SEQUENCE: MLDAERLKHLIVTPSGAGEQNMIGMTPTVIAVHYLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLCGAVKWLILEKQKPDGVFQEDAPVIHQEMIGGLRNNNEKDMALTAFVLISLQEAKDICEEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQAISCGSPPPILNGRISYYSTPIAVGTVIRYSCSGTFRLIGEKSLLCITKDKVDGTWDKPAPKCEYFNKYSSCPEPIVPGGYKIRGSTPYRHGDSVTFACKTNFSMNGNKSVWCQANNMWGPTRLPTCVSX
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:  -1305.781  -2784.519    308.978   1846.722               -151.095                 47.940                 99.703    967.249      -1061.937            -4.309                 -29.677   -900.990         -108.719       -231.822        -74.383       -106.918     -61.482       -6.832                   35.313      5.200        36.698       191.732        360.366    -95.442      85.369    -33.370       0.000         78.985        281.460  12651.000 HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
RT 0.701561 -0.0549281 0.710489 -0.61764 -0.544163 0.56781 0.355433 -0.83718 -0.415689 -32.8675 -4.69758 22.4504   HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
RT -0.409282 -0.3752 0.831693 0.115609 -0.925515 -0.360634 0.905054 -0.0514494 0.422174 -0.456255 -1.46471 0.749313   HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.215_chain_B_20_0000100001_0000001_0
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SCORE:  -1334.713  -2744.557    292.924   1839.550               -152.398                 46.332                 99.547    957.371      -1050.842            -4.280                 -28.989   -897.252         -113.271       -232.755        -72.805       -100.316     -63.923       -6.982                   22.654      5.971        33.794       197.159        350.903    -98.580      85.785    -33.370       0.000         69.368        264.252   7510.000 HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
RES_NUM A:1-307 B:308-437 HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
RT 0.491662 -0.834731 0.247977 0.851387 0.52058 0.0643203 -0.182782 0.1795 0.966628 -27.8833 -37.9896 5.65267   HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
RT 0.226575 -0.970242 -0.0854105 -0.520231 -0.0464179 -0.852763 0.823422 0.237648 -0.515267 1.74238 -1.28038 -0.18893   HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKH[HIS_D]LIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.566_chain_B_5_0000100001_0000001_0
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SCORE:  -1332.584  -2741.062    296.012   1834.762               -153.773                 45.938                100.987    957.563      -1049.520            -4.336                 -29.427   -897.941         -108.951       -233.999        -75.442       -100.404     -68.514       -3.800                   27.755      3.201        31.295       190.203        348.025    -94.994      85.314    -33.370       0.000         73.792        268.103  11946.000 HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
FOLD_TREE  EDGE 437 279 2  EDGE 279 1 -1  EDGE 279 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
RT 0.890689 -0.0799717 0.447524 0.283249 0.867602 -0.408701 -0.355588 0.490786 0.795415 -33.9842 -10.3218 1.94374   HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
RT -0.316688 -0.82865 -0.461572 -0.935967 0.194062 0.293779 -0.153866 0.525052 -0.837046 0.458929 -0.510308 -0.824038   HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.218_chain_B_14_0000100001_0000001_0
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SCORE:  -1332.821  -2712.390    287.357   1803.862               -151.129                 45.062                 97.544    954.664      -1039.168            -4.017                 -28.280   -885.283         -107.166       -233.772        -72.657       -101.115     -59.892       -7.014                   24.405      2.028        33.716       195.784        344.676    -97.932      86.830    -33.370       0.000         65.694        258.741   6534.000 HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
