SEQUENCE: EGQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIHAIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVHVDGHLYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAAMQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGX
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:  -1064.659  -1873.014    181.115   1322.260               -100.942                 32.560                 73.348    694.081       -727.962            -3.819                 -24.966   -708.334          -92.905       -136.267        -86.050        -81.671     -59.519        0.000                   14.216      2.848        22.367       140.381        296.157    -74.784      62.076   -125.543       0.000         11.635        178.072   6795.000 HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
RT 0.684639 0.0211056 0.728576 0.157336 -0.980294 -0.11945 0.711698 0.196412 -0.674469 -34.5811 10.5621 32.0542   HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
RT 0.246474 0.96908 -0.0115787 -0.541659 0.147652 0.827529 0.803652 -0.197692 0.561303 -1.92904 -1.22674 -3.96609   HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGHLYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
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LiqMCBxNixJUF/nhQ/nV+AFV7vJUP66hQEbt5AdjWqJ06F5hQPGTzAtZIpJkF+qhQ+qR1AFd7zJENw/hQCYptA58lyJUS4SiQ121zAxkryJUI/niQ9YmkAZqs2JkEiTiQNPLAB9pkyJ07gahQ2x5BBd33vJkzXIiQ6e+4AZHn3JECxDiQlXgwAVig0JUYYxhQLJTqABwluJE70QiQv6ZuANquxJEqk0iQQDO6AJrvvJE06niQC3L3A5Yn2JESvqiQqudeAl5z1JES0giQxD7nANhq6J0LmViQehLgAxmj2JUmuEiQ HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
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LOn1pA9/CeJUC/ciQm9gjAlmgdJkiXwiQ5X8jARjDYJEYY7iQBkgiApBxTJ0C7xiQWQ/PAJbDfJ0hvriQ5qbMA9jtkJkJqiiQWIdp/MGelJkv+eiQCXQVAZ96oJ0U9xiQj5inAh6UcJU1GPiQ0hnmAZgSgJEo97iQzARJAhaMcJ0HhgiQ28OHApk0eJ0qt6iQnpeUAdBGlJkgRTiQcxsj/U7apJUBRYiQxpzb/wLciJUx2TiQ/k1Q/0rGlJUnIuiQSxbSAxz1sJ0vVriQw6QNAZahoJ0xTBjQ9fJjAB/coJ0fN0iQ HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
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LTxO4+a7c6I0debjQUhRp/ewS3IkqcNjQBr7G/y09xIk2uIjQHsVF/MLWxIEWPNjQyNun/y3PuIk72AjQOnHD/c+o5I0M9bjQ0AHEAven2IksCVjQgwAv/Sbe5IUon+iQ HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
LDwrmBBwA/IEPOojQDwroBBwA/IEPOojQDwrmBBwADJEPOojQ HKH_2021_1XD3_run_2_complex.867_chain_B_3_0000100001_0000001_0
SCORE:  -1039.114  -1890.872    191.636   1330.985               -103.019                 34.213                 76.490    699.544       -733.175            -3.454                 -22.478   -704.956          -94.097       -137.461        -89.084        -83.863     -61.464        0.000                   22.695      4.281        26.333       141.687        295.655    -76.094      65.325   -125.543       0.000         15.488        182.113   3164.000 HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
RES_NUM A:1-229 B:230-305 HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
RT 0.795132 0.149574 -0.587701 -0.0535364 0.982636 0.177655 0.604068 -0.109796 0.789333 -14.3636 37.6738 11.1915   HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
RT 0.266606 0.963805 0.000815845 -0.58485 0.161107 0.794981 0.766075 -0.212424 0.606634 -3.75593 -0.122182 -4.38573   HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
