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:  -1469.336  -2660.947    290.833   1704.940               -151.244                 48.022                106.637    891.908       -973.404            -5.483                 -34.078   -930.481         -146.891        -80.288       -235.049       -118.884     -72.674       -6.328                   27.359      6.593        34.565       224.662        425.236   -115.032      75.954   -101.507       0.000         47.616        278.628   7848.000 HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_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_1_complex.302_chain_B_4_0000200002_0000001_1
RT 0.292981 -0.210542 0.932649 -0.6911 -0.720709 0.054403 0.660715 -0.660492 -0.35666 -23.8571 -16.969 -5.43576   HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
RT -0.184518 -0.734907 0.652583 0.949065 -0.305776 -0.0760014 0.255398 0.60532 0.753896 -10.9439 -2.82099 -12.02   HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_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_1_complex.302_chain_B_4_0000200002_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_1_complex.302_chain_B_4_0000200002_0000001_1
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LN9ZBC9CwCIEoKwmQwu6BCNPJIIEfawmQ8aIDC1ZrII0Zf+mQoLjDC5hJNIURRDnQTA3ACNfCMIk6E3mQwcXAChc9KIkw+MnQJTZACFJWGIE0hUnQ5zz/BZlDPIkZrXnQjS4AChTbBIEEF9mQjrOCCtFLJIUvTgmQ45QBCJ0EQIkWe2mQXjEACtg4LIklEsmQ/lH/B9ujOIEijmnQfaz/B1zrSIUP+QnQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
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LABeHC1lFZH0FTznQlDNGClmLUHE4n5nQTilFC9H7MH0LlonQxx9ECF01EHEb0tnQ3yNFCdbJdHEWRAoQMYwECNCVkHEpNtnQCEAECZbFYHUfnFoQtbgHCpI7gHEhqvnQLwZGC5PSPHE/2DoQaZuFCJySiHUH7FoQk5FEC9IkqHkrNznQZjnFCRgEoHEkqlnQgYOEChMwfH0whhnQZzUDCR1VeHExUIoQNdeDCl55SHkAAAoQr8UECFpWTHEgdMoQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LHGuFC5iEQHE4ZUnQTjMFC90QKHU3CCnQv5RGCBNhKH0qFxmQpyDHCxiISHEtCwmQQ44DCxXGPH0G75mQ0grCCF8mOH0TKJnQmw/BC5WSBHkQXMnQQXGBCR8V/GEcnzmQi9PGCFUyWHE9hRnQMjBFCBH7BH0ZXGnQvBDECxbSXHUaE1mQxnmDCpqoKHU5KsmQkT9CCBAdRHUqvYnQ/I5BCN4xTHUVDDnQ6NoACptf3GUbmzmQAFVAC1ndFHk1/xmQbkxBC914/GUYNmmQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LCcVGCBhVCH074jmQhtWHC5ghBHUHlTmQR27GCtrWHHkAh/lQlM7FCdvlEHkV01lQQ8jHChdn1GkJJOmQnVoICdbL0G09c8lQnF5HC1fbvGEfdimQr4oFCdwd8GkvWlmQW6RIC5P/EHUPrZmQSwoGCBrgyGE10HmQYNuICNdrrGE104lQNmVICJGc4GEr4tlQNllJCVYM3G0FECmQac+HC50BnG0gdemQDo0ICtnWyGEYQpmQ/xFHCpQZwG0JKumQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LIIvHCVlKPHkDy4lQ0FaHCRGaVHUOxllQh4VICxoSTHEmETlQRCEICl4sWH06NBlQ+yaHCRrchHEYxqlQYtuICJGokH0v1xlQY6ZGCpHwjHEkB8lQvIjICpiKRHkGkBmQ9iZGC9kRTH0KpglQECKHCRG+lHUbbclQ26TJCpeSlHExlllQslZGCFWFsHU7a/lQSLcFCVJahH0MP2lQCMpGCh1UfHUziKmQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LrwdJCNo4NH0MAXlQcvaKChj5LHkd0FlQwrBKCFs9BHUIY5kQFY8JCp4I5GEsgClQJ60LCxBhKHkTsOlQ9QbMCJwWUHUm2YlQYj1NCpLDSH0o1glQ0ndOC9B2bH08brlQhQ1PCJfjZHkgpzlQ4YqJCdoNLHk32llQswZKCpAqSHkEu6kQRj0LCJ6NEHE3malQNUfMC1ACIHk+wBlQLfdMC9MxaHkhBNlQtYzLCp77WHkYLmlQ/nzNCFIfLH0SVslQEcdOCpknPHkBVTlQSVhOCxfTiHEZyflQEX1NCVsYeHEQv4lQmhNQC1kNgHUCh6lQ/myPCpLoTHkHo+lQvRbQCZtRXHUGZnlQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LM4zJCJ4eDHkThkkQbkXJCNL86GEHcWkQArNKCxxM5Gkj5CkQkt3KCt2XAHESj6jQAC9HCpr58GED2NkQRi5GCdzX9GEc/dkQSkeGC1JBHH0jmlkQ+eUGClaL0GUc3lkQiyfFC1umHHkep0kQasVFCxTx0G0IH1kQI/6ECtbf+Gkwd8kQbK5JC90ELHkrbekQFxXJCN5nzGkQefkQre8HCJ3YEHkB6EkQT7sHClfh2GUMkCkQ0O8GCN9WOHUrmfkQxzpGC5PbsGU63fkQaeMFCN2XPHUjV6kQYm5ECp3ktGU+X7kQ5eJECpH9+GEkdIlQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LeoKKCJSjvG0zE7jQh7vKCJVItG0tpmjQ5skJC9tntGU5aXjQ6JdICF1dqGU3LdjQwiZLCFNWiGEkBnjQd2lMCBz8hGU3t0jQsvcMCl4VfGkK0JkQ851NC9tCkGUDSsjQH9iNCFZxeGUkYWkQmi8OC9aejG0QK5jQV8yOCBx0gGEwPOkQJG5PCVKIgG0MdbkQdvpJC14wpG0oFDkQXbeLCdxOzGUdKijQSVrKCFMycGU3VtjQfpqLCJT1fGk07WjQdgdLCpSodG0sbQkQi+8NChUImGUpcbjQZScNCZdqcGkGemkQGp7PCFtFlGkNpyjQjMsQCVahhG0XYTkQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
La+yJCFAwxGE7QEjQ/FtIChPlyGkYF1iQu6SJCRXExGE9ueiQ601JCB1k4GE18UiQf8DIClhe9GUbu4iQKkvGCR9U/GEO6viQMwpFCxfS7G0LG6iQDtkGCRQSFHUYgeiQJdZECtcU9GU2uyiQEgVFCpPhHH0GyWiQPkOECZ1fDH0S+giQgUuKCVrQ0G0KOAjQdf+HCldQsGk6D4iQsS/HCxRy+G0Y6JjQGCuIC12lDHkXmyiQ6jzFChge2G0yYIjQpNcHCRfSIHEpxWiQuPjDCBSG6GEXG7iQqtPFC5obMHEFpIiQotODCdmKFH0l/aiQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LiLPJCJXBnGEFTXiQIP6JC1AijG0JgDiQ+mAJCNDrgGELwwhQsfNICteLZGE+4xhQB00KC1O9ZG0KVIiQGYfLCdupUGEcg0hQnQgMCxwwbGEM+ohQXRfNCVqYfGk1gyhQ3NRMCF9vdGUhQUhQe2tICx0mhG0aggiQD9iKC5gGqGkpP+hQPtnLCZdfcGUTHTiQC9PKCtc0TGUNmQiQoaBMCt/kNGU6/5hQbluKClaQSGEq8ohQr25MCRhSiG0r1LhQP7bLCptjaGkQrMhQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LBfLJCh6hmGUENfhQ2FYICdsKlGU74LhQ1pkIC9tMaGkJsBhQ3ptJCFHdWG0zl/gQ0fuICpZytG0mb7gQNmzHCdgBuGk5LogQQdFIChrD3GkOYZgQee8ICpxa9GkvIegQTXcHCFEn3GEQCJgQ853JCRoasGUkffhQpKVHCBYDmGkWCQhQlkuICpbg1GkXpChQd6uJChkVsGkCf1gQ/Y6HChqkmGkvPfgQojxGCN3iuG072tgQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