RES_NUM A:1-307 B:308-437 HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
RT -0.496516 0.394204 -0.773353 -0.0103816 -0.893565 -0.448814 -0.867965 -0.214815 0.447762 -4.20429 3.69168 48.0107   HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
RT 0.255868 -0.966257 0.029655 -0.646145 -0.193757 -0.738211 0.719047 0.169723 -0.673918 -6.42163 1.5353 -5.62968   HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
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L0uHtC16sTKUzm0iQ0untC16sTKUzm0iQ0uHtC16sVKUzm0iQ HKH_2021_1GHQ_run_2_complex.1202_chain_B_1_0000100001_0000001_0
SCORE:  -1339.494  -2758.339    301.507   1826.808               -152.352                 46.903                 98.675    962.018      -1051.678            -4.204                 -29.269   -904.110         -111.600       -234.990        -72.128       -102.369     -69.378       -6.845                   27.649      3.893        34.173       197.057        350.617    -93.345      86.462    -33.370       0.000         72.508        276.215   1110.000 HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
RES_NUM A:1-307 B:308-437 HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
FOLD_TREE  EDGE 437 280 2  EDGE 280 1 -1  EDGE 280 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
RT -0.589815 0.00795728 -0.807499 0.589671 0.687436 -0.423934 0.551731 -0.726201 -0.410152 -4.95351 -15.3145 5.03677   HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
RT 0.0435493 -0.917029 0.396437 -0.400603 -0.379544 -0.833945 0.915216 -0.122496 -0.383893 -5.31903 3.06529 0.347383   HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.695_chain_B_8_0000100001_0000001_0
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SCORE:  -1365.349  -2699.157    276.298   1793.663               -152.027                 44.768                 99.822    945.869      -1031.974            -4.213                 -28.807   -886.672         -110.997       -234.872        -73.676        -98.160     -63.682       -6.826                   19.541      3.639        30.826       190.413        347.747    -96.897      83.983    -33.370       0.000         67.932        251.479   6219.000 HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
FOLD_TREE  EDGE 437 154 2  EDGE 154 1 -1  EDGE 154 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
RT -0.160274 0.477915 -0.86366 -0.217198 -0.870602 -0.441449 -0.96288 0.116833 0.243337 -7.20473 32.9829 70.9181   HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
RT 0.586396 -0.659989 0.469632 -0.677116 -0.717598 -0.162997 0.444583 -0.222415 -0.867685 -1.86554 1.15543 -0.812441   HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
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Lt9csCBiSbKEDNTgQt98sCBiSbKEDNTgQt9csCBiSdKEDNTgQ HKH_2021_1GHQ_bound_native_5_xtal_0000100001_0000001_0
SCORE:  -1351.251  -2744.303    293.810   1809.217               -153.987                 46.567                100.526    957.499      -1041.709            -4.137                 -28.064   -885.533         -106.044       -235.792        -73.679       -103.538     -58.257       -6.642                   22.008      5.355        33.226       192.993        341.902    -97.154      87.943    -33.370       0.000         66.160        263.752  15324.000 HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
RT 0.457757 -0.884286 0.0921763 -0.864257 -0.418253 0.279507 -0.208611 -0.20761 -0.955709 -9.32543 2.04175 46.2574   HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
RT -0.331452 -0.337237 0.881142 0.240342 -0.933304 -0.266794 0.912346 0.123346 0.390397 -0.53187 -3.83088 -0.588102   HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.434_chain_B_9_0000100001_0000001_0
