.458098 -0.23544 -0.284404 -0.802066 -0.525171 -0.429418 -0.383192 0.81778 -31.0762 -4.14597 -21.5728   HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
RT -0.196375 -0.897757 0.394295 0.946987 -0.277925 -0.161162 0.254269 0.341744 0.904742 -9.56688 -2.08883 -13.4239   HKH_2021_1IRA_run_1_complex.161_chain_B_17_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.161_chain_B_17_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.161_chain_B_17_0000100001_0000001_0
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LVC5NChHBUHEIRQjQfuINCVFDaHUQfAjQ8b+MC1rwlHE/pFjQal8MCNoIpHkHFYjQmPtLCBVuVH0DC+iQEqlLCdQhKH0aw2iQSMaLCFWcCHE2aFjQC1pLC1B8HH09ThiQQdSLCBvB4Gk1/+iQ/XiLCB6e9G0f4aiQpUWLCxXg1GkBypiQ/LlNC1XNUH0i6fjQWlpNCF8gZHkSaxiQxWMLChBdWHkZWNjQrFLLC9sxaHEAsyiQ3jXLCZdZEHkFeWjQ29yLCpySOHEGjViQ2pJLCJA1xGEj9KjQEBmLC52f7GEXEKiQ7PQLCJxPtGEhvkiQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
Lpj0MCl1DsHEiO1iQwucMCZZE3H0qC4iQ8B9KCpE52HkFA1iQG3cKCBs5wH0ifniQoiHNCBk+9HkNzniQaLlOCNgo+HE0aqiQ/HYPC9CW3H0N/fiQCSJPC5jQDI0j/2iQgQuQCB663H0vBiiQ0jgQCdehDIEXD5iQ9BTRCxPv/HUykuiQJmqSCJ5FAIEvZwiQA56MCZUDpHUUNmiQQorMCRky5HUKMIjQ7d6MCd0j6H0LZYiQTysMCJN/CIESUoiQBd7OCBEJxHU29ViQxzgOCxZJGI0rR/iQ8dVRClxWyHEX1ZiQLe9QC51mGIUb4CjQmj6SCNtHDIEl/4iQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
LqoOKC53L9HkdaBjQACyIC1XO9HUaP/iQFTUICpYYEI0gBCjQoqNIC5CZGIkBAUjQ4PPICB/h1HEALQjQT+2GCBD0xH0S/NjQiKjGCJL8qHkRj9iQFO5FCtzc0H0BecjQLYTFCpAzmHkfg7iQneoECRkQwH0PoajQENWECR/WpHkM7JjQZirKCR6+AIkPSMjQ3JgICt9g6Hk2QviQY03ICNQduHUUUQjQUiVIClRP5H0B2fjQ8MVHCpbyoHEOPyiQ/NJGC9az5HEDdpjQp4EFCd0YhHk5juiQWf3DCVLWyH0lSmjQudXDCRU7lHUWMIjQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
L01GICNGHHIUcBwiQNM1HCVQ4MI0YBwiQyQbGClsgOIkknpiQ9PAGCpKqNIE4aXiQXF1IC5JvPI0DPhiQKUmIC1W0VIUjNeiQNf1IC12GZIE8gyiQ7J8JChyEZIkOc7iQmUzHCdG+bIEy15iQY8KICFECFI0C5hiQSr/HC1yVOIk6OAjQlv1JCJhKPIUQVniQhSyIChS6NIErfRiQ2GTJCFrOXIESJSiQx/kHCBekWIEbxYiQI55HCFXOeIET/GjQHE5GClg7bIUJ6xiQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
LtktFClBBRIEbc4iQI6VECh0uSI02U0iQ9YUEC1DNXIExvjiQ3RIFClg8aIUP/kiQGZrDC5VtUI0D6IjQuTMCCtMzVIUDzGjQu+iBCRaOXIkccbjQaGNCC9a/WIklorjQ7CZACx9oYIE8IbjQ8oHGCJ8oRIErDHjQRSxDCRHYPI0IMuiQZK1DCZG8RIkgmVjQkWJECFtcYIECtNjQuYCCCVvFZI0dm7iQHhtBC9UPSIkkKAjQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
LV9XDCNs2WIEBrUiQXPLDC9LAbIEcdEiQwy4CCVEcgIUokOiQpEXDCVLhkIUqhGiQ/72BCNtzgIUhPZiQUJBCCVKoZIEpN1hQvqTCCx9TVIk83jhQmzbDCBgwTI0QqghQv2WBCZRuTI0hTZhQkpxCCtshTIE2qUiQb3FEC9lVbIkhG7hQENLBCV8NYIUny+hQ4VsBCJLRdI0aMthQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
LcxeGC55wkG0pKhkQcxeHC55wkG0pKhkQcxeGC55wsG0pKhkQ HKH_2021_1IRA_run_1_complex.161_chain_B_17_0000100001_0000001_0
SCORE:  -1504.691  -2637.017    276.726   1690.273               -151.947                 47.009                106.725    887.428       -965.784            -6.252                 -39.161   -929.807         -147.787        -78.926       -239.612       -118.307     -66.461       -6.412                   25.410      5.044        34.431       223.255        419.562   -115.383      73.999   -101.507       0.000         44.081        265.729  15781.000 HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
RT -0.675517 0.424759 0.602708 -0.0240101 -0.829641 0.55778 0.736954 0.362319 0.570635 -41.2377 -0.913439 -31.61   HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
RT -0.178183 -0.715148 0.675881 0.958677 -0.280984 -0.044571 0.221786 0.640009 0.735662 -12.3251 -2.51102 -8.52708   HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
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LlI4DClZtmGkK7ulQlI4EClZtmGkK7ulQlI4DClZtuGkK7ulQ HKH_2021_1IRA_run_1_complex.14_chain_B_3_0000100001_0000001_0