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L9LMjBBGR5IkVWmjQ9LMlBBGR5IkVWmjQ9LMjBBGR9IkVWmjQ HKH_2021_1XD3_run_1_complex.336_chain_B_1_0000100001_0000001_0
SCORE:  -1039.156  -1915.197    197.602   1327.261               -102.756                 34.245                 75.711    696.731       -737.482            -3.854                 -26.172   -690.286          -88.946       -136.756        -85.349        -83.233     -57.372        0.000                   17.260      7.532        23.251       146.845        295.366    -74.902      66.335   -125.543       0.000         13.010        187.543   4237.000 HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
RT 0.913069 0.401748 0.0700263 -0.283032 0.747916 -0.600429 -0.293595 0.528413 0.796606 -22.4023 32.1895 20.032   HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
RT 0.240517 0.970624 0.00632197 -0.557677 0.132853 0.819357 0.794448 -0.200595 0.573248 -1.68506 -1.20957 -4.04223   HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
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LUGyjBhbm4JU+aHjQPLTkBtMS+JEA9LjQ0BNnBRkBAKUfqLjQZA3oB9KF+JETzXjQdcKjB9Is/JUsJijQ1tvjBx1qCKU9krjQV4ZiBFzzEKUfLejQ6AuiBVRwCK0OoCkQIRikBFJx1JE1gRjQA7PjB5YTAK0e5/iQfNEhB9Gg/JUlxgjQzNzjBNgr8JkKitjQjV5lB9mDDKk5drjQ7X2iBxAtGKEi8kjQdAJjBR8wEKUh/NjQQDRgBlJhEKEFJejQ2NGjB12sEKEHpJkQfjmgBZqXCKkowCkQyJvjBVcOBKEE/LkQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
L83vnBx/ECKU2N/iQ5RaqBh+QDKkCG+iQiEPqBRCJGKUqVFjQQISoBhniHKUYpAjQLrqrB5nBDKEspniQE8AqBBTREK04mXiQtcbuBp8bEKEaEniQ2CNmBBayCK06C2iQFBurBFpNCKE9JJjQJN2rBtE7AK0s0jiQ9w8qB9tBEKUsCIiQbFDoBB0XDK0YkXiQp84pB9ZWGKE0cbiQDISvB9uNEKUDJXiQXfOuB17jGKk9cqiQTbxvBBWkDKk4hyiQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
LSTNsB9bAHK0+zRjQUFIsBF5uJKUUbZjQXGNuB5njLKUfgPjQbvkwBt/4KKUlbNjQ2LdsBJ8vJK0/kxjQYgeqBxSGIKUPL+jQaSLrBhmUIKEBmVkQCdrnB5nCJKkQs5jQ0dwtBdbzFKEwdVjQKjNqBJ8kKKEHQVjQX6buBJABJK0Ja1jQ87RsBl2zLKUD+2jQpapqB59/FKU1r5jQ0S0pB9nHHKUG6ekQHPNtB97mHKUxJYkQQsBrBddZKKkXrakQg/TmBFY2HKk15CkQTtfnBlGJLKkpE+jQkZMnBBpzIKULDpjQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
L9nTtB5+9NK0usKjQti9uB5HEQKEryBjQ+mPwBh3oRKE4sTjQkeXvBBN2TKkwFZjQMnTtBx05RKkxyziQG2HsBhVkQK0zEgiQYxuqBNxhSKkMDSiQsFaoB1etTKELqciQKu6lB5bpSK0XTdiQmSWlBhLZQKEgAUiQloBkBFw4TK0TjniQ+wUrBBBVOKUEQNjQaAiwBxKKPKE0G4iQoIqrBVOtSKkdJ9iQG1huBhGlTK08guiQojttBNinPKkr7WiQTirqBhWDPKkkLliQzMHsBB4IUKkyCOiQa+EqBxmjRK03YDiQTbsoBFueVK06VkiQAVxmB9hYPKkbBMiQ9mbjBVPqPKEgnViQd5bkBhLnVK0OmviQ7ALiBxHGTKUfLoiQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
LzESyBlvcQKkKHdjQCwlzBRUpRKEucvjQiGE2BlzJTKUrUojQVEU3BVdcSKU9SYjQUWW0B5GePKE5f/jQd3AyBRiqNK0eCHkQ72EzBFClLK00QWkQIzxvBV6TPKkeQRkQxo0yBpfmOK0EaXjQf/PyBFaFTKEb32jQ7k21Bl5LOK0wI4jQKQP1BNtaQKEAhNkQpgOxB9aoMKE1V5jQnMdxB1oQKKU4HbkQGDo0BJEaKKkMSOkQSp6zBh9iMK0OWkkQzhKuBdNAOKEKOWkQthiwBZxXQKUDLfkQpz/uBNvuQK0fxFkQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
Lc1w2BdvOVKU5T0jQTuK5Bl7xWK0+FwjQBWl7BFefVKk+p6jQn9Z7BVHjUKUg0MkQHD24BFloZK0hO4jQF1M7BV/fbKUOuzjQaao6BtsReK0Nh6jQ2v58BpaCgK00d2jQv2A9BJpqiKEKg7jQJ396Btl2jKkB2EkQBrM/BdbDkKUm/2jQXum1B50tVKUQ9AkQ6Ag5Bhq1WKEr2ejQNfE3BxdhaKE4ExjQ/yi4BJSmZKkMfJkQJk98BBL1aKkdi8jQb+o7BtmgbKkHpijQOL64BdJCfK0PsxjQcLN6BFzSeK0unLkQB6h+BNMOfKUHUvjQS+S5BtwziK0OUIkQILE7B5S0lKE2jIkQqnYACJeJjKUP1vjQAUT/BREBmKEor6jQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