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SCORE:  -1240.160  -2776.117    324.886   1875.933               -153.889                 46.893                102.001    985.608      -1067.751            -4.056                 -27.754   -902.583         -111.091       -232.828        -66.556       -110.435     -69.770       -6.691                   39.988      6.072        31.914       190.701        344.826    -99.382      87.985    -33.370       0.000         76.037        309.269  19100.000 HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
RT 0.912525 -0.169601 0.372202 0.0190733 0.926636 0.375476 -0.408577 -0.335532 0.848813 -29.4341 -10.2214 35.2827   HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
RT -0.350521 -0.257957 0.90033 0.201136 -0.959624 -0.196638 0.914702 0.112163 0.388253 -2.3927 -4.10482 -3.63886   HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
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Lt2HtCR5QYL0utkiQD7CtCJO/XLEr37iQloNtCtDNVLUv4DjQ+UKtC9wPTLk/83iQoyVsClqqYLEpJDjQEHJsC5JkbLU6YAjQOySrCVMOcLEZMJjQfdWrCxr5bLEg/ljQ7LusCFr5XL0KCbiQM/YtCR5XZLkpjDjQGA/rCRzbXL0Lg6iQ44SsCBEJYLUI6TjQD3esChZ1cLU0ZJjQnwLsC5qGcLk3cviQOK3qChXScLUDEtjQFogrCpK5ZLUQVqjQaZtrClpWdLUtKsjQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LErbtCxaCVLEVEYjQrYitC1lbSLkX9hjQQS9sCBkWRLUqQvjQs7vsCtznSL0v1+jQN5IuClVdSLUK3wjQyYxuC1mbSL0OSmjQw8NvCl0aUL0k9jjQX/CvCRCLQLE9nbjQQEwvCtfgTL0rGZjQEspvC9p6QLET4TjQL70uC1coNL0DOYjQ4EDwCVYMPLko8IjQs2NvC1O5LLE9WNjQ3F0vCJrnML0c2FjQZzftCB8tWLkFygjQrjotCplARLk3IVjQtsHuCRCQULkKr6jQLgHuCFDzQLk+m7jQyfKvCdRcWLUqGqjQHNLwCpqkULEOIVjQdQWuChnANL0lEejQ8jhwC5n0PLEs9CjQXnBvC1u7JLkQ/KjQFAHwChaKLLUSN9iQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
Lr0vsCpJ7OL0GcpjQzeQsChENNLEo+zjQqairCd5LOLETmzjQdhZrC1CeQLEkrtjQB98sCVuNOL0frbjQSOSsCpGRLLkKSsjQ3UasCB76ML0XlEkQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LnVDrCRsaMLEjh4jQ49WqCt/ENLEXE9jQ6FTqCtxVOLErVTkQQdzpCp+pPL0weYkQy5AqChFWKLkSj7jQ6cjqC9SVIL0YQBkQamMrCFogJLkGt4jQtIErCNGbML0Ng5jQu9KqCl7cOL0RtwjQCklpCRBSKL0lqGkQ1/zpCB3CKLkZVrjQthkqC5a+HLENmSkQPobqCJ+ZGLUe75jQuOmrCxECJLklIEkQKFTrCtVwILk/ZojQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
L9Y0qChE6NLEzRgkQ7J4qCBD0OL0BN2kQ0ZjrCFyKQLEyX4kQfG/rCR21PL06pqkQPu1qCRBeMLEy4FlQSSarCV3zKLEcwClQniNqClZ1KLkN9BlQlMNrCFe0MLUU7akQbDfqCVzQQLkjs5kQan1qCt+NNL0/PWlQBgzrCVTrLLkzrIlQAgMqChFLJLU4LNlQXjxpCpYGMLUVOElQUdNqCttDKLEm4xkQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
L9bqrCROmRL0H4JlQz+SsChiATLk3aMlQIP3sC5SZRLUHtWlQ0tvsC52jPL0QrjlQS0LsC5UmVLk2qYlQvSrrCBwlXLkn8NlQed7rC5M9YL0Xt5kQaZ5rCN8KXLUo1mkQhKWrCZMoWLkZ7akQotwqCxzvXLkCSfkQotZrCtu7ULEtxKkQxQTrCd6wRLkWEVlQNeesCZchTLkJm8kQl+/rCNAJVLkToolQjPqsCx5oWLkMmalQ7UOrCh3fWLEq3JlQBUjrCl2JZLkzbZlQwforCRLvaLkQd2kQDwcsCxaiZL0pA8kQv1UsCN1OWL0ZWikQOwtqCtXCZLUIlrkQH4WqCNuSXLkuOWkQjN3rCVmCULkKbHkQJFArChyeULknhBkQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
L3YetCFSSSL0eLRlQYBHuClpPRL0j5YlQzsKuCdRZRLUL9wlQLD6tCh1QTL0Mr6lQJYsuCFr6SLkkuPlQat3uCRgkSLUuV4kQRNVvCRPxULEjTxkQRKQvClh/PL0u81kQPgftCVBzTL0leGlQQxIuCdZNPLEWOTlQRakuClFBVLkwASlQXOJvC9ehSLU2JZlQd5auCB5kSLUKiukQAvdvC9ReULkWngkQLMFvCBgsWLUxFzkQa/xvC5BvULE4N7kQI1YvCtdxPLUsllkQv7svChMFQLUlu/kQLQ9uCx3SOLkY56kQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LXbfuCFRbPLkL96lQznnuCZMOPLkQbRmQeBLvCpZ/QLEEtYmQMBlvCpB6RL0z/LmQEO0uCtVTMLEH6TmQ+WJvCd9mLLE0M/lQzFyuCFnMNL0UnulQ7hhuCtPgPLkvt6lQRDLuCt3vPLUYXamQKPKvCxFJMLEiUhmQqRYuCxxDLLEFjXmQDJrvC5eEML03CAmQJAHvCZAdJLUXN8lQzCJvCFu5NLU/vilQinZuCVE/LLE4znlQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LLdMvCxsWRLkOXtmQ+lwvCBtjSLkXI4mQgm+vCNxgQLUGnInQXajvCJvJPLEAISnQlwkvC9wPVLUcxCnQWlVvCd4CXLEkuymQ57LwClifWLUbjNnQ1yyuCFqtQLU8M2mQ3wKwCBq3SLES3smQCtLvCJU7ULURqOnQvp6uCRpXWLEKTtmQL6CwCVEZYL0WsUnQeDYwCBDMVLkX+ZnQU0kwCFx0WL01uBnQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LsOowClGKQLknZLnQhw2wCdEYOLEwCcnQrt7wCVZGQL0N5vnQeIOxCN/RSLkcFvnQTXfxCV1+ML0dIVnQTLXxCND1KLkse+mQj0+wCBqMRLk12CnQujewCFh3ML0MEfnQai2xCJvbOLUt7QnQ0FsxC9R1LL09thnQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LjDqwCtiLPLUlzAoQPipwCxQyQLEvgKoQWm7wC9TXPLE3RUoQc38wCF95MLUjuUoQer6vChLrRLE0rMoQ67pvC5QYTL0fODoQmZdvClNMPL00JOoQRjcwCFuUNLkZjAoQ7v8wC1ikSL0KIJoQP+5vCRr5SL0R5ToQwWJvCxpBULkL4EoQMZ+vCF+HVLEQMCoQBDqvCJ7MSLUky3nQuz8uClK2PLERuPoQq1dvCJM+NLUq6GoQQyovCB0/NL0e6UoQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LdRIxCBx7QL0ROcoQEKZxC9r2PL0LKmoQtn1wC5YkOLkFusoQqL+wChL6MLUSrzoQXcRwCVUiPL0iSsoQs9txChtESL0jpsoQbVRyC50LTL0jQnoQK0GxChM8SLkIYboQTExxCJCVOLERRkoQBdWxCRSoTL0vRuoQdS4xCBRRRLUvU0oQj3cyCpqgULkgAsoQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