SCORE:  -1491.307  -2608.582    273.960   1667.986               -151.391                 48.471                106.091    872.937       -956.146            -5.470                 -34.947   -923.639         -151.732        -81.020       -240.680       -110.765     -61.518       -6.644                   25.705      3.391        31.627       222.000        419.681   -113.923      74.864   -101.507       0.000         48.886        261.059  12960.000 HKH_2021_1IRA_run_2_complex.699_chain_B_14_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.699_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.699_chain_B_14_0000100001_0000001_0
RT -0.174667 0.977468 0.118523 0.960927 0.195475 -0.195983 -0.214735 0.0796603 -0.973418 -38.8835 9.46467 -21.3688   HKH_2021_1IRA_run_2_complex.699_chain_B_14_0000100001_0000001_0
RT -0.00810895 -0.802046 0.597207 0.960966 -0.171418 -0.217166 0.276549 0.572135 0.772129 -13.345 -2.21346 -8.52236   HKH_2021_1IRA_run_2_complex.699_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]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.699_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.699_chain_B_14_0000100001_0000001_0
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Lg5qyBl/G6EkLuHmQr6twBV2/xEU95WmQrO8wB9z08EkwmsmQanCzBlWm7EEFP3mQqQGxBp28ZE0lLZmQTgmwBdbjNE0OnEmQrmKxBh7frD0VlHmQYJuwBd7tRDU80ylQHYryBxWodD0tphlQzyc0BxnyyEkA9FmQSptuBJBQ1EkitQmQoYHzB19jWEk2uemQ3rsvBph+TEUMHlmQjFhuBBosPEEk5/lQsZ3xBRRAUE0lB4lQJwOzB91NnDkl1MmQGR2vBZJ5eDUj+TmQjX9wBhm0vCESc2lQ0rsuBRKOXDEz8slQMSWyBtbyLDkaZUlQ6ieyBNX28DUs2dlQNnj0B56ZYDUODnlQ HKH_2021_1IRA_run_2_complex.699_chain_B_14_0000100001_0000001_0
L2fuuBRz6GF0TMzmQn5luBBg4SFUSLHnQzcNsB94MOF0XUVnQzgEqBRKzHFkXKOnQjjcuB9EBrFUHIDnQ5rswBZvN0Fkvd3mQ+NhwB9AM3FU6yhmQL1AzB9f95FkqzBnQ6hlyB19z/FU7jWmQVbG1BNrQBGktf2mQNd40BtNxCGU9ygmQFJGtBZFJHFEROpmQI3WwBxgJPFEjPQnQIrnsBZkiuF0NR6mQbjSuBdfOzF0agSnQuIsuBp4dyFURbZmQsxKzBN4p3FUTDTnQCZYyBBd8AGERdFmQ3I72BxIdDGknp+mQ4jh2BV1KGG0M1XmQ HKH_2021_1IRA_run_2_complex.699_chain_B_14_0000100001_0000001_0
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LqnjCCZ/akGkAWqlQqnjDCZ/akGkAWqlQqnjCCZ/asGkAWqlQ HKH_2021_1IRA_run_2_complex.699_chain_B_14_0000100001_0000001_0
SCORE:  -1490.750  -2668.268    290.690   1722.005               -151.076                 49.499                107.370    897.007       -982.713            -5.917                 -37.724   -944.440         -149.524        -80.262       -241.985       -109.583     -70.861       -6.153                   27.450      4.026        33.604       225.529        422.274   -112.452      75.027   -101.507       0.000         43.784        273.451   5552.000 HKH_2021_1IRA_run_2_complex.856_chain_B_0_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.856_chain_B_0_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.856_chain_B_0_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.856_chain_B_0_0000100001_0000001_0
RT 0.787351 0.594897 -0.161793 0.261123 -0.559529 -0.786602 -0.558475 0.577084 -0.595886 -20.0141 0.890439 -30.7272   HKH_2021_1IRA_run_2_complex.856_chain_B_0_0000100001_0000001_0
RT -0.119118 -0.715003 0.688898 0.964696 -0.247488 -0.0900596 0.234887 0.65385 0.719242 -10.5297 -1.93626 -11.5218   HKH_2021_1IRA_run_2_complex.856_chain_B_0_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.856_chain_B_0_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.856_chain_B_0_0000100001_0000001_0
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LHVQFClMKkG0IPAlQHVQGClMKkG0IPAlQHVQFClMKsG0IPAlQ HKH_2021_1IRA_run_2_complex.856_chain_B_0_0000100001_0000001_0