L4JdHCRvSVG0SA7gQbMcHCFW9KGUt/vgQGUfICJeYKGk4KegQP1RJCl5xCGUMKdgQlJVICZkCQG0BROgQX9DGChqlIGkX4lgQM55ECJxgFGkaj1gQYuIFCxKCEGUsPIhQfsxDCJ2eEGUc6tgQsGkGCRBBZGk2J+gQx+pHCpzyEGE0v7gQMjvFCx0pPGU99cgQLLLGClzICGkEUagQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
LvvEFCBZbrGU632kQvvEGCBZbrGU632kQvvEFCBZbzGU632kQ HKH_2021_1IRA_run_1_complex.302_chain_B_4_0000200002_0000001_1
SCORE:  -1417.906  -2697.054    303.285   1745.922               -152.316                 49.107                107.637    922.362       -992.946            -5.797                 -35.557   -934.963         -150.841        -80.987       -241.287       -126.885     -59.985       -6.634                   45.287      8.919        35.832       231.918        415.678   -115.794      74.880   -101.507       0.000         49.158        294.666  11467.000 HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_1_complex.181_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.181_chain_B_1_0000100001_0000001_0
RT -0.669791 0.722731 0.17041 0.258921 0.0122272 0.965821 0.695945 0.691022 -0.19532 -36.2943 -25.9955 -23.0011   HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
RT -0.039051 -0.897286 0.43972 0.968662 -0.142018 -0.203775 0.245293 0.417982 0.874713 -8.63266 -3.35172 -11.761   HKH_2021_1IRA_run_1_complex.181_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]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.181_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.181_chain_B_1_0000100001_0000001_0
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L06OrB1/B1Dk+AUbQllXqB9C9PEU0jgbQVjpqBBu9SEU/uQcQwyqoBljLVEELsncQftenBNG6TEUMxSbQU2DnBZoIUEEQaiaQ8bIkBJgIYE0zAXaQ15sjBh5cYEk6nmZQQk1gBhj/bE0VMbZQbo3pB1oUdDkx8QbQesprBRrtbEU08QbQhbMmBtQlHE0jYgbQ21zmBR6QjE05XfbQRjSoBl+tgEE9XUaQa5rnB503EEUe/UaQ1X5iBp9jLEEy/kaQJIgjBB4cnEk/SkaQ1n5kBxxOlEUiuYZQnZWkBddNJEkmOZZQ10ogBlAGcE03/6YQIbafBJ9GQEkFnnZQx9NgBleLqEkdHnZQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
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LcPGGCJq4kFUg2AhQ8tfGCFJdpF02tWhQALZFCZx94FELpdhQ2e9EChT2CGEZPQhQ926HCN6uxFEy5WhQtXiICRD6zF0vSshQKA4ICtwpbFU785hQEpSJCNJSmFE24TiQEmLGCVeMwFkQa1gQ7TbGC9WJbFEdlghQU9iICtCKnFUddNhQNN8HCpPrAGk/WPhQnXdJCxhP8F0V/qhQnZ3HCdso8FU3+1hQUtgJCV3PZF0J6eiQgcKKCFTqwFUVjSiQfndICZ2jvFEo8ZiQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
Lle6ECRYc4F0YkxhQwQxDCJnDDG0Wd2hQ9mGECJXXOGkqO9hQKApECtYLQGkDfOiQ0o8CCBLg7FEkdIiQeJvBCVWzEGUWIPiQLffCC5pclFEKCBiQx4SFCB0vuFkZT9hQbiJDCtTdDGUCJohQ6BlDCFNp5FUMcWiQrvMBC9WwAGEpBciQQcECC19nMGkQ9UiQyrEBCRI6FG0biBiQpW8BCtOydF0yzNiQmu2BCVX+mFUu+yhQS6WDChgmbFkz+8hQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
L2sqDChyFWG0xRwhQ897DCNbYhGkMZ0hQ38sCCRzfnGU/v7hQhW0CCBInwG0g8CiQpMdEC1VBnGUaIghQdtcDCdrSmGkFzPhQ3IwFCFJ7hG0UUYhQooNDCdYEUGU/WihQPcsECNP+hGEf5AiQqzoECRBcvG09ujhQ8jqDCpsFrGkTSEhQZAGGCJOCmG0hIKhQSvfGCNMqiG03tkhQvqlFCl3fZGU2oUhQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
L07gBC5RviGUcd5hQ9vSACB/XoGUZb/hQ743/BpQ+mG0B1WiQMyk/BRB4dG0YqeiQw9O+B9P1kG0HrxhQNnb+BtiBoGUTcahQSi67Bpx1kGE3QOhQIoE8Bx7JoGEZz2gQgfl5BZUYlG0t7qgQrqdBCdkSbGEQazhQc5cACNE6wG0Kx8hQvrE+BpOKcGEXUyhQDHZ8BFsKoGE9J4hQzWs+BNirwGUieZhQPfFAC55MkGkOPThQhJp7BBaMcGEDQPhQimL6BxxtoGEZlVhQ+rY8BhPxwGkd31gQ2nw9BteGkGUuTvgQd+w5BJYsnGkMgbgQqKS5Bp9ZdGk1jrgQJtA4BpSNpGkwsxgQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
LqJk/BpsIwGEmnhiQbG9+BlzcwGkAV4iQPDs8BFaz3G0ag+iQcsL8BB7GAHk/x0iQZVsAC5pR0GkmJFjQXA3BCF7ltGEQLCjQ5C2CCpOlwGEvH0iQXT+BCN0IkGUlmMjQRO7DCxIMqG0exwiQl3CDCFHsdGEz/IjQ6QBECxMugGkHL7iQpu4/Bt6K3G0hlZiQYQa+B9neoGEBQ9iQYX8ACpwb8GErdAjQ+EcACR7X0G0zHWjQDOwCCtvH4GkKZriQPZMBCJfwhGkYsXjQ6nsEC9AqsGkrdliQ28HDChRFWGE2JRjQx32ECd5kbGUhb4iQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
L44X7BlmJ1GEAvPjQEzd5BBlg8G0JlYjQQnH7BRT+CHUuEojQFkt8Bt6c+G0gL0jQvtR3BFQr2GUn4jjQlLn1BhkHwGUhlVjQo4P2BxKglG0CFTjQIuczBFDe0GU+ALjQEsv0BxaMfGUeXGjQ2c7xB9KDuGEn99iQTHlyBpJbjGkSq7iQdJExB1J6cGUj6uiQDZw7B54HuGEhXXjQBCq4BhMwBHE+OMjQkHM4BdbdxG0PgvjQjjA2BZJV8GU+PsjQY583BZ6GiGE5kbjQqf8yBRL68G0C+MjQvOP1BBO5WGUY2EjQaBOwBViUxGU8k1iQOblvBF44gGUyNpiQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
Liz16B95eNHUepnjQL0b8Bdk8THUtI2jQ8Co6Bt2xcH00x+jQviJ6BRXDlHEzX0jQeW4+BVv2XHkgwpjQXekACVUEcHUhT2jQ9jUBCBIOVHEjSCkQgB7ACtLZmHU/c1jQdUaCC9ruYHU6aNkQ4ZACCxIJqHkrRAkQrtwCC5uPjHUYcMkQ7mh5B5L7QH0iddjQ2mF9Bl7DPH0npDkQC/o/BJIORHUUNgjQcxQ+B9RAeHEBqejQzPCBClm3MHUJoCkQRmVACZBlrHUz/rjQ1s/CCFMJTHEYwWkQvARCCVFiyH0uE/jQmQoDCdeHmHkIIVkQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