LdhivCxYXiKUtfciQdhCwCxYXiKUtfciQdhivCxYXkKUtfciQ HKH_2021_1GHQ_run_1_complex.721_chain_B_10_0000100001_0000001_0
SCORE:  -1339.986  -2729.081    282.687   1819.827               -151.755                 46.007                 99.333    953.683      -1043.309            -3.941                 -27.442   -884.814         -113.397       -233.101        -70.500       -104.076     -61.882       -6.578                   22.341      2.488        34.042       195.075        348.275    -97.792      86.112    -33.370       0.000         69.641        261.542  13959.000 HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
RT -0.372356 0.274089 -0.886694 0.292778 0.941302 0.168021 0.8807 -0.19704 -0.430747 -1.01634 -24.2616 -6.47453   HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
RT 0.255662 -0.966584 0.0187851 -0.65925 -0.188519 -0.727908 0.707125 0.173715 -0.685418 -1.07432 2.98818 -2.50148   HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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L5214CZtmOKkjx4kQEvY4ClsSMK0Gz3kQkzx4CZNrJK0mj6kQpEW5CpxcJK0o9ykQBGA4CFCPMK0hZikQh4c3CRr7JKE54ekQAU12CV7cKKEHctkQT2P3CBIzJKEGRHkQY0J5CZ+5OK0XQskQH2B4Cl9cMKkX2ElQYTv3CB5GOKEVehkQkDX4C1YIMKUePVkQvfq3CdCAIKUiSjkQIxd2CRs4IKUwKrkQqw+2CZmfKKEt+9kQbLn2CddWMKUlKpkQs342C1PMIKEEPFkQJvB3ChVqLKU9QCkQPHs3CpPYJKkOd9jQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LvtU4CJxbAKkuGMlQr8z3CFlq8J0t8KlQ5rQ3CFmV9J0GvblQVQr2C1/P8JERNXlQaqI4CJyN3JUpmNlQQWz4Cx13/J0EvPlQyDl3Clm48J0OO7kQHkw3CVlG0J00TMlQy8g4CFjn2JEwTBlQwnX4C1q+2JECYdlQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
Ljmc3CZGJ/JE21ulQqR/2Cl/5/JUPwAmQ7+f2CpcRCKEmW9lQtg51CV7ACKk2tBmQAVa3CF0SAKEG2UmQthw3CxVW7JU25bmQnFW4Cxqy5J00+NmQell4CNHJ9JkiVCmQbni4C5cO1JkmsOmQBb83C977/JkfXxlQ7ms2CFhQ8J0whCmQvWz3CNOxBKEYsRmQXRH3C5pEBKUMghmQC673C1m17JkmPsmQNEZ3CRYI4J0n0bmQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LUgV1CZnDAKUnHTlQJn40CZEE8JkWJclQTzQ0CJxY+JU+ZmlQG9tzClJM8JkysjlQcXP1CBMn4J0u8slQqWz0CVmM0J0rP3lQ9rM1CJ47wJEexHmQOMw0CV4zsJE8FTmQLKI1C9yvpJkLAkmQgC11CFW2/JEqSXlQaBu0CNJe5JUSRPlQIJr1ChIt2J0ypllQz7a1CNrI7JEdv5lQI9X0CpZ/1Jk8V/lQQin0C1+hxJkAwqlQAFn1Cx+4uJ0i2/lQs8Z1CdRpzJk4uTmQaXV0C153uJ0koamQ0zj0C51/pJ0eSHmQ2N00CJRHnJEqDrmQR0g1CBzwnJ0XXdmQ9fT1CNJRsJkKVvmQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LlvXzCRsvDKU+XXlQQj5yCtypEK0xNHlQ0RfyCFuVCKEbH+kQV8ByCJPzCKEBjxkQvHRzCt4HGK0mJ1kQ8iozCdtxIKkim7kQeLC0C1fvJK0SEpkQvwHzC9Q+KKEz5BlQiq1zC5MLDKEffSlQGKjyCpHBGKUyvOlQzDpzChSxEKEPnukQJT6yChAlGKk4cokQsW+zCxdYIKUf/IlQgmS0CF5jLKklotkQUUZ0C5bPIKUyvkkQoHtzC5kIKK0ojbkQ3AZzChbzMK0FJGlQHlyyCRJYLKk2b0kQp40yCJ8VKKkFiPlQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
LDWoyC9Wu/J09tElQUtNyCFaV7JEuJ9kQRiqxCdXv6J0gjNlQB0xxC1LH5J09yflQqkmyCl6/1J0H86kQn5NzChVo2J0SmrkQPhIyCBWWxJ0OG0kQ8HEzCFod4J0ctUkQIvAzCdUC/JEKWPlQU9+xCd/X8Jkc9tkQD9zyCdMB1JkYnKlQsBkzC9+g5J0NyykQXpdzCx6wyJktkqkQwyayCJYptJU7azkQBwuxCVu5wJUDv/kQx86xCRsHyJE+zkkQQ9hzCdlu4JkcrLkQY7uyChtp1JEa1MkQgL1yCd5X8JkdMVkQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LDycvChMn3J0VRalQ/x1uCZQ00JEjvUlQF/RuCBN84JU0fRlQ7vJuCNFF8J0iEglQNIquC9L1wJ0fxmlQ6SMvCVh8sJ01DplQXp/tCtd+tJ0xtilQ0PivCVwe4JUr1plQ1/7uCJRjyJE2XGlQbanuCl1BzJUkw1lQACQvCJyCrJElnblQvb5tCFJRrJk+vvlQevltCNH6wJU0lhlQpHBuCVeurJ0UCUlQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LQDbsCpzJAKU3MJlQ54vrC9BLAK0U0RlQB8drCFv7CKEIQOlQKF2rCJSzEKkz1JlQ1ZvrCxd++JkbbplQu/CsCdFgBKEis1lQxNpsCBu8BKETUHlQ9GcrC5pg9JEkPJlQZSOrC13c+JEBsulQDu/rCZFL7JkH/rlQ7KBsCVB7AKEaMEmQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
