name Intraclash total energy Backbone Hbond Sidechain Hbond Van der Waals Electrostatics Solvation Polar Solvation Hydrophobic Van de Waals clashes entropy side chain entropy main chain sloop_entropy mloop_entropy cis_bond torsional clash backbone clash helix dipole water bridge disulfide electrostatic Kon partial covalent bonds 1_1XH72.PDB 7.22503000 -35.51765386 -10.07500000 -20.42500000 -21.53293838 -9.74929717 30.28379852 -27.55240690 4.57591881 11.32422387 9.17024234 0.00000000 0.00000000 0.00000000 2.69813606 0.30773194 0.08697525 -0.44088640 0.00000000 -3.88141986 0.00000000 2.38400000 361.00000000 2_1XH72.PDB 7.73091000 -40.25575949 -8.33750000 -20.11250000 -22.76044611 -10.73448340 30.73406091 -28.93955691 4.19408630 10.13057738 9.28975590 0.00000000 0.00000000 0.00000000 2.59433098 0.33032003 0.03454241 -1.85490600 0.00000000 -4.49372096 0.00000000 2.38400000 361.00000000 3_1XH72.PDB 11.06050000 -42.44785130 -11.17500000 -22.53750000 -23.39829314 -11.96368486 34.98237043 -29.18184133 1.69016930 12.41944823 8.51456867 0.00000000 0.00000000 0.00000000 3.36626473 0.31973350 0.06064140 -0.94407528 0.00000000 -4.28091946 0.00000000 2.38400000 361.00000000 4_1XH72.PDB 7.13516000 -43.61215302 -8.58750000 -23.28750000 -21.73424521 -10.76834302 31.90175238 -27.47445482 0.99871727 10.64557222 8.33316862 0.00000000 0.00000000 0.00000000 2.27734627 0.30338233 0.01596855 -1.58643210 0.00000000 -4.34620319 0.00000000 2.38400000 361.00000000 5_1XH72.PDB 7.02636000 -41.04618950 -8.58750000 -21.28750000 -21.54584407 -10.30650445 29.94647159 -27.38639749 1.52620489 10.47723630 8.37436822 0.00000000 0.00000000 0.00000000 2.25141904 0.30763622 0.01417150 -0.43987796 0.00000000 -4.08243708 0.00000000 2.38400000 361.00000000 6_1XH72.PDB 7.38937000 -38.75352317 -9.22500000 -16.17500000 -22.44014572 -10.73762719 30.81880357 -29.07769056 3.22338371 8.79526561 8.44548189 0.00000000 0.00000000 0.00000000 2.63741908 0.29509517 0.07458028 -0.56640904 0.00000000 -4.52658479 0.00000000 2.38400000 361.00000000 7_1XH72.PDB 7.34133000 -41.21183637 -8.33750000 -21.02500000 -23.11777213 -10.94105363 32.27252798 -29.40592345 1.03791894 10.98333845 9.54577728 0.00000000 0.00000000 0.00000000 2.46117402 0.31436416 0.03907689 -0.57719392 0.00000000 -4.14720681 0.00000000 2.38400000 361.00000000 8_1XH72.PDB 7.54388000 -43.01133662 -10.96250000 -25.72500000 -23.35162167 -10.83179026 34.94573379 -29.12336589 1.66311766 12.07489395 10.44994637 0.00000000 0.00000000 0.00000000 2.96424302 0.33222307 0.06233481 -1.13039372 0.00000000 -4.04693468 0.00000000 2.38400000 361.00000000 9_1XH72.PDB 4.88441000 -42.25912069 -10.32500000 -21.41250000 -22.14514970 -10.57867617 32.70472861 -28.07248788 1.53679218 9.74009579 8.57800700 0.00000000 0.00000000 0.00000000 2.82510876 0.31404528 0.04195319 -1.04032527 0.00000000 -4.11166720 0.00000000 2.38400000 361.00000000 10_1XH72.PDB 7.67956000 -35.80999090 -8.33750000 -20.88750000 -21.52344088 -10.71237778 30.48822015 -27.24376133 4.99039823 11.54316587 8.48399592 0.00000000 0.00000000 0.00000000 2.16331388 0.32534959 0.01062462 -0.64859428 0.00000000 -4.13653531 0.00000000 2.38400000 361.00000000 11_1XH72.PDB 