LpQf5B5AlaHUGqRkQ2pa3BtpShHkhYbkQhML4BBZkmHUkbwkQHE44BVmLhHUY8/kQGA40BBkjaHEGsekQQRkyBtAGgHkz0qkQnjSxB1dYpHExnekQ7tTwBlXAoHEErMkQWdSxBl94yH0abokQAOG6B9twTH0MeZkQqi82B9vqnH0nGQkQFSH0Bpu+XHUWMPkQPXZ1B96YTHExnnkQq9AxB1+JaHkJmtkQFqRzBhBIjH0yL6kQEfdwBN9Q5HEDUhkQNeHyBROtzHEQk3kQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
L///3Bt7JxHENCxkQrwp4BhxH3H0LYElQX0m2B5l40H0j8VlQI7L0BVG80H0qtRlQzNu4B5nkBIUYDAlQRqs5Bxi0EIEM+SlQZQ35BRPoKIEj3OlQzlR5BpQVMI0lb9kQbgo6BhFcNIEyWdlQwxb3BdZH1HUaqjkQj6m6BdMr0H00BKlQqZ/5BlpaCIk6nykQ9Fu2BV88CIUVD8kQ6kV4BNuPEIUiYglQ3Aq7BZ1TDIEIvXlQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
LjYl3BlsSzHEPoplQgi41BZ+nxH0Va8lQR0nzBxG05HUj69lQo3WxB1Oz2HEUzCmQoSP0BNDmBIU8ZBmQjMh3BJVHyHExORmQoYQ5BdwFoHEWhWmQTn94B9z0fHEmpMmQyV36BB95oHEELlmQ6zn5BBWLzHEParlQFW/0BNsspHEmJ7lQfz24BVdA5HkzWQmQaaK2BlohzHEEkemQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
LJueHCBmQqGktG4kQJueICBmQqGktG4kQJueHCBmQyGktG4kQ HKH_2021_1IRA_run_1_complex.181_chain_B_1_0000100001_0000001_0
SCORE:  -1444.187  -2661.186    292.036   1712.237               -152.550                 50.033                107.819    897.090       -977.552            -5.554                 -34.551   -929.376         -151.726        -77.463       -241.684       -111.086     -66.942       -5.649                   40.334      6.317        32.986       226.397        418.672   -114.340      73.891   -101.507       0.000         52.698        276.470  10393.000 HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.859_chain_B_22_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.859_chain_B_22_0000200002_0000001_0
RT 0.603955 -0.180655 -0.776275 -0.337634 0.824272 -0.45451 0.721971 0.5366 0.436828 -5.39748 -17.7334 -23.5768   HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
RT -0.0841215 -0.733186 0.674805 0.969821 -0.21577 -0.113539 0.228848 0.644889 0.72921 -11.6885 -2.2378 -10.2628   HKH_2021_1IRA_run_1_complex.859_chain_B_22_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_1_complex.859_chain_B_22_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.859_chain_B_22_0000200002_0000001_0
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LeewrBNbtvD0bsBbQydyqBlsGNEktrNbQv25qBVzRQE0p79bQRC2oB1t0REEoPTcQVx7nBJKeQEEoo9aQMNqnBFXsQEUYBNaQsSwkBxRBUE0Ke/ZQOjdkBxCVUEUQ1OZQJsnhBBXLXE0mXBZQZAcqBNvuXDU5o8aQFGFsBZnHZE0AD/aQRfpmB9z3DEElLKbQ1TLnBNoqfEUxvJbQme4oBRlldEEu//ZQWUYoBh8mBE0XBAaQzvhjBdwIHE0MeMaQ39BkB1/JjE0jWMaQtcplBtjbhEED5BZQuONlBtNSFEEM1BZQrtghBBHTXEkNEhYQHNggB1P/KEkD5MZQvc6gBtPLlE066MZQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LWHWtBpwEREUBROcQf/6tBdNMTEEft7cQ9hrvBtVrmEUWoDdQ5FSxBNevsEErXocQJcSvBZg49DkCaMdQxBUtBxmONDkV/EdQtF4uBZFxPE0gB5bQ97CsB1jaVE03tMdQs8MxBVuk5DU3E8cQ6HtvB1psAEUEYudQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LmvcvBVQSwEUObpdQ/gFxB1oEDFkSU0dQkBK0BFI4/E0TyzdQw9l1BJ/hOFkGHndQsKSwBFAaLFktOgeQ0IntBxtxWFU6/jeQzhMtBBDdeFkdrSfQO5kqBZVqqF0ooYfQsWQqB1GwyFU97CgQVKBuBBQlqEEQ+9dQ+gowBBWcPFka0cdQKDBwBdVq9EU6uzeQcd3xBpbJVF0aAueQZrjtBVVakF00ROeQEmAsBRWtLFUSWbeQieLtBl+iQFUE6nfQM12uB1QwoFUsCcfQlsiqBZ7O4FE1zCfQr+5oBt0FgFkzGRfQClgoB1Gx6F0WPEgQmIRqB1ummFEnoNgQ9FyrBlbq8Fk7sGgQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LqQH1BVvQtE0nxCeQxi93BxqomE0dKFeQ6jv5B5LkzEEbIkeQrxm6BFodFF0URaeQpMQ5B1slmEkohYdQMPC4BlOhWEk+t4cQN2c4BZVn+D0kIFdQo9L6B1Hm1Dk2JedQ7+C3BRIEkDE6c0cQvZwzBBBfiEUoIMeQ5p/3BVIIWEUcqQeQegI5BVka2EEMSKdQBiX7BJ2uiEk3vbdQFY51BhAkZEkEN2cQ9W64B1tTZEUoWZcQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LBcd6BZE9pEUfsIfQHQQ8Bd0e0EUEVnfQo2Z+BRz/kEkT23fQzAC+BpJfREU4H3fQHLs6Bdbq9EUkZGgQukp4BB8IPFkvzAgQ6X55BBfhjF0+T0fQv043BBNyzFkxssfQdml2B5c+2FU9BHfQLvE3BFV+qFEm/keQkqy0BVORDGE0ZEfQMdu5BNZAbEkYlPfQC+R9BxdeBFEmAXfQX1n5Bl9NxEEivNgQuaE8B5kJEF0BUSgQsjW3B5VvJFkY/nfQflb3BJNZSFUs7OgQ1IN7BFqJpF0T9GgQHjD7BJOghFk5UXfQEBb3B5Lh9FUqwCgQswc4Bl3meFULWleQ+QF2BRSqtFEhGJeQTLa0Bpz6HG0vJefQuI0zB1RmEGklooeQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