LrL0qCVEPDKU2mQlQSHhqC5/3FKkb9OlQ6HGqCpnWGKUWR7kQFy9pC5FlEKE7OukQa6hqCdToBKUQ4TlQpSNqCpgRGKEO1clQHd6qCV/WHKEoePlQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LVm0mCRFouJEUZlnQFvNnCpIezJUyDinQqoqnC9nG1JUTj0nQ0ubnC1Jt1JE9XDoQYgxmCl6V4J0Y2dnQ+KemCp7b4JkuIJnQDP1lCFcd3Jk/hDnQgZ0mChCj5Jkq61mQICxlCJgA4JEQNumQRZXmCtVP5JkgrlmQS5dnCJZw6JkrXxmQUqimCtBF6JkJBRmQ5OpnClUl7Jkn2cmQ1uMnC1PQ7JED/MmQ5AZmCpjyuJU9ytnQr5hnChwzyJUZGUnQMJYmCxvg4JUyupnQqcEnC9b97JUipfnQUbblC53c2J0CeOnQ8fVlCZrl3J0NLlmQxg1nC9AC7JUGC+mQgeLmCtRz5JE0SEmQd3JoCphf8J0wtZmQyfXnCdx77JEg18lQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LDbypCFXz1Jk77IoQHVHqCNymzJkxWSoQnJ2pCNhe2JUmTcoQk65pCRni0JUdTloQSs2qC1Bv0JkNNQoQIA3qC9Bl5JE35IoQL9OqCV/H5JE5ECoQ0YxpC1hI2JUnNJoQJBBqCVHSvJUgzSoQ+RHrCFBf1Jk90XoQ27FrCpXNxJU9kMoQgU4qCNoT9JE8kNoQnKUrCdUd5JkdKEoQQlCqCpfO9JUmCBoQ53VqChNJ3JEA50nQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
LW6ipChRJ7JE9SaoQzsPpCl0s+JE+AioQY1ioCtG8/JkW8doQrBZoCJpC/JE5lUoQPTppCx58BKkrDjoQIHnpCNpYDKUSKZoQ10XqCxAWBK0YjloQzohpCRuc8JENuSoQAXNpCJst8JkZwpoQfvbpC9QLDKksapoQdHKpCtrBEKExAYoQqhpqCxaNDKEiPmoQXvZqChwPAKE3DtoQyslqC1oJAK06OfoQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
L/1HoClpHBKkypkoQ/PcnCh4tBKk9LhoQg8VnCtbaEKkpmboQGetnCRMXGKURodoQqh9mC5ogBK0pmqoQyR7mC9ia9JEgHwoQlRjmC12M5J0IupoQVf9mC9c92JkRAhoQvjbnCFnGzJUFCioQoijnCdP4wJE1droQbNxnC14kxJE9cZoQuKRoCxAhBKkaOsoQaOTnCR/NAKEBWboQcoGnCZZ9CKE4rwoQ6UdmClMCCK0l9noQYtbnCNf+7JUzaxoQdSrmCRJ19JE003oQdTZmCVR91J009uoQU+GmCpSB7J0BKmoQxE5mClPd4J0AiZoQ6GTnCdlByJElByoQTR6nCRHBuJ0xFsoQBNrnCFGVzJ0oASoQdCIoCVHvuJ02AaoQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
Lh8zmCp/cEKU6+UoQCukmCBfyGKk7MPoQCpYmCBR+IKE/8WoQy1KmCpLYIKUc2foQgv7lC1AIGKk5zIoQd5+lClAYEKkm29nQzdSlCVwlDKktw2nQlOSmCVg+FKkOLsnQ10jmC9GuCKEl+ToQ+W+mCBbaHK0d8JoQa3llCpZHFKkYQOoQfQslCVM/HKEydGoQ+tRmCthlCKEYkAoQzkUlCxUXCKk3eonQF3ClCBkcCKEItBoQoj/kCl1YFKU/VznQkFTmCRTxEKUH7dnQQQ+lCxSuHKEzVpnQdSymC1GoGKkRNwnQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LHkYlCpqBQKUVnhoQJ3ukClhSRK0w4hoQrH4kCRARUKE3zhoQI2WlCR0KVKU36moQlNUkCxjfQKk3yroQNkNkCxkqNK0PvroQvaojCJ+4RKE3hroQalulCFIeQK0YbnoQw6ckCZvyQKE0qaoQsOlkClkDRKkREzoQSpokCFWyMK0C5soQx7VjClRSRKk7eyoQkRsjCtNDUK0iqroQWaXjCdDURKEyRkoQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
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LxIUjCxGDhKkff2oQzUQjCBL7jKU/x3oQqCtjC9P2kKEf6ApQLY4jCdvMnKUMoBpQibyjCt+UjK0xiIpQVMiiCZ7qkKk8O6oQCpGiCZV/jKkTwxoQWb7iCVe4fK0B04oQthajCtC6kK0tYwoQb9XiCNKqjKk4gBpQsVgiCxD0mKEFu7oQP5qhCBcokKk/yzoQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
LBHuvCtMmQKkk7ijQBHOwCtMmQKkk7ijQBHuvCtMmSKkk7ijQ HKH_2021_1GHQ_run_1_complex.482_chain_B_1_0000200002_0000001_0
SCORE:  -1340.203  -2756.932    302.572   1818.710               -151.252                 45.973                 98.469    959.160      -1047.671            -4.147                 -27.043   -897.935         -111.364       -233.463        -74.272       -107.699     -68.864       -7.016                   26.306      6.085        33.564       194.948        354.111    -96.777      84.799    -33.370       0.000         75.959        276.944  21056.000 HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
RT 0.859026 0.442196 0.257947 0.205309 -0.759154 0.617683 0.468959 -0.477648 -0.74292 -38.4708 -34.5727 10.2569   HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
RT 0.255925 -0.965671 0.0445173 -0.665448 -0.209389 -0.716474 0.7012 0.15374 -0.696192 0.650644 0.887346 -0.845174   HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
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Lb+tuCFymaKkUlGoQbpRvCdpIZKUF/BoQiW9vC1dxZKUssGoQdTHwCpvEcKkgDJoQChSvCRttZK0QLsnQmBevCFErcK0GrnnQituvC55yXK03AhnQ5XuuC5XpcKEjLHoQecLvCRpAXKU+IDoQzKzuCp8cZK010mnQlmcvC1WEdKERpWnQ4bHvCtY8dKks5vnQzZ9vCpSIdKUpFtnQkZtvCN/JYKUTNQnQcqOwChw8XKE0DmnQc5ivCRszVK0xZknQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LZPYwC1ytXK0adHoQWMExCRh9XKUwNLoQyjkxChkiXK0yKCoQDSexClK1VKEvM2nQFMMxCF69VKECOUoQxz2wCFwrWKE2jeoQh1KxCJKwXKEZPnoQdrJwC5geWK0iehoQ4ytwCl3MYK0UUvoQb8FwCdxcXKkf5roQJrkvCVYkVKUVKcoQiKfvCBtjXKEqFxoQBF+uCFfsVKUhZhoQie7uC5+qWKEhkroQwNNwCx74VKErbFoQ8tIxCNz9ZKU+ZOoQfHBxCVSBUK0m0RoQebuxC1w1VKEGsVoQGHtxCp6LYKUlvnoQl90wC1m+YKUXk2oQU+lvCpbyUKkiIUoQRHcvCVhUYK0AN5oQIahuCp0/UKEiMdoQSjcuCtJwWK0scvoQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