SCORE:  -1465.665  -2660.455    287.794   1720.216               -151.219                 49.217                106.632    898.364       -978.594            -5.782                 -35.667   -933.691         -149.338        -78.764       -240.258       -116.218     -66.990       -5.331                   31.376      6.297        35.711       224.470        419.408   -114.415      74.510   -101.507       0.000         41.922        276.647  16491.000 HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.363_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.363_chain_B_2_0000100001_0000001_0
RT 0.191628 -0.797833 -0.571612 0.718196 0.510936 -0.472375 0.668934 -0.320009 0.670911 -8.24843 -3.02115 -24.8591   HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
RT -0.0990653 -0.736529 0.669112 0.96926 -0.223609 -0.102635 0.225213 0.638376 0.73604 -9.44206 -2.31561 -12.1946   HKH_2021_1IRA_run_2_complex.363_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]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.363_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.363_chain_B_2_0000100001_0000001_0
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LfUGACNgDMIE6axjQ3y5+BVy6GIEmf1jQW6R9BZp/EIURWijQVrc8B9mXAIkMrhjQOtA9Bh5MHIEy4IkQm896BF+GLIUwzEkQZni+BNipIIEdGdkQUsF/BZJcPIUjRyjQeFOACtw7DIk5y4jQXLE8BpSTDI0lELkQmoe5BhnbKI0CNOkQV1L9BV9xIIENeqkQyEBAC9YnFI0h8fkQ2Ig/Bp4hMIEwNbkQ HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
LQNy8BpdiII0a2SjQSAL7Bt9EHIkcVAjQit18BZBdEI0I/uiQ1az+BxezGIkMIniQmxx5BNo+LIEOC3iQYZr3B1qdOIUyTFjQOhW2BJUOTIEES6iQuZO0BtVzVIEJgIjQGC8yBFnfaIUk69iQjFg9BJISMIklIUjQtRq5B15LEI08YFjQvCR7BJ8BPIkcgziQkA04Bx63KIEhBoiQvbK2BlmdLIUlAJjQ4Nm4Bl/wPI0pPUjQfg33BZtMWIUnR2iQFOa1Bhj3RIUmdriQyVsyBlG2SIklLMjQFwJ1BpuHXIUDYXjQ6+ixBB/EcI00yHjQ5lV0BFkSdIUKl6iQVQDyBBYTZIEpLwiQ HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
LF++7BZiR/H0IzoiQxiW9BB584HEboYiQTvj7BV8j0HkkWHiQkJM5B1ZjyH0AgKiQk/u+BJjLvHkHhiiQu1YACFAqxHE2fyiQVUEACJxnxHUu2HjQiErBCRkI0HUEgsiQNZABCVO9zHEi9WjQOPnCC9Vi2HExs7iQF0RCClza2HUf8QjQydX6Bl4B8HEeiwiQCT0+BBb/9HEGBRiQZpO9BBPFqHEf9piQcpq/BtTiqHkmwViQDfF+BF3wvH0FxMjQuy7BChmL0H0TjbiQjWuAClG7zH0YwnjQaznDCdYj4HEI82iQwHBDChEU4Hka6cjQ HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
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LGa76BFuzEHkEAIhQ4Rq5B9cM/GURE2gQYGr6BBj8zGkmixgQqAC9BJjQyGECDtgQJO95BRJEGHEywhgQJo+4BNp7AHEwuMgQro91BltK/GkNuLgQNXY0B9utGHktrNgQJPK1Bp+G1G0iiIgQ/c58B9QGHHUw5GhQdKi3BR1i+GEwp5gQdJ44B9ojNHkT7jgQ5oD8B99DIHUPnfgQopg5BBeSGHEyY/fQWf95BFRP5GU1SKgQjUNzBthYzG03iHgQ7/j2BZ6CvGEQ3GgQ HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
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LYC/FCx7JpGkRp0kQYC/GCx7JpGkRp0kQYC/FCx7JxGkRp0kQ HKH_2021_1IRA_run_2_complex.363_chain_B_2_0000100001_0000001_0
SCORE:  -1514.917  -2641.656    278.912   1702.865               -150.578                 48.697                107.834    893.351       -969.860            -5.744                 -36.800   -942.411         -152.412        -80.921       -241.602       -111.668     -80.718       -6.360                   23.399      4.959        32.668       223.082        424.700   -116.689      74.002   -101.507       0.000         43.704        265.837  16576.000 HKH_2021_1IRA_run_1_complex.92_chain_B_4_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.92_chain_B_4_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.92_chain_B_4_0000200002_0000001_0
RT -0.195025 0.639082 -0.744002 -0.431154 -0.737205 -0.520226 -0.880949 0.219322 0.419317 -28.6644 -16.3719 -34.682   HKH_2021_1IRA_run_1_complex.92_chain_B_4_0000200002_0000001_0
RT -0.144444 -0.720636 0.6781 0.955189 -0.280472 -0.0945981 0.258359 0.63405 0.728856 -8.85497 -2.32611 -11.9824   HKH_2021_1IRA_run_1_complex.92_chain_B_4_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.92_chain_B_4_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.92_chain_B_4_0000200002_0000001_0