L3iVACJ7rtEUh8CgQD5ZBCZqVgE0hxLgQyR2BCtRUpE0OThgQrs6BCJQ38EEvwjgQoqmCChR9fE0Ez4fQ++SCCt7nXEk2LLfQeMiDCZgiVEEUaveQuojEC1xsdEEns7eQOPfDCZJYKE0ZYPeQBIdACFyx9EkjpCgQ2bCBChWGQE0jUOgQ52ADCJ9CwEUp31fQMuYDCl02VE02LDgQityBCxCZIE0N8MfQNQnBCh80iEEv77eQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LveMCCpeNbE0EYwgQQPsCCFXBiEUVbFhQv4LEC5ECnEkTLFhQnH8ECZEZdEkR64gQOgaCCt3kQE09EWhQEx8AClWKMEESyZhQAASACVRveEU6ojhQF06ACd9DpEkLNwhQRNU+BtS+iEUBqehQGpFCCtxKLEEbOtgQ4PKCCdYlwEUCIKhQjA4CCpanBE0a4QhQ0f3CCV3+UEUhUlhQU9eACt5jIEEdmKhQjx1ACdIl8DkpJkhQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LfroECp9k1EkPVThQxcEGChIf6EUs+UhQn5wGCdgpvE0TCohQFs9HChGgyE0qerhQYyRGCtavSFU/EWhQ+PtFCdJRfFkhtChQk6YGCNTTZFUhftgQKX4FC9cAnFEnCbgQdHgGCBmogFEOMGgQXX+DCBw89EESzchQv5jGClUd0EUHsGhQ+VzFClm8YFkQjkhQ/6VHCFROWFEzOXhQ3GpECpmpbFUnTBhQOT0FCNCYwFkYiFhQOGeHCBDIbFU+9ugQ2oKGC1BtIFEQhpgQ5FzECRFNlFUM2ZgQ1SHGCN/v3F0QOegQQDJGC5I9pFUkm0fQkXgHC1wXiFUiCHgQaqRGCV0GRFUgFDgQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LDtAGChRWjEkTZ0hQoJiGCN1cYEkvOHiQW+rGCl7kAEkbeDiQ/DuFCxlorDU699hQ04lFCF5rbEkCwaiQNQfFCV1H0EkkMgiQZEFGC1O7NEEvUuiQ2haEC5065EUD6wiQlVCFCxXyhEkuiwhQm5gHCxbBfEkfALiQQjlECJlfWEU0WWiQCtcGCdWo5EkHwliQF3PFCty38EkAjRiQ6AaFC5n8PEEjy7iQATGGCdd85DUWKqiQi0EHClc0SE0G7yiQi5aECx6OLFkKcziQeubDCdGA1EUSGriQvsnEC9zEyEELCAjQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LjO5HCVXgwD0T7GiQDCJICFlmCD0TpEiQo+BICZV4vCU/2aiQKTrICZSY/CkJwpiQTihJCF3W4CkwG7hQNynJC5TWMD0RekhQ3DuJCVbSGCkSe6hQ7nALCFyTMDka4ahQrSpIC1jJCEU4TLiQksXHCtbO0CU3l6hQEcTKCpopGDk88EiQVl9ICBF96C0c2ZhQA7RJCpyatDUETlhQIEsKC1sk8Bkz3zhQfKqJChSByBkmlKiQj/7ICNpuvB0KkwhQnT+KCNiJbDEoGLhQJxrLCxfheDUPKlhQ1TYLCFu3rCUORZhQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
L1nKHCNUUQCEHSdiQej6GCNPC8BUHSyiQy8mHC9r0lAEip1iQRjVHCZQ8O/zNGqiQBRZFCx574BEbL1iQkSyEC9SGPBExHJjQWCNFChv69BED6djQnyPDCtETSBU86FjQeQsGCZ4WECUm8PiQn6THCtXIUCEeJ+iQPiCFCp/XdCEjw0iQ5v+ECFVgYBEuSniQHnHFC9wCNAUKWKjQbkvECBgPfBUzprjQzOSGChtI7BUdxfjQFB5EChnEgC0jPdjQ1CwCCp5R0A0lzSjQ7X6CCRBzJCEh0EjQ95+CClFyxAkza3iQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
Lm+fICluajAkhwFjQ2+SJCBxKv+TXwKjQm/2IC9tgn8DPGfjQvd2ICBzme+DfcwjQ9qyKCtwrd/DmINjQT1nLCtrsz7zJJTjQqwSLChP3TAkUe4iQY6oIC5jKZB0mhOjQ66MJC1m8u8DLe9iQFP6KChqrdAkJ9ZjQWVqMCB/BA9TrvUjQlGSLChlhp1DxNijQTOhLCRzdM67bkGjQ8AWMCh8wkA0RM6iQa0LLCJRVK/DiSsiQ3GuKC9A1MBk5V0iQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LR6jICZuJh8bCocjQRoIICxANA/buIujQ1CAJCdgjvAsiUvjQYVuJC94hEB8LQgjQiJsGCpMA4/rA2rjQH3yFChSae9LmUtjQ2joIC9BGA+bYXNjQ+WPICtlF197rJ9jQAOkGCBesaAcvhcjQZ1cGCJrfrAsW/3jQI36ECZp9g+LDvpjQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
LOK7ICxMWcB8GIBkQfZpJCR9EWCMEODkQD3EJCp3b5C8yG1jQ662HCZTl+C8NCzjQ3ugJC1sAnC8qgZkQUkDKC9Q/MC84fpkQclWICprSIB8hhNkQuisKCtP8QCcTH/jQ1RdICN4bqCc3TckQhD9JCZo8GD8fWakQB+3JCxwodC8Dz2kQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
L+D+JCV3aTDcJmsjQjboJC5Xr6DMPchjQq7aJCpUeOE8EoyjQR99JC5rnME86LEkQlvtKCl7gDE8zuRjQhu8KCV0VLDccLujQ2UsICxGM2Dc71YjQmCcKClpWSEMOwJjQaz1KCdc3tDs67FjQKBpLCBJvFEsqUajQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
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LrgJECFN2nG0DEPlQrgJFCFN2nG0DEPlQrgJECFN2vG0DEPlQ HKH_2021_1IRA_run_1_complex.859_chain_B_22_0000200002_0000001_0
SCORE:  -1489.277  -2660.146    289.636   1699.131               -149.437                 49.161                104.807    893.187       -971.894            -5.992                 -37.276   -933.585         -145.789        -81.561       -237.863       -109.793     -70.635       -6.551                   24.528      3.737        33.460       218.120        421.892   -113.516      76.491   -101.507       0.000         48.708        273.409   3862.000 HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
RT -0.300464 0.170164 0.938491 -0.469758 0.82994 -0.300878 -0.83009 -0.531266 -0.169431 -37.2333 -20.9299 -26.5319   HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
RT -0.178612 -0.751306 0.635324 0.956971 -0.282737 -0.0653136 0.2287 0.596321 0.769479 -11.2032 -2.51058 -10.6993   HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTH[HIS_D]GIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
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LqYW5BdaJxFkjmcmQr4o7B5o5wFUm7qmQboQ+B1xGyFEz3emQ0Q6+BRk4jFkn6RmQD/n7BFrxcFkUt4mQxeV5BptWbFUPZInQU/h5BtLFHFUC3VnQUtN3BhUcFFUpulnQyFY3BtlpxEED/ynQ+jg4BloajFUyhXmQX4h7BVH7+F0ZV1mQQ0j7BxRuOFEibumQvde9BZYIcFkA4BnQZNZ5B5aSpFEg5SnQBbc3B9LfbFEzu/mQw+g5BpKH5EUMZLnQSha7B99NHFE0tenQtGQ3BZWUTF0sQwnQ9SV1BBxWFFk26cnQvE01BJ1MxE0KP9nQscU3BtVokEUyZpnQ4qG5BpWrxEUCY7nQ HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
LjLx/B5MhBGE6rjmQUVKBCFIlDG0edZmQ9nTCChnjFGkJZomQsjLCCtNFKGEJt5mQdOIBCBVhNG0BOLmQACQACxrFNGk744lQDl79BRHpQGEYh6lQSWtACRmSJGkXellQbIS8BNgeQGkWTplQ39w/BxcIJGEUJUlQAcL9BhqxMGkZCWlQaPC/Bd6/GG0LbumQQOaBCZFZ5Fk67PmQmx1AC5uYUGEk6UmQdDJCCVQEPGkzYFmQKjM9B9BoTG0Y7JmQSXvBChofGGEKFklQ1XR6BJMSTGU7FrlQY3PACVyKGG0iCFlQtg27Bt3tMGkUYIlQ HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
LQ/dDC5b1CG0kChmQujpECZQ6FG0aRsmQbRGFCdCMQGkMAimQKWKFCdK+QGUeSOmQVlsFChfN7F0qBqmQ7mcFCltXnFk3r1mQQowECJMbWFU5bsmQo07FCRIylFUZ1JnQCRlECRLCEFUjM4mQWdwFCdMzTF0tHVnQu3FFCxGBDFk2tMnQd18EC9wzwEEIfYnQmejDCZ4y9FEe1SmQJdbECJsWHG0sG9mQtdxFCxVc3F0vRZmQPkoGC5a8AGUSbvmQYEYECVPqXFUSHcmQWseGCZEKzFUy7QnQxMEECFBe2EU3lxmQF2JGC1MsSFk8BlnQrJjFChh9wE0CAlnQ HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