LFN19B9RgVKUhZvjQRrKAC1SdUKUas3jQnVVBCR42VKUPzsjQgYIBChuSXKEdGdjQ14bCCVH4VKE+g1jQY0z9BVtRWKkidgjQ9tNACNXxUKUR8IkQn7NAC15TSKUc10jQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
Ld6gnB9YR+Iks1wjQd6gpB9YR+Iks1wjQd6gnB9YRCJks1wjQ HKH_2021_1XD3_run_2_complex.128_chain_B_16_0000100001_0000001_0
SCORE:  -1057.757  -1865.813    182.920   1299.890               -100.132                 32.459                 73.877    685.691       -720.848            -3.992                 -26.406   -683.340          -94.987       -137.704        -84.615        -77.459     -53.538        0.000                   12.015      3.892        20.942       137.237        298.870    -75.878      63.162   -125.543       0.000          6.944        174.601   7166.000 HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
RT 0.280205 0.859246 0.427998 0.24758 -0.495462 0.832599 0.927464 -0.127335 -0.351563 -22.6869 10.8163 28.8332   HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
RT 0.243639 0.96093 -0.131354 -0.55985 0.249936 0.79 0.791964 -0.118937 0.598871 -3.34987 -1.09814 -4.98091   HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
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LYX9WBD7oEK0YZciQSdocBf/BEKEfEeiQIj1fBv8oFKki6NiQ2WueBbEAIK09bKiQVqpeBv0nEK0Nl0iQ/pQiB727DKkTt4iQ4WAjBDNXEK0YXPjQfW0lBbsvDKUsJTjQloGnBXhBEKk9DmjQKk0lBLg6EKU6E3jQd7qpBPVZDKEecnjQnoZVBTVGGKkupliQxYNdBjL6BKEPwaiQMCQcBzOhDKU8HAjQvDJeB7ovGK0q93iQLPjjBTpNFK0SBviQqRoiBXK2BKEOs0iQWnyhBDnEDKEbiZjQqJqiBP2cGK0jhTjQpS5mBvfDDKkBkGjQcb3jB3SZFK00I2jQZ8ymBjhHFKEKJFkQ+FqqBbotCK04aajQkkpqBDMmDK0ve1jQ HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
LZG7hB/YXEK06eEiQNxtjBXYqFKElb1hQY/amBXfREKkI21hQEBrmBXaHCKUjK/hQkBboBnYfFKEM1vhQ0gOiBXjaCKkD7HiQFa8jB3BxHK06o5hQMX3iBrskFKEmZlhQ HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
LwfBkBJNI+I0XEejQwfBmBJNI+I0XEejQwfBkBJNICJ0XEejQ HKH_2021_1XD3_run_2_complex.439_chain_B_1_0000300003_0000001_1
SCORE:  -1052.182  -1887.436    190.431   1307.704               -102.411                 33.046                 77.251    691.068       -727.439            -3.810                 -25.404   -699.282          -92.838       -134.917        -86.178        -82.570     -57.884        0.000                   17.718      3.605        23.017       143.414        298.351    -75.059      67.849   -125.543       0.000         11.279        183.856   4767.000 HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
RT 0.370448 -0.866842 -0.333697 -0.715557 -0.495391 0.492509 -0.592238 0.0563302 -0.803792 -30.8158 17.459 31.4185   HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
RT 0.229106 0.97209 -0.0505035 -0.541282 0.17035 0.823404 0.809027 -0.16131 0.565204 -2.42483 -1.57248 -3.63418   HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
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LHHJmBFTx/IUtAxjQHHJoBFTx/IUtAxjQHHJmBFTxDJUtAxjQ HKH_2021_1XD3_run_1_complex.646_chain_B_4_0000100001_0000001_0
SCORE:  -1053.122  -1885.606    186.395   1331.428               -103.886                 34.593                 77.736    706.081       -733.377            -3.615                 -23.922   -706.485          -95.958       -138.919        -87.075        -83.347     -68.068        0.000                   14.895      4.582        23.333       138.953        300.506    -75.288      63.324   -125.543       0.000         12.988        183.152   4409.000 HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