Lx7HyClJDZKUF0CoQR1ryCFk4YKEao2nQIzKzCVEtWKEpS9nQ+rczCZMxWKUfcHoQ1AEzC5jjbKkpi1nQx/yzCFFkbKEXRknQZjJyCNocaKUM0IoQYafyCFbaYKU8wmnQX6uyCJvGdKkO9vnQ/NOzCN9HcKUtzCoQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
La3QzCRjxUK0a5unQRlqzCJ1WSKEG/xnQvRa0CJipSKUo8snQzko0CxgiUKU0dinQnvXzCV4DQKUo3knQwIryCF8NPKkrGsnQSnYyCpz7MKkx6enQ4qeyCt1hKK0lNjnQ6JCyCVlrNKkIWOnQ01AzC5y8UKkzqgnQTJozCNOyRKkmXBoQP/VzCx3oQKEQQUnQpdszCN6TOKU6BmnQJBuyCpLkOKUoa8nQ+fVyCls7QKk/CrnQ/B1xCprTMKUKcEnQuF+xCZLpPKkcULnQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
Le4y0ClzpQKUrH0nQVoh1CtKcQK0opxnQXHv1C9OQQKkIUanQVMV2CRXhQKEMCVnQuUy1CN7/NK0Mc9nQ/Gk0CdSLPKkq48nQp8v1CdwOSK0Gl4nQ98U2Cpl5NKUZ87nQ99p1C9CHOKkDEHoQQEk1CBANMKUYn2nQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LFCQ1CVonPK0BiMnQRaW1Cd6WPKEum1mQPnI1C5X2RK0YmpmQmBG1CFLxRKUjDWmQ7+90CdZ/MKU1gsmQbPR1CZ/8LKEBnXmQOL41ChGnLKktiWmQye30ClccLKE3jHmQSiy0CpqYPKEL0SnQfG41CtRHPKUieymQ5n90CNZXLKE/L4mQAzc0ClckNKkSmpmQdRD1CpxpKKU7g5lQ7DY0CZmxLKk2DJmQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LeOB1CBIFUKUiB1mQ8lz0CNVpWKk5yrmQV7G0C9cZWKUNFimQiJ7zCBN3XKkHZTmQFoS1C9ScXKkRHamQ5gA2CdkdXKk4JhmQJvP2CBoDZKENRumQyAY2CZvjVKEatYmQdXD1C1vAUK0VWFnQMgy0CBVKYKk+Z4mQ2HP1CV/NWKE6/LmQwpK1C56dZKU6HVmQwv22C5DXVK0g5cmQLvK2CBJRUK0zQOmQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LNpuzCxBgUK0qWqmQsuDzCpV6TKUiFjmQczhyCJ+5UKkbVymQw2kyChVeUK0utFnQr6/yCpi3QKkZChmQnwUyC9B0PKUiKZmQboTyCpnNMKEk6VmQj2xyChlwLKkn79lQs36zCxzcTKE1o2mQxr+yCVC3UK0ujTmQ/5YzCpRKQKEbhWmQhnFzChi9PK0YdwmQcO7xChbXQKkYPkmQZ5NyCtHtQK047JmQnBzyC13qJK0y75lQThiyCto2MKUw/wlQgRSzCJHgMKU6+/lQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
L1EAyCJRIWKkj8pmQVNdxCpFwWKUQy4mQpN8wCB2iUKkSk6mQDfmwCR36TK0z2qmQW3CxC50HZK0uYymQXnSxCZrqbKUaY1mQFwfxCF9YdKUVhmmQe0WxCpg+cK0iSJnQj2qxCxZrfKEv4vmQ0ilxCN6cfKUCMFnQj+OxCpkPcKU3xdnQsjsxC10OhKkozUnQW1VxC9dBeKUUztnQsMkxC9/cgKECnpnQSs/xCdkiWKkcyZmQjvqxCdlGXKEsmInQJm+wC9R/YKEJohmQt8jwC9IAZKUHz5mQLegxClwAdKEwRVmQh61xCxnWhKEBPomQtuDxClBTaK0JOhnQp93xCxELjKEBDRnQxTPxC1oZdKE6+9nQwQpxC1G0hK0Ey2nQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LLO1wCxElTKECGOnQKoTwC12oRKkimSnQYabwC9JvOKkTsLnQdIvwCRLOOKUvN7mQV7HxChSPUKksjanQpgNwCdEwRK0nljnQVW2vC5QVSK0N5KnQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LAlLwCtSxMKU5RYnQZrAwCVrCKKEt5RnQ0sRvCxD3JKUwDKnQd7/uClzrHKEooHnQOLJwCpyfIK0MpmnQnS8vC5RaKK0uQ4nQ2pHwC5WNNKUY0vnQlEJwCBmzMK0uOYnQHuWwChTZJKk8LFnQkS2vC1woGKkfxmnQGGrwCxk6HKEDfnnQHYavC9/JKK0EI8nQAAOwCtD7JKkjfDoQZosvCVxiOKUyrznQSNmwCN85NKEIm2nQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LdB+uCdUNMKU+cHnQ2aRuCBfwMK0gXCnQD3OuChOfOKExRumQXjvuCl6FPKkMXkmQlY8tCZjNOKUybVnQ29QuC5nwQKk9YYnQJPCuCN5lMKUAdpnQAKPvCBg4NKkWhJnQ12AuC9E4KKEtV/mQnbatCNjgOK0ocSnQOoAuC54NSKEo0RnQQvztC5voNKkP32nQ3KztCNSpKKUvdnnQdijuCJMVMK04jsnQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LQMotCdHQPKE5fnmQBKltCZoBRKkO3UmQBMUtC5rxTKUlGbmQdH6sCFWDUKU28pmQjhItCxC5PKkZeDmQxzZsCRSjPKUVdJmQHbAsCtwqOKUa+2lQ67MsChGBMKUTXvlQ4s+rCN7pJKEnU3lQCcjrCFjlJKEKcHmQkcMsCRFaHKkizulQFxNtCNarOKk8hvmQR/EuC1tSRKE3FOmQ0tJtCNrMRK0xh1lQpxUtCFq8NKUgl+lQa2WsCFuFOKUTNWmQUbMsCxbdRKkIuOmQfserCV1oOK0QM7lQPSFsCpVFQK0c5plQbvhsCF87LKUW5ilQQvYrCtsSLKkmBOmQ5FZrCV3zHKUfKNmQi4gsCdgcHK0NVilQWTCsCR8mFKUje0lQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LVSitCdPyVKkzyOmQB6WtCdKlYKkWFSmQYRnsCtU+YKU9+PmQbSUsCtW+XK04sAmQfRxtCFFVaKUMICmQldttCpimdKEBrAmQ815tCl7JfK0sJUmQkhOuC1CieK0jfxlQrA3tCdNVVKUg8CmQgDhtClNEZK0WohmQK0RuC9w3ZKUyQEmQCootCtSoZKUSLylQk5MtC1kHeK0yc7lQ7X4tCNYPhKEqdQmQw5ltCBJyeKEtFhmQPNZuCdFueKUFHYmQlVMuCdhrgKE7tvlQ2msuCpADeKkS03lQOXLuCNNndKkLhilQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