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L656ECxoqnGk1BMlQ656FCxoqnGk1BMlQ656ECxoqvGk1BMlQ HKH_2021_1IRA_run_2_complex.13_chain_B_20_0000100001_0000001_0
SCORE:  -1478.133  -2606.139    278.167   1655.572               -149.947                 49.763                106.731    876.274       -954.979            -5.678                 -35.829   -912.793         -154.439        -77.937       -244.667       -109.147     -57.624       -6.636                   29.636      5.815        31.468       216.439        413.929   -114.559      75.544   -101.507       0.000         45.319        269.093   6565.000 HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
FOLD_TREE  EDGE 457 233 2  EDGE 233 1 -1  EDGE 233 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
RT 0.119482 -0.965752 0.230318 0.299776 0.256245 0.918952 -0.946498 -0.0407547 0.320126 -42.5927 -65.7989 -43.9509   HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
RT -0.0443101 -0.989952 -0.134285 -0.497459 0.138432 -0.856371 0.866355 0.0288557 -0.498595 -0.780838 5.80299 -1.4929   HKH_2021_1IRA_run_1_complex.755_chain_B_2_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.755_chain_B_2_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.755_chain_B_2_0000200002_0000001_0
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LC78dCpwr6JUtxOoQUb5dC9SQ1Jk+jKoQhGZdC588wJER/RoQ5BjdCNuGxJkfxboQNFSfCxjSzJ0HEHoQ9f6fCZ0Y2J01K9nQRuYgC51a6JU7IBoQoSqfCdxV1J0G/nnQm8rgChDW9J0B5ynQ7aIgC1ZV4JU3bYnQkAkgCtSU8J0v2dnQbhceC5JX7JEbzVoQ2SPdCNQV1JkPzDoQqj8fCZSTzJ0w+NoQ/7MfCVwIvJkzVEoQKEfgClYU7JEijJoQnq+eC9JHyJkvsjnQzSBhC5XQAK0Zt3nQ47BgCRYk3J0/2HnQ3TzgC1ip+JkQkRnQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
LmY2cCZb1sJU3JNoQRZhcC9xEoJ00/SoQeesdC51TkJUAyRoQmwMeCJ4YjJUZ8IoQNfPbCROslJE6EPoQS/CaChOmoJ0LpSoQkKeZCFirsJUPuMoQjofZCdWBnJE6EcoQ14TYCpQCvJkBjQoQSUYYCNgVpJ08xfoQ2dxXChrStJkwJaoQ3/mWCVodvJkv9doQ4lucC1m0sJUrBFoQcfacC1yBpJkedboQNjQbCZnvlJUYaGoQPwKbCB+ihJEBqRoQaF6ZC1Z7tJk7JFoQyJ9ZCNI0jJUVqgoQy2zXCRKKyJk4HMoQTp9XCBi9nJUsSnoQAFYWCFEttJE/0koQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
LyYKeCZDQiJ0CxaoQLDVfC1q0eJ0duaoQksAfC12DaJ037hoQ+sJfC54YaJE/uroQIdPgClYTiJUIreoQpt6gCxahgJUlpcoQdOKhCpoygJEJXSoQF6UhCZv5eJUeqkoQFJzhC9kdfJ03HQoQ0Y+hClcjdJ05hioQwdNiCJc2dJEnHYoQ++sdCZrHjJEkwhoQClhfCNdYdJEQoSoQdKMgCFZPmJUBDboQEIMgC5s3iJk2QnoQs90gCFyJiJ0r/LoQIfIhCN/ueJk9vsoQSy+hCZlvfJUoBIoQWKTiC1HScJUMBpoQdDuiCVD1cJE3QWoQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
L7PgeChFwVJ0kGdoQ8E/dCFxKRJ0kPjoQIF0eC1+EMJEJuioQDZ+eChgrJJ0JPaoQWMjcCdN5PJkeqfoQAn6bCFM2KJEG0koQmgqbCJqYLJkt3woQip7aCF49OJ0JY0oQACRcCNo0HJUwP3oQR8deCF1yVJk23UoQSa8dCVcXSJUYnroQr/5bCxmSTJ0sehoQHPicCJFWPJUmBXoQc+8aCNUKKJ0KAhoQrmjcCBiXHJ0QgjoQKKIcC1V+HJ0OL/oQVn3cChR2EJErE0oQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
L6XUfCRJVKJkQ4roQxjEgClJhFJEsRsoQznTfCdFiAJkI8poQ6lMeCBO+/IU5NuoQReZgCJ56EJE1R3oQ/s6gC9zhAJkK73oQL/QhCh2WAJUudCpQGiIhCJcvDJEWCJpQJaqhCpdz8I0zCEpQZlJfC90bMJkaqyoQNmdgCt1zFJELUmoQ30ngCBokIJkCs5oQ21AgCNy+DJE2I9oQWXrgC1iq8IU+l2oQIKShC1lJBJknjxoQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
Li22fCRV58IEzZjoQ4eNfChFw3IUfHhoQAl+eCh5e0IUYRroQ2F8dCJd4xIEtPsoQ+99fCRKGzIknawoQL/AgCtyU0I0+QZoQJi8fCBz41I0UMNoQ8SEfCpj34IER/JoQf4YgCR58zIEyKHoQeNYgCZK19IE06foQzYPeCRQk4IU1fdoQDligChOh0IUuoboQYPufCdhKwI0tEaoQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
LZg9QCxmvAI0HhAmQZg9RCxmvAI0HhAmQZg9QCxmvEI0HhAmQ HKH_2021_1IRA_run_1_complex.755_chain_B_2_0000200002_0000001_0
SCORE:  -1489.693  -2683.195    293.557   1717.599               -151.826                 49.277                105.228    893.996       -980.716            -6.007                 -37.352   -937.051         -147.970        -79.249       -242.493       -113.708     -67.988       -6.527                   28.910      6.773        36.046       228.437        420.327   -112.310      75.227   -101.507       0.000         46.584        276.244  10970.000 HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.346_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.346_chain_B_1_0000100001_0000001_0
RT 0.622714 -0.449007 0.640796 -0.712889 0.0119897 0.701174 -0.322515 -0.893448 -0.312626 -10.1147 -34.0499 -8.20316   HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
RT -0.0408824 -0.796458 0.603311 0.9935 -0.0966058 -0.0602107 0.106239 0.596927 0.79523 -7.15845 -2.13508 -13.7318   HKH_2021_1IRA_run_1_complex.346_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]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.346_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.346_chain_B_1_0000100001_0000001_0