RT 0.940703 0.1906 -0.280622 0.0725031 0.695153 0.715197 0.331392 -0.693134 0.640113 -18.9998 19.6083 19.4237   HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
RT 0.264606 0.958575 0.105445 -0.556837 0.0626001 0.828259 0.787347 -0.277878 0.550334 -2.39011 -0.895414 -5.72283   HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAH[HIS_D]EGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
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LGBDmBd8r8IUdqRjQGBDoBd8r8IUdqRjQGBDmBd8rAJUdqRjQ HKH_2021_1XD3_run_1_complex.283_chain_B_10_0000200002_0000001_0
SCORE:  -1055.721  -1899.204    188.498   1329.706               -102.454                 33.875                 75.338    698.300       -735.765            -4.047                 -26.182   -701.608          -93.235       -134.874        -87.929        -90.132     -59.837        0.000                   20.234      3.697        23.122       142.171        300.179    -73.404      65.273   -125.543       0.000         17.344        180.755   3425.000 HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
RT 0.508791 -0.536316 -0.673422 -0.699956 0.197691 -0.68628 0.501192 0.820539 -0.274814 -21.1153 33.7149 40.4926   HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
RT 0.255834 0.95755 -0.132837 -0.540547 0.255616 0.801542 0.801472 -0.133257 0.582997 -3.28123 -0.611117 -5.10378   HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAH[HIS_D]EGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.351_chain_B_4_0000800008_0000001_0
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SCORE:  -1028.043  -1883.033    191.355   1311.965               -103.193                 34.410                 75.762    684.512       -729.596            -3.441                 -22.427   -680.529          -93.543       -135.296        -87.682        -80.223     -53.799        0.000                   21.330      4.892        22.511       139.071        301.693    -77.341      63.192   -125.543       0.000         14.027        182.882   4687.000 HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
RT 0.689814 0.368887 0.62296 -0.594522 0.779663 0.196645 -0.413159 -0.506012 0.757134 -29.0449 31.8654 10.8131   HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
RT 0.274258 0.961426 -0.0210332 -0.555809 0.176323 0.812396 0.784767 -0.211115 0.582727 -2.34815 -1.18044 -4.48739   HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
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LEo7kBl4MIK0IdhhQHMGkBBcdKK0qaUhQuprlB5V9KKEjBAhQfCKoBBI+KKkZk/gQrrLkB9b+MKU9CihQTdliBls6MK0X42hQh5/iBB0iPKkkRCiQx8VfBljaMKEFUyhQvzrmBBkOIKUmfphQTIEiBdtGKKEdXPhQE+PmB5lZNKkzEmhQDhZjBtwmOKEvZYhQ29VjBdoVLK0zPBiQf17hBBthPKE1RRiQisHlBdL1PKkxaFiQKkQiBFOLRKEJa4hQ6FLdBBFaMKUfOBiQ0A2dBBC/NK0x3nhQpiyeBlLgKKEqoqhQ HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
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L6t6nB1cEQKUeLjgQVbhoBZp5SKE1XkgQkofqBVTqTKUR+SgQ+WKsBZaCSKUjfMgQiGrpBN3jTKUNY6gQmO5nBVbvSKUcmNhQOSUpBl3bTK0mJihQYjIlBxjEUKUnYMhQ/OEpBlEqOKkYuqgQ9TtmB17CUKE2nhgQBXlrBhYiSKkdB8gQjBCqBdctVKkuP7gQQDpnB9umQKklRNhQv5GoB5CzSKUtrvhQ1ePrBZhaSKUtqihQXeopB1llVKk8BjhQUJ7jBt7cTKUe4ZhQIiWlB1BPWKkatMhQ2yHkBdfeTKkA19gQ HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