L3GSsCZnKaK0FIgmQkblrCJbvaKklEgmQ9tcrCJG1cKUcSQmQq9zrCV8zeK0UoPmQrcdrCdUybKEJj2mQFwHsCRlzcKk+n9mQYPnsCFi9aKkw2zmQqYRsCFOFaKUJigmQSJTrC5S/YK0v/bmQCbGrCZ7XdKUQe1mQu0PrCtBQaK042AnQxLMsCBB5eKUHQ4mQsYKsCdp0cKk2kOnQMwCtCtLGcKE21xmQk2ssCJcMZKU9h9mQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LjK5qClAlcKE+dFmQvkuqCtwseK09C3lQjqEqC9R4fK0Ol8lQLUupCxZ8eKUhBLmQvGsqChe1dK0GEglQv4rqCpCNgK0WVTlQ9PDqCFoKcKkNiblQSMoqCFJ1aKEqTGmQMeGrCByPgKknK4lQSeGrCpCscKkOZclQaMKrCl3ygK00/QlQaiDqCJcnbKU0/KlQ8sDqCdWXaKkSWllQ5OmpC9KRdKEnwelQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
Luw5pChF8hK0F3wlQkESpC5yVjKk2V0lQkdyoChC0iKUQMilQt46oCJHXjK0+aPlQiadpCJyPmKkzO4lQL8+pClRmmKkKKQmQulOqChfdiKEn/klQdtDpCpKliKkO4CmQxZvpChABnKkLkqlQtYCpChJdnKk7H6lQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LmGNoC9xzhKEcSolQ5qsnCNX6gKkfVZlQvSFnClrtiKkIVYlQUlvmC1cJjKkdcolQI+dnCpyEeKkXUglQi17mC509cKU27QlQAjEoCB0OcKU3IilQjmIoC9bihKUpR4lQ4C7nCpmzgK0QdJlQYIPnCRAOeKkA5vlQslxmC92/aKkbaWlQFHgmCRnSeKEUbQlQyNJnCF4ycK0yABlQ0L6nCRFRaKEoanlQkWToClwEcKk+8SlQpcboCRRCdK0httlQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LLv7mCN5rjKEsKFlQ5xWmC5gZlKURKBlQptFmCVv4kKEBuqkQmm6lCBBxmKE6OfkQrzKmC5ZpiKkz2ikQhzhmCVNVoKURVDlQkV+lCtK6pKEJH+kQtXPnCpLQjKk204kQYv9lCVh6kK0FtMlQwKrmC5dvoKEZwTlQfj8mCBC1oKk5A5kQQZ5lCROkpKkS7ukQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
LJrdwC154UKkB+7jQJr9wC154UKkB+7jQJrdwC154WKkB+7jQ HKH_2021_1GHQ_run_2_complex.765_chain_B_1_0000100001_0000001_0
SCORE:  -1340.966  -2742.060    290.213   1831.627               -151.151                 45.480                 98.878    963.831      -1048.648            -4.105                 -27.238   -897.687         -108.192       -231.033        -72.663       -108.479     -65.937       -6.821                   24.205      3.360        30.589       194.286        349.929    -95.655      87.370    -33.370       0.000         69.871        262.435  10520.000 HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
FOLD_TREE  EDGE 437 278 2  EDGE 278 1 -1  EDGE 278 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
RT -0.57191 0.655596 0.493064 0.793278 0.595052 0.128929 -0.208873 0.464873 -0.860387 10.6177 -39.5696 38.6029   HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
RT -0.990621 -0.128998 0.0450557 0.0886112 -0.355486 0.930472 -0.104013 0.925737 0.363583 -2.04991 -2.28513 0.49222   HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
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Lw654Cxp6NKUUmzkQzVd4CdvnLKUbyzkQER24C59EJKUGV4kQpFa5CdtvIKkTZwkQ49H4CVMWLKEWxdkQJFm3CVqGJKkowZkQSo92C1wvJK0W2lkQ+Ud3Ctt5IK0wnBkQZ0H5CJqaOKEOklkQHYF4C9J6LK0HPAlQmM33CxFLNKUPbbkQO0g4CZVLLKEQkRkQu+x3CNbMHKE1kfkQhwl2CJXPIKUvGjkQG+D3CZ+3JKUs62kQL8x2CFwoLK0S8fkQJBG3C9eWHKUjo+jQFQR3CV5wKKEJw7jQrz63ClWbIK0OG5jQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LFWj4C1pTHKkXsElQIa14CxLtEKkYXIlQiWR4CdlpCKkuvHlQotr3C1RXDKU6AFlQB3O5CBCpEKkYkdlQS104C1wLFKkKjxlQt1N4CdyGFKEuOwlQ8gH5CVItFKUnCCmQncH4CRGxHKko5LlQGQL5CpTQEKEGj7kQoHe5CJ8sCKklhflQnjo5CRYHGKETqclQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LWXc4C9rGAKkwlKlQuF83CRJB8J06ZJlQrzY3C5Xp8JUKGalQbYz2CBdu7JkBIVlQbaR4CR2l2JUf+LlQuP84CdgV/Jk5GMlQ3Lt3CxqO8JUXq5kQtx53CJ2czJEkrKlQ9op4CtKE2Jkhk/kQSjg4CBsW2JEmpblQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
L7qj3CF+U+JUxktlQfjC3CVnl+JEUC+lQhek2C5fqBKkTo6lQNm91CdGcBKEO+9lQTCX3CtPu+J0nOUmQi6v3CJhj5JknwZmQF0U3C5pj0JEcYYmQury2Cdee0JkQQhmQFii3CptywJU6/NmQEoC4C5DO/Jkr4wlQzcv2CNi96Jk7/8lQoQt3CNADBK01IVmQ0Y+2CZYV/J0JUgmQQxK4CJYK5JUJvOmQSz83C9y65JUI5pmQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LOP22CVs5DKk0RzlQqrd2CFkTGKUWCvlQfJ+1Cli2FK0S2clQS3Z1CJBzGK0audlQ4b82CJ2kIK0FZqlQxDU3CJrjJK0Gj+lQTL33CN0hLKkpb6lQAzI4Ch8dMKUV5OmQbFn4CpUYOKkF/RmQr544CJWsPKEr+BmQ0Az4CZn8OKEC5lmQQ9W3Ctw+DKkBcxlQJ2L2Ct70GKkJU9lQvXU3CR64HK0QIflQT9r2CFDMKKkWEjlQuB92CRWhKKU3CJmQS3h3Cl82HKE96GmQ2vQ4CFyiKKEblxlQrCs3C1jLNKE+XxlQeN93CxJkLKEIHcmQH5w4C1KTPKEOZylQRMP5CdQGRKki8EmQztl4CNE9NKUYUymQQdJ5CF3WQKE4nomQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LjiL2CRdSEK0n4MlQs2w1CJenDK0aq6kQ0MN1CN/qBKkzvBlQtNo0C57ACKEkm7kQSEO2CxuhCK0CzokQFi71CxH5BKk2LSkQuTl1CFKUEK0mYIkQahh2ClpMBKkyFEkQ2uq2CVnpDK0ACNlQn1h1Cd4cFK03D1kQ5/o2Cxe2DK0e5mkQ5Ib2ClWpAK0VzukQ/9k1CxtPAKUx7SkQx3Z1ChK0DKUSU4jQXcK1CFl3EK0qLSkQ6h71C9h9FKEuZHkQ3eW2ClJxAKEBG0jQtc32CVE4CKU3gDkQFUy2CBc9+JUfhKkQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