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LGReqBljJ8D0/7GbQtkppBJHRTEE0vVbQ3UEqB5byVEUepFcQftJoBxDkXEEGIecQvJumBBEZXE0/eKbQszJmBFefYEkSjaaQQMMjBVwjcE0SyRaQW8miBlBwdE0H3hZQv1afBdiWhEUrBZZQUxFpBhUukDUizDbQ1R4qBRaRfEkeyFbQTxelBBnyKEkkLYbQMlFmBtRfmEEGtYbQ7LVnBV+YlE0DhMaQurvmB5RhJEEnhLaQpZAiB12rPE0WzfaQhGmiBRCmrE03qgaQfRwjBZC2qEka/TZQyROjBJizOEkl0SZQCX0eBZEDiEEDE5YQPNQdBBzLVEElblZQbgPeBVdRvE0tfmZQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
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L5w/LCdxWFIUfxalQpy4MCVqyJIE/melQRy5NCN7XIIkfpvlQnx6OCp0ELIE2DylQhdEMC1AmOIkMlllQWLTLCB3ZNIUhl4lQRekKCNKZJI0EW4lQ2bZLCl5oQIk61ImQwMELC9AdFIUybhlQpebNCx2sKI0F5PlQ3/sMCtb9RI0V/olQ56YLCN0vPI0PhZlQCk3KC168PIkTFWmQWb/LCtd3TIE6BImQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
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LHrEJCJzZXHUWJlmQi6AJCBXTTHUtZPmQbaMKC13vLHUmtNmQQXRLC90FOH0JNWmQxZHJC5c/bHE9M+lQrQAICBoXkH0Vk9lQd1XGCVxKfHEbm1lQu8hGCpZ9bH0GnZlQu/9JCVF+ZH06NqmQ6YGICVysOHENJNmQtBEKCFGKgHkT4/lQp6HJCx/GYHU29ulQQy5HC5y8nHk/6MmQGWSIC9DnqHkuRylQJUlFCpX1YH0OqTlQl3yGCBHIjH0knQlQt3SHC169VHEfbXlQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
LFuAKCZZCDH0OaCmQPnCLCRhD7GE73/lQ+/yLCtdR8GEYJrlQ7AOLCReR7GUD7ZlQd8XKCthAwGUM8/lQTBYLCh9KnGECD9lQdnmJC9CkuGEe9TmQG1FJC1g4BH0627lQEKvLCJ+t7GU8ONmQUlsJC1/lvGE3rylQB20KCV7sfG0898lQ435LChGCoGEs5tlQvoFMCh+LnGk3KKmQCXHJC5N7mGE+FTmQZWRKCNK2uGkKkhmQ8V2ICV2z0G00XVmQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
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LUUpOCp/atGkb6jlQpUYPCZ6bjGkdMilQiiiOC1BBbGku5WlQ1iYNCh6/YGUDDdlQ1AzPCpckfGU7W4lQuJqQCxghnGUGnFmQjxBSC1z2pGkON7lQ6T/SCxH2vG0htKmQgemSCBsR7GEFmOmQQhCOCBhwuGU8ewlQjRRQCBywkGEugYlQO/5OClcudGUlnBmQ4gXQClxNYGEws2lQnPHQCJ9BvGkCNHmQAm0QCNVPkGE6cVmQjYfSCdabiGkGK2lQSG4RC5W2uG08DtlQRg/SC1vorGEE9ZmQVv/TC5mpvGEQCEmQjuQTC1Sq+GUjzYmQilnSC5bS/GklmAmQPOrRCFSs7GUdBVmQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
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LtQXOCd4v3F0+sukQ2AxOCRngjFkeXlkQB9yOCtZMoFUnmNkQ9Q0NCZXvwFUHAFkQRntNCtgOSF04WpkQnX9NCpOi8EUNgekQPKlOCl7irEE6+okQAqiNC1T15EkvjJkQeSwOCl2aYE0z1ekQ2buNCl02mEESh/jQemUOC9fBWEEjFKkQLseOC9GrCEkDBAkQT1WNC9Rp6FEJivkQUkwPCVl1eFkI1qkQ8fmNCNmnPFk9Z6kQKawMCNJJYFE7mjkQGT6OCBq8sEktA5kQZKDNC165GF0rCBkQdWOPC1NELEkMNnkQkdYNClp5kE0/NvjQws0OC5elwDkmFKkQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
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LtXHQCVT4FFU/wYjQ4+0QCxR6yE0t+QjQztiQCFNwsEE+H6iQ47YPCBbfpEENzziQt0hQCZasfEEdWfjQlYHRC18EKEEUVYjQikoSCND0IEU8SZjQA0PTChepMEULCqjQdDQTCFGODE0ELHjQwjFPCVl8GFETDYjQ1V5RCJhL2E0xDSjQuE2QCBfBjEUdsvjQz1dPCZ3UdE0+afjQrVuQCtj77DE4JjjQNKzQCp9UGEUxFIjQc9PUCdX4BEUvuGjQImsSC5/CAEETg5iQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
LtUnRC9IxqEEq0tiQKmgRCFozkEkOgXiQcMCRClfjNE0XWViQlhkRCVQf+DEPEgiQE02SCVEtnEknaMiQH3zSC9kilEE+b0hQkGIUCNSmpEUHRqhQZOGVCtgyrEEJm1hQD6KUC9/NrEkW9WhQdYhSCNB6tEUVP0iQwDzQC57TvEk5+PiQG3QTChLJ3EEWMQiQIajTCBbwbEEuaSiQTJfSCZ+YVEk5QwhQliESCh2ywE0xLuhQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
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LH+qIC5MFmGkoRnkQH+qJC5MFmGkoRnkQH+qIC5MFuGkoRnkQ HKH_2021_1IRA_run_1_complex.346_chain_B_1_0000100001_0000001_0
SCORE:  -1491.392  -2630.459    275.502   1703.302               -151.549                 47.195                108.654    899.482       -970.888            -6.162                 -38.529   -941.026         -149.795        -81.306       -240.715       -124.861     -66.983       -6.481                   24.252      5.453        32.090       221.038        419.832   -113.231      74.514   -101.507       0.000         52.447        268.338   2585.000 HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.248_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.248_chain_B_2_0000100001_0000001_0
RT -0.63097 -0.775091 -0.0333247 0.771685 -0.63146 0.0758999 -0.0798726 0.0221744 0.996558 -21.9633 -3.03932 -34.6421   HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
RT -0.173859 -0.767667 0.616814 0.955027 -0.284215 -0.0845346 0.240202 0.574377 0.782556 -9.26956 -3.11307 -11.6106   HKH_2021_1IRA_run_2_complex.248_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]ALFLGIH[HIS_D]GGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.248_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.248_chain_B_2_0000100001_0000001_0
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LKvaPCdbtfIU+aejQrEDPChXteIkNKIjQkcuPCBoxZIkbu+iQm8AQCdOoZI0+mriQ5ttOC5GJfI0bIqjQyx9NCBAPeIkdMHjQzSTPCdLNiI03l+iQ HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