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LLU5wBlu+XKkTQ5fQD2YzBVeHZKEiVEgQDwU1BlUcZKEBfjfQVh00BZWZYK0LtAfQ2eK3BNNEbKkvQmfQpR8wBdF0WKks3efQieAzBxQDbK0+yLgQfEQ0BZE0XKUZeQgQ HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
LZ+WmBl5d9I0KUkjQZ+WoBl5d9I0KUkjQZ+WmBl5dBJ0KUkjQ HKH_2021_1XD3_run_2_complex.270_chain_B_1_0000500005_0000001_0
SCORE:  -1041.957  -1886.100    189.102   1314.221               -100.369                 32.969                 72.947    689.667       -728.804            -3.839                 -24.892   -687.411          -89.436       -137.764        -85.307        -72.851     -59.717        0.000                   15.769      2.954        21.978       138.514        300.316    -74.450      66.410   -125.543       0.000         10.353        179.325   3844.000 HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
RT 0.519671 0.198244 0.831048 -0.750168 0.571401 0.332789 -0.408889 -0.796367 0.445657 -26.894 27.6049 18.1254   HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
RT 0.259572 0.965675 -0.00973467 -0.578545 0.163567 0.799082 0.773245 -0.201787 0.601144 -1.63179 -1.45384 -5.50696   HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
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L7KCnBFgUDKkknWfQFK/lB92GFK05J2eQ3KtmB1AYEKEbaIeQEmApB5DyDK0Pb9dQ+u5mBFH8HK0Ls/eQdCLmBxhDJKENrrfQjEVnBtP1LKk6RvfQtVKjBZwEJK0DdxfQ6eApBlYODKUXKdfQgI1jBJFDFKEui3eQjAEpBBOBIKU9s8eQOhAmBpnPJKEf2neQBtEnBZI1HKEOWCgQLJ4mB5tpMKELQHgQqXfpB9dvLKEFQrfQOCemBdRHNKEEsWfQ3UsiBtZ5JKkUPIgQ9DRiBVOSKKkqVYfQonWiB1wEHKEb0vfQ HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
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L4RenBR8Y+IkJZWjQ4RepBR8Y+IkJZWjQ4RenBR8YCJkJZWjQ HKH_2021_1XD3_run_2_complex.141_chain_B_0_0000300003_0000001_0
SCORE:  -1049.447  -1884.402    187.238   1314.510               -100.731                 32.883                 74.615    697.030       -728.851            -3.525                 -22.698   -691.155          -98.805       -137.903        -88.267        -79.111     -56.024        0.000                   18.298      4.654        22.974       139.199        296.654    -76.826      63.072   -125.543       0.000         13.810        179.454   6546.000 HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
RT 0.990007 0.140075 -0.0163109 -0.140109 0.990136 -0.000970969 0.016014 0.00324657 0.999866 -25.0091 37.8333 16.0776   HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
RT 0.257136 0.965482 0.041539 -0.553537 0.111916 0.825271 0.792135 -0.2352 0.563208 -4.08261 -0.0613654 -4.57885   HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
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LsJiyBNZdYJUPugjQcs3vBd8gaJEJncjQTKJuBxtCWJ0ZoTjQ+s/uB1l8SJkj1FjQi28vBpVSfJE7INjQ6YPtBtjHiJ0nYJjQsQgtBJoFnJUpT7iQr0juBtQCrJ0HvCjQfcrsBhzBnJkwBpiQ3/E0B9VpZJ0BYXjQYx/uBVp1bJUjsrjQk0XxBVsQiJU39SjQ88pwB1P8dJ03v9iQo92rBpdWfJk07BjQBEasBV2QjJE8zYjQ HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
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LNXNMB5PuzJUWIDhQFZqNBJLQ5JkM4GhQTWLQBx6H8JESC0gQQdCUBxvS6J0rBqgQ3raRBJIi5J0C7ZhQ7PaPB1LB3JkihuhQrFzTBptY3Jk7E/hQZYZKBVV35J0qz1hQTECPBZp4wJEHCBhQqKEKBZ5b7Jk9jKhQ+VKVB9Mt3JkT1VhQzRHSBNIv9Jk/PdhQtSiOBtYyyJ0KAshQoidSBVri1JEx1NiQk9VXBNuS1JUWV5hQv7xUBF9j7JkhDCiQuJCJBdbI4JEZmEiQbSVLBRUD+J0dD4hQC0OHBF9f5JkjIqhQ HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