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LjGxzCBzapKkwASoQUEbzCVVQrKUSLZoQt80zC5+isK0DIioQ64T0C1QZrKEoGmoQCi5zClvFqK0cmKoQ0CNzC5hxsK0fIUoQDXAzCt5LqKEfycoQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LTBqzCxGCvKkAZloQv33zCRgOwKEWavoQQ5fzCRr4uKEku4oQdfszCxxFvK0JBCpQoGszC1MLzK0C8toQsuGzClmKzKERNmoQYXOzCV8zwKUGweoQGanzCV38uKE2oloQCpa0C9z9vKUUSwoQyzjzCZgD0Kkkv1oQy2H0ClwS0KER3qoQiGoyCFCCzK01hqoQCVGzCJ2E1KEYBioQUsuyC9d6vKkxKdoQxyezCBjcxKE0aXoQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LTw8yCV1htKED41oQU+fyCNHGsKEm68oQexYyCRXVpKUuE4oQIrhyCNi5oKUEquoQRu0xC1DhtKUW29oQ56fxCpuctK0ppzoQq26xCtIawK0RMBpQ3p0yCFretKU8HuoQQluyCt53rKkTyEpQe3gxChYfsK0WuDpQDLYxCVpnrKEP3xoQPzbxCNbYxKkpxBpQH0KyCtLewK0j7IpQTJOyCJ3cxKU7W7oQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LA7GyCdMfnK0/P+oQIF+xCRY0kK0mB6oQdESxCZtdkKEFy0oQaJywCN+slKkRH4oQKYDyCJnuiKUkwCpQuHxyCFAeiK0GBHpQOg1yCBcTgKkKLPpQQweyCVG6gK0rHZpQfeZyC9pLfKEsWhpQ9RpyC9NvcKUV1gpQqUEyCBR9fK0u/ppQx0/xCdt7nKkX7FpQ5JWyC1WZkKEn7zoQviuxC9nNjKkscJpQzb5xCNyxgKExt/oQ2oGzCFlBiKEpYApQNs6yC5VWkK0htKpQwioyCdLdeKE33LpQJTXzCFCCgKkeCRpQGOSyC9lwiKkJ8ZpQXe5yClkIcK0LSapQ7PlyC9bdbKEzAnpQpM4xCFE1hKUoaqpQmPAyCJvreKUgLwpQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LCiRxCl3oiKUf7soQqarwC5wvhKkdQnoQoKMwCtUXgKECpuoQxsZwCxNGfKk6X2oQh33wCVyxfKkPYeoQAaNxCFP6gKkZtUoQoXfxCtHteKkIROoQRNrwCxJWiKE41NoQm4txCVvzhKED4qoQWFdwCxphjK0F3joQO4NxCpFVeKUN2hoQ42bwCZ3qeKkkyboQ2EnxCRERiKEj/WoQ0VuxCZRlfKU6cHoQNL3xC1tndK0Y7SoQO6FxCFIVdKErzLoQtQ5wCt7EjKE3pGoQhZSwCRs6gKUYvLoQ54cwCF1AkKUQKSoQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LAbivC1vlgK0XdsoQ6t/uC9CcfKEPUyoQnL6uC5shcKk8swoQEaJvC9qYbKUK6ooQRwYuC5V3gKEaqtoQ6IluCBafhKUgdioQvvTvCtcHiKUKCjoQKgivCVlkgK02ZsoQXKEvCpW0fKk206oQST9tChdgfK0yGuoQCkQuCBloiKU1PyoQqDeuClGzfKEpNdoQhVSuCptLjKUTgfoQ0oivC9zehKUmpboQZIXvCBCMkKE4hkoQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
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LR/rrCxzIWK0UN9oQ3bbrC1ICUK0XOEpQIDrqCdpvTKU/EEpQTwTqC1vnVKUreBpQiIqrCZCkUKE61PpQyjbsCF7lUKUdaQpQVcXrCRnNXKkuyTpQNVgrCxcDYKUTT9oQNBprCtYISKkmqBpQK2erCtD8SKEC9UpQCrlsCB26UK0GpYpQV+nsChhrSKkPmNpQtOosCBbMWKEabLpQNqhrCpNkXKUv/bpQbnirC5D1YKkasOpQ5e0qC9gIXKkGjTpQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LD+bqCliaRKEebHpQVTupCpe6QKUkIIpQn7bpC5JXSKk90RpQDn1oC576SKEPUSpQwqypChuoSKkyyZpQu9lpC9h7NK0oJJpQEM0pCNnhMKksDApQAYwqCNf7PKEvaJpQyxepCZOrRKEC6ApQjC2pCxpKNK0JQQpQMyDpCxgmNKUWOKpQj8rpC1rsKK0vLBpQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
LYxVxCJaDgKksPyjQYx1xCJaDgKksPyjQYxVxCJaDiKksPyjQ HKH_2021_1GHQ_run_2_complex.643_chain_B_4_0000100001_0000001_1
SCORE:  -1218.380  -2815.344    327.368   1881.874               -151.616                 48.181                 96.696    983.253      -1077.421            -4.475                 -29.913   -875.493         -107.114       -225.646        -68.704       -111.211     -65.871       -4.009                   38.190      9.627        37.261       202.850        346.529    -94.357      84.149    -33.370       0.000         85.289        304.895   8847.000 HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
RES_NUM A:1-307 B:308-437 HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
RT -0.380438 0.714301 0.587402 -0.0526864 0.61739 -0.784891 -0.923305 -0.32955 -0.197245 3.91965 2.00723 49.5761   HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
RT -0.493171 -0.365835 0.78927 0.144697 -0.929135 -0.34025 0.857814 -0.0535965 0.511158 1.30186 -3.08528 -1.3849   HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.267_chain_B_1_0000100001_0000001_0
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