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LMmuCCR8IKIUTJNjQdg8BCl3KGIkspBjQySfACVWkHIkD4+iQTuw/B91ZKIUhmLjQgg9BCdMvAIUTGNjQOcSDCx6j8H0rhPjQJQ/DClz39H0yKijQWq2DCJbp2H04P/iQPVOFCRKa5H0dskjQKRGFCZUNyHEXzBjQZ5xFCBimzH0XjUjQSzZCCVQYLI075bjQ8ZXCCVNvFIEL6xiQSahBCVENBIkG9cjQW6UBCRM87H0IQEjQ4ZjDCh1TBIEuHvjQhaTDC9Kj1HE9UwiQsFxFCRom6HEhrzjQT0iFCNqntHU770iQpnwGCxUJwHkDoWjQ HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
L7nz/B1XaFIkJWuiQVP98BJ6uFIUHqriQAG/7BBNgAI0R50iQ88U9BhLz4HkHayiQo8P8BtjPGIkmjUiQ3UI9B1WVLIkj0KiQQFn/BVBlLIkCVBiQZEf7BRBxPIkcDLiQkKOAClUMQI07H4hQCqV8BF3bUIkiwBiQsU0+BdjpUIkuT4hQiWs/Bp5SZIEx3uhQUEdACNkTDIExkjiQVRI8BdBDJIkY30iQGQO9B9kBDIUDQMiQP0G6BtZ1FIUkhSiQd7cAC5mDIIkTFBiQ2Sh5B5vkPIUtlSiQtJLBCt7WQIUapwhQ1xD7Bt77XI0Z2BiQJeU+BJe+bI0FyvhQ HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
Lpvt5BpOjAIEFv/iQrRv4BZBO3H0aMJjQRcs1BJFU3HEPYHjQNMU0BVdu8HUksTjQ5cx5B9kC3HkYQgjQUbu5BBT5sHke2rjQagf7BBiAlHEUDmjQF8F4BtRSrH0p58jQfGo7Bl1nbHUMCxjQIZN4BRf4hHkSOIkQcMA6BhDAaH0MJCkQKzq4BRL/DIUoYBjQh1g5BFXYwHkkTAjQMr17BRwx5HUXJgjQXcp4BBy18HE6mpjQn7z8BtedmH0chYjQuyt2BVOjxHECfBkQAgC9B9AjVHEwQsjQgY52BlYugH0c4VkQZeI6BVjjSHUn4KkQ HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
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LrWJGCdMEsGkW//kQrWJHCdMEsGkW//kQrWJGCdME0GkW//kQ HKH_2021_1IRA_run_2_complex.248_chain_B_2_0000100001_0000001_0
SCORE:  -1494.268  -2681.041    286.323   1733.419               -149.546                 47.597                106.464    907.872       -985.665            -6.128                 -38.861   -953.777         -149.303        -80.373       -237.074       -120.547     -65.501       -6.265                   28.398      5.277        35.440       224.095        421.978   -112.234      74.742   -101.507       0.000         49.273        272.674  10334.000 HKH_2021_1IRA_run_2_complex.760_chain_B_14_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.760_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.760_chain_B_14_0000100001_0000001_0
RT 0.80486 0.502055 0.316452 0.583354 -0.767299 -0.266366 0.109082 0.398991 -0.910443 -17.708 -4.05564 -7.07558   HKH_2021_1IRA_run_2_complex.760_chain_B_14_0000100001_0000001_0
RT -0.121173 -0.707613 0.696133 0.960269 -0.261178 -0.0983351 0.251398 0.656559 0.711146 -9.37026 -2.78978 -11.9487   HKH_2021_1IRA_run_2_complex.760_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.760_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.760_chain_B_14_0000100001_0000001_0
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SCORE:  -1467.495  -2625.925    276.599   1695.605               -151.653                 47.516                106.640    886.679       -964.776            -6.047                 -38.027   -927.561         -144.727        -79.466       -236.637       -113.929     -60.523       -6.604                   22.891      6.082        34.356       222.258        422.267   -114.038      75.082   -101.507       0.000         42.017        265.935   8372.000 HKH_2021_1IRA_run_1_complex.746_chain_B_3_0000100001_0000001_1
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_1_complex.746_chain_B_3_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_1_complex.746_chain_B_3_0000100001_0000001_1
RT 0.98333 0.174704 0.0503948 -0.172642 0.810107 0.560287 0.0570592 -0.559648 0.826764 -16.0579 -27.8962 -19.6044   HKH_2021_1IRA_run_1_complex.746_chain_B_3_0000100001_0000001_1
RT -0.176896 -0.729833 0.660342 0.95485 -0.28996 -0.0646841 0.238682 0.619086 0.748174 -11.5934 -1.82284 -10.4205   HKH_2021_1IRA_run_1_complex.746_chain_B_3_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]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPHALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_1_complex.746_chain_B_3_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_1_complex.746_chain_B_3_0000100001_0000001_1
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SCORE:  -1483.765  -2659.073    282.234   1722.165               -150.500                 48.144                105.390    891.980       -978.655            -5.753                 -35.742   -944.165         -140.632        -79.181       -239.614       -120.077     -60.948       -6.337                   25.391      6.053        30.706       223.303        422.500   -112.198      74.245   -101.507       0.000         49.130        269.378  18127.000 HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
FOLD_TREE  EDGE 457 160 2  EDGE 160 1 -1  EDGE 160 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
RT -0.821876 -0.567504 -0.0495957 0.432363 -0.564728 -0.702954 0.370921 -0.599184 0.709504 -23.0659 15.0366 -28.5699   HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