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LtnvnBNhMHK0XDGgQ2SdqBB3LGKEBVEgQaOxrB5lUHK0ZqgfQJhZqBN4fIK0+0FfQVNOuB1UcHKU8jefQ00xmBZouHKUNBxfQbdmrBBMwGK0VeSgQDSbqBtkAEK0elDgQ HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
LTJ1iB9G84IUKbkjQTJ1kB9G84IUKbkjQTJ1iB9G88IUKbkjQ HKH_2021_1XD3_run_1_complex.505_chain_B_9_0000300003_0000001_0
SCORE:  -1053.214  -1892.089    187.173   1326.141               -103.207                 34.145                 77.289    690.686       -732.846            -3.271                 -21.663   -686.894         -100.994       -135.698        -87.314        -81.236     -56.048        0.000                   15.910      5.246        21.362       139.576        294.970    -75.563      63.943   -125.543       0.000          9.909        182.800   2912.000 HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
RT 0.13401 -0.602822 0.786541 -0.644593 0.549822 0.53122 -0.752689 -0.578188 -0.314893 -35.3993 27.6565 28.341   HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
RT 0.2494 0.968331 -0.0116308 -0.57994 0.158964 0.798999 0.775544 -0.192525 0.601219 -3.79503 -0.528727 -4.28968   HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGH[HIS_D]LYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLH[HIS_D]LVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
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LAq/gBJ1D9IU6KSfQvIvjBtfS8I0crDfQsJ2jBVBV3I0AwneQp+8hB18L0IUgXoeQEbZlBpEQ3Ik5PJeQRZsfBJgy5IEXjWfQyTakBtbx/IU/qxeQAPElBlI17IkgHffQ HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
LCuPjBNUk7IU/RpjQCuPlBNUk7IU/RpjQCuPjBNUk/IU/RpjQ HKH_2021_1XD3_run_1_complex.41_chain_B_3_0000100001_0000001_0
SCORE:  -1053.185  -1879.189    185.906   1312.316               -100.254                 32.618                 74.005    694.445       -729.307            -3.692                 -23.706   -698.023          -92.023       -136.493        -89.000        -79.298     -58.407        0.000                   14.913      4.715        24.357       140.373        295.525    -75.962      65.199   -125.543       0.000         12.056        181.283   6247.000 HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
RES_NUM A:1-229 B:230-304 z:1 HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
FOLD_TREE  EDGE 305 169 2  EDGE 169 1 -1  EDGE 169 229 -1  EDGE 1 230 1  EDGE 230 304 -1  HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
RT 0.991644 0.00658608 0.12884 -0.0759051 0.83732 0.541418 -0.104314 -0.546674 0.830823 -25.2606 39.1268 6.83729   HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
RT 0.287414 0.957425 0.0270199 -0.539941 0.138658 0.830203 0.791111 -0.253201 0.556806 -4.62579 0.0757803 -3.7281   HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
ANNOTATED_SEQUENCE: E[GLU:NtermProteinFull]GQRWLPLEANPEVTNQFLKQLGLHPNWQFVDVYGMDPELLSMVPRPVCAVLLLFPITEKYEVFRTEEEEKIKSQGQDVTSSVYFMKQTISNACGTIGLIH[HIS_D]AIANNKDKMHFESGSTLKKFLEESVSMSPEERARYLENYDAIRVTHETSAHEGQTEAPSIDEKVDLHFIALVH[HIS_D]VDGHLYELDGRKPFPINHGETSDETLLEDAIEVCKKFMERDPDELRFNAIALSAA[ALA:CtermProteinFull]M[MET:NtermProteinFull]QIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRG[GLY:CtermProteinFull]X HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
CHAIN_ENDINGS  229 HKH_2021_1XD3_run_2_complex.198_chain_B_10_0000200002_0000001_0
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