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L947GCdHonGk5Y0kQ947HCdHonGk5Y0kQ947GCdHovGk5Y0kQ HKH_2021_1IRA_run_1_complex.92_chain_B_4_0000200002_0000001_0
SCORE:  -1465.295  -2653.100    284.984   1716.400               -151.392                 47.518                104.740    894.854       -973.584            -5.268                 -33.429   -934.726         -138.052        -80.334       -241.382       -114.108     -69.034       -6.311                   30.774      7.049        33.145       224.691        422.265   -116.392      75.265   -101.507       0.000         44.918        266.722   4774.000 HKH_2021_1IRA_run_2_complex.42_chain_B_10_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.42_chain_B_10_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.42_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.42_chain_B_10_0000100001_0000001_0
RT -0.135594 0.849539 -0.509801 0.265297 0.526896 0.807464 0.954585 -0.0257615 -0.296824 -25.8911 -29.8371 -11.7811   HKH_2021_1IRA_run_2_complex.42_chain_B_10_0000100001_0000001_0
RT -0.0643196 -0.796696 0.600948 0.973851 -0.181596 -0.136516 0.217891 0.576453 0.787544 -8.79736 -1.83788 -11.5109   HKH_2021_1IRA_run_2_complex.42_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_2_complex.42_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.42_chain_B_10_0000100001_0000001_0
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LD30GC5MUkGkP1ElQD30HC5MUkGkP1ElQD30GC5MUsGkP1ElQ HKH_2021_1IRA_run_2_complex.42_chain_B_10_0000100001_0000001_0
SCORE:  -1468.862  -2648.236    288.218   1687.367               -150.062                 48.179                104.453    878.543       -967.312            -5.650                 -35.630   -904.916         -152.209        -77.660       -243.767       -105.662     -64.780       -6.455                   33.097      4.221        31.815       225.719        416.127   -114.803      73.771   -101.507       0.000         46.736        271.541   1401.000 HKH_2021_1IRA_run_1_complex.157_chain_B_9_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_1_complex.157_chain_B_9_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_1_complex.157_chain_B_9_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.157_chain_B_9_0000100001_0000001_0
RT -0.440237 -0.204435 0.874298 -0.877587 0.303827 -0.37085 -0.189821 -0.930535 -0.313165 -33.1865 -20.4074 -11.0017   HKH_2021_1IRA_run_1_complex.157_chain_B_9_0000100001_0000001_0
RT -0.232 -0.763494 0.602705 0.953157 -0.302066 -0.0157505 0.194082 0.570818 0.797809 -11.7494 -2.78377 -10.4459   HKH_2021_1IRA_run_1_complex.157_chain_B_9_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.157_chain_B_9_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.157_chain_B_9_0000100001_0000001_0
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LQb/DCBJaCHkWgUnQgYoECRA98GUZuCnQpxEGCpC2/GEtV/mQIyiGCpVbIHkGNFnQTH6DCxcW/GUyrtmQUvhCCxd97GE9/tmQH1hBCJ/IDHEcpymQrANCClyhxGkedqmQK1OACp33/GElkzmQVG6AC9aSuGUctrmQfh2/B9hb1GE/KwmQaSAECVvmKHkbDVnQBplEChre0G0y2FnQfQ8DC1L6HHkShqmQs4aECNcS7G0QhgmQM2xBCRwgLHE2z1mQkf/CCp10rGUI2mmQY55+BdGpFHUlW3mQF+pACdF+lGkoOpmQIl09BFuxyG02JxmQ HKH_2021_1IRA_run_1_complex.157_chain_B_9_0000100001_0000001_0
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LUxpECZN4sGUl2QlQUxpFCZN4sGUl2QlQUxpECZN40GUl2QlQ HKH_2021_1IRA_run_1_complex.157_chain_B_9_0000100001_0000001_0