RT -0.686873 -0.347492 0.638321 0.680918 -0.000644398 0.732359 -0.254078 0.937683 0.237056 -0.746839 -13.667 -9.42678   HKH_2021_1IRA_run_2_complex.25_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_2_complex.25_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_2_complex.25_chain_B_6_0000100001_0000001_0
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LBp7lB1mhVHUufJkQ+p2jBtUiQHkrd8jQmYWkBZc8SHkG5kjQlG8kBBqIcHk2YfjQmBFhB59iUHk95CkQJBmdB1yiOHU/V4jQiHPYBFt2RH00PAkQba/XBF1PYHkktOkQGWVUB91FOHUyq3jQkOdlBpZTbHUXLUkQlN6jB1C7HHUHt+jQW50gBd7JUH0g4TkQxx4gBxG6cHEXU+jQGQvdBlg4PHEIGnjQqtJeB5D/FH0IN7jQ HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
LeiDkBRXxKHkdQXjQbiUkBd79LH0ACAjQpoXiBdfQUHUDM3iQTPEjBRTEaHEdRoiQJ08fBRpRSHkHX5iQp10jBlzUBHEiP0iQ2+HmBd7w4GkPt0iQZGaoBVxF7GUJg6iQr4hlBZ7zvGUVduiQTdojBRzZDHkDldjQSWWmBZzpOH0Tk8iQRQDiBdyl9GE+L7iQ2oWjB1gDDH0xljiQ HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
LF/OCCpoUUG0AYjlQF/ODCpoUUG0AYjlQF/OCCpoUcG0AYjlQ HKH_2021_1IRA_run_2_complex.25_chain_B_6_0000100001_0000001_0
SCORE:  -1495.526  -2620.834    272.454   1684.677               -151.422                 48.149                109.451    882.023       -961.408            -5.747                 -37.108   -918.338         -151.836        -76.347       -240.109       -107.492     -75.125       -6.330                   25.303      3.893        32.995       222.622        414.721   -114.894      73.081   -101.507       0.000         39.337        264.267  13441.000 HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
RES_NUM A:1-311 B:312-456 z:1 HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
RT -0.475804 -0.835391 0.275196 -0.776256 0.251724 -0.577981 0.413566 -0.488628 -0.768248 -13.3888 -34.8985 -0.225915   HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
RT -0.101872 -0.749507 0.654111 0.949265 -0.269891 -0.161413 0.297519 0.604482 0.738975 -6.27193 -3.30098 -12.976   HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
ANNOTATED_SEQUENCE: D[ASP:NtermProteinFull]KC[CYS:disulfide]KEREEKIILVSSANEIDVRPC[CYS:disulfide]PLNPNEHKGTITWYKDDSKTPVSTEQASRIH[HIS_D]QH[HIS_D]KEKLWFVPAKVEDSGHYYC[CYS:disulfide]VVRNSSYC[CYS:disulfide]LRIKISAKFVENEPNLC[CYS:disulfide]YNAQAIFKQKLPVAGDGGLVC[CYS:disulfide]PYMEFFKNENNELPKLQWYKDC[CYS:disulfide]KPLLLDNIH[HIS_D]FSGVKDRLIVMNVAEKHRGNYTC[CYS:disulfide]H[HIS_D]ASYTYLGKQYPITRVIEFITLEENKPTRPVIVSPANETMEVDLGSQIQLIC[CYS:disulfide]NVTGQLSDIAYWKWNGSVIDEDDPVLGEDYYSVENPANKRRSTLITVLNISEIESRFYKH[HIS_D]PFTC[CYS:disulfide]FAKNTHGIDAAYIQLIYPV[VAL:CtermProteinFull]S[SER:NtermProteinFull]SKMQAFRIWDVNQKTFYLRNNQLVAGYLQGPNVNLEEKIDVVPIEPH[HIS_D]ALFLGIHGGKMCLSC[CYS:disulfide]VKSGDETRLQLEAVNITDLSENRKQDKRFAFIRSDSGPTTSFESAAC[CYS:disulfide]PGWFLCTAMEADQPVSLTNMPDEGVMVTKFYFQED[ASP:CtermProteinFull]X HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
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L/lhJCZkgtG0kGjkQ/lhKCZkgtG0kGjkQ/lhJCZkg1G0kGjkQ HKH_2021_1IRA_run_2_complex.834_chain_B_19_0000200002_0000001_0
SCORE:  -1492.437  -2628.441    274.877   1693.505               -149.714                 47.017                104.677    888.699       -965.751            -5.455                 -34.012   -937.411         -147.686        -80.161       -236.324       -120.156     -64.742       -6.383                   25.850      5.580        36.040       224.447        413.805   -113.428      74.283   -101.507       0.000         44.029        265.928   2742.000 HKH_2021_1IRA_run_2_complex.273_chain_B_3_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1IRA_run_2_complex.273_chain_B_3_0000100001_0000001_0
RES_NUM A:1-311 B:312-457 HKH_2021_1IRA_run_2_complex.273_chain_B_3_0000100001_0000001_0
FOLD_TREE  EDGE 457 198 2  EDGE 198 1 -1  EDGE 198 311 -1  EDGE 1 312 1  EDGE 312 456 -1  HKH_2021_1IRA_run_2_complex.273_chain_B_3_0000100001_0000001_0
RT 0.389077 -0.310049 0.867461 0.915641 0.0268204 -0.401101 0.101095 0.950342 0.294329 -16.9637 -5.30228 -35.0688   HKH_2021_1IRA_run_2_complex.273_chain_B_3_0000100001_0000001_0
RT -0.0782353 -0.905106 0.417926 0.986678 -0.130277 -0.0974363 0.142636 0.404736 0.903241 -10.2502 -2.46002 -12.4434   HKH_2021_1IRA_run_2_complex.273_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]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.273_chain_B_3_0000100001_0000001_0
NONCANONICAL_CONNECTION: 76  SG  24  SG
NONCANONICAL_CONNECTION: 84  SG  3  SG
NONCANONICAL_CONNECTION: 144  SG  101  SG
NONCANONICAL_CONNECTION: 176  SG  122  SG
NONCANONICAL_CONNECTION: 292  SG  228  SG
NONCANONICAL_CONNECTION: 421  SG  374  SG
CHAIN_ENDINGS  311 HKH_2021_1IRA_run_2_complex.273_chain_B_3_0000100001_0000001_0
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