SCORE:  -1466.582  -2664.606    291.538   1699.216               -149.500                 47.772                105.492    894.721       -973.986            -5.334                 -34.082   -928.778         -146.982        -80.599       -239.211       -125.889     -63.900       -6.490                   35.340      6.134        39.786       225.180        425.689   -112.699      74.590   -101.507       0.000         46.240        275.283   7332.000 HKH_2021_1IRA_run_1_complex.912_chain_B_4_0000300003_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.912_chain_B_4_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.912_chain_B_4_0000300003_0000001_0
RT 0.122824 -0.276284 0.953196 -0.807324 0.530782 0.257874 -0.577185 -0.80121 -0.157858 -18.0448 -33.3593 -20.2137   HKH_2021_1IRA_run_1_complex.912_chain_B_4_0000300003_0000001_0
RT -0.18976 -0.750131 0.633479 0.955512 -0.289478 -0.0565585 0.225805 0.594564 0.77169 -10.7776 -3.44005 -10.2492   HKH_2021_1IRA_run_1_complex.912_chain_B_4_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]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.912_chain_B_4_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.912_chain_B_4_0000300003_0000001_0
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SCORE:  -1468.883  -2651.710    287.244   1706.758               -150.385                 48.421                106.355    895.686       -973.438            -5.389                 -34.315   -941.614         -147.470        -77.878       -240.149       -116.946     -69.100       -6.429                   37.681      5.156        34.649       225.918        422.319   -114.854      75.467   -101.507       0.000         44.119        272.526  33898.000 HKH_2021_1IRA_run_1_complex.590_chain_B_1_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.590_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.590_chain_B_1_0000100001_0000001_0
RT 0.739761 0.466348 -0.48505 -0.665579 0.612987 -0.425736 0.0987882 0.637782 0.763855 -7.23566 -17.5304 -26.7877   HKH_2021_1IRA_run_1_complex.590_chain_B_1_0000100001_0000001_0
RT -0.309196 -0.871396 0.380877 0.93793 -0.345589 -0.0292493 0.157115 0.348192 0.924163 -10.6421 -3.26229 -11.9309   HKH_2021_1IRA_run_1_complex.590_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]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.590_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.590_chain_B_1_0000100001_0000001_0
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LAk7FChbptGEAj7kQAk7GChbptGEAj7kQAk7FChbp1GEAj7kQ HKH_2021_1IRA_run_1_complex.590_chain_B_1_0000100001_0000001_0
SCORE:  -1454.118  -2653.187    282.544   1720.107               -151.221                 48.103                107.433    891.266       -978.578            -5.657                 -36.818   -927.184         -151.242        -80.095       -233.565       -116.298     -68.002       -6.210                   32.442      5.885        38.727       230.591        424.003   -113.547      72.810   -101.507       0.000         45.932        269.149  10711.000 HKH_2021_1IRA_run_2_complex.536_chain_B_0_0000300003_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.536_chain_B_0_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.536_chain_B_0_0000300003_0000001_0
RT -0.415718 -0.875243 -0.247241 -0.645353 0.0923237 0.758285 -0.640857 0.474791 -0.603221 -8.72218 -18.9232 -31.7663   HKH_2021_1IRA_run_2_complex.536_chain_B_0_0000300003_0000001_0
RT -0.205164 -0.709621 0.674051 0.949759 -0.310668 -0.037979 0.236357 0.632395 0.737707 -13.7537 -0.779302 -11.588   HKH_2021_1IRA_run_2_complex.536_chain_B_0_0000300003_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEH[HIS_D]KGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]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.536_chain_B_0_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.536_chain_B_0_0000300003_0000001_0
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