8.18001000 -42.07395769 -10.96250000 -25.57500000 -23.83197288 -10.60518831 33.89356775 -29.98427846 4.58219090 13.20953065 9.09317097 0.00000000 0.00000000 0.00000000 2.97171501 0.33231681 0.05363698 -0.68680585 0.00000000 -4.23202444 0.00000000 2.38400000 361.00000000 12_1XH72.PDB 8.16247000 -42.26463085 -10.07500000 -21.97500000 -22.98099474 -11.97296653 32.26940790 -28.92886841 1.66722707 13.01328225 8.71545851 0.00000000 0.00000000 0.00000000 2.54657385 0.31689232 0.01860805 -0.26935496 0.00000000 -4.29300385 0.00000000 2.38400000 361.00000000 13_1XH72.PDB 8.08872000 -42.55769766 -10.32500000 -23.08750000 -23.27567584 -11.09227058 34.53195715 -28.98547303 1.48412713 11.62797607 8.99392434 0.00000000 0.00000000 0.00000000 2.90264619 0.30763657 0.05148592 -1.26697493 0.00000000 -4.11692008 0.00000000 2.38400000 361.00000000 14_1XH72.PDB 7.69316000 -36.58891745 -10.96250000 -21.68750000 -23.01806257 -10.29306663 32.88431419 -29.06644985 4.55973226 13.47655927 9.40661343 0.00000000 0.00000000 0.00000000 2.77732888 0.33170406 0.09788897 -0.79830219 0.00000000 -3.96547322 0.00000000 2.38400000 361.00000000 15_1XH72.PDB 7.53995000 -40.06220920 -8.08750000 -19.15000000 -22.48093614 -11.13450984 30.19042941 -28.64562155 1.33439706 12.16437846 8.40113927 0.00000000 0.00000000 0.00000000 2.65125737 0.32394783 0.01465209 -0.76386696 0.00000000 -4.55602839 0.00000000 2.38400000 361.00000000 16_1XH72.PDB 7.82510000 -38.73102827 -8.58750000 -20.01250000 -21.14285711 -9.22998365 29.37241233 -27.34068529 1.23298816 10.60999271 8.49473200 0.00000000 0.00000000 0.00000000 2.37757887 0.32227294 0.04869429 -0.75496846 0.00000000 -3.79893213 0.00000000 2.38400000 361.00000000 17_1XH72.PDB 8.03665000 -39.83686613 -10.32500000 -21.01250000 -22.44973730 -10.12325434 33.05413028 -28.09211485 2.19037435 9.26832264 10.11371353 0.00000000 0.00000000 0.00000000 2.30141189 0.30724021 0.07103436 -0.87374598 0.00000000 -3.95950072 0.00000000 2.38400000 361.00000000 18_1XH72.PDB 11.06520000 -41.98843605 -8.33750000 -25.03750000 -22.47569769 -10.64441628 30.75725680 -28.43794617 2.53414561 13.46531602 8.46094671 0.00000000 0.00000000 0.00000000 2.48502119 0.32355800 0.02020994 -0.65370294 0.00000000 -4.12456922 0.00000000 2.38400000 361.00000000 19_1XH72.PDB 12.22140000 -39.68624390 -10.96250000 -23.13750000 -21.93769509 -9.72714579 31.62757020 -27.34785505 2.39977965 12.60375932 8.56118123 0.00000000 0.00000000 0.00000000 2.50692636 0.33405626 0.04977912 -0.67896797 0.00000000 -3.64357587 0.00000000 2.38400000 361.00000000 20_1XH72.PDB 7.91023000 -39.13037892 -9.18750000 -19.66250000 -22.51388725 -11.24494896 31.47594209 -28.47355155 1.97487672 11.22393572 9.03231471 0.00000000 0.00000000 0.00000000 2.94112771 0.30678426 0.02273562 -0.39499173 0.00000000 -4.32393199 0.00000000 2.38400000 361.00000000 21_1XH72.PDB 6.96736000 -41.09786850 -8.58750000 -21.62500000 -21.62150567 -11.81241081 30.97853268 -27.59342741 1.58307223 11.65403858 8.74040800 0.00000000 0.00000000 0.00000000 2.11420514 0.29368608 0.02456644 -0.48298263 0.00000000 -4.46986506 0.00000000 2.38400000 361.00000000 22_1XH72.PDB 7.54283000 -42.85420951 -9.22500000 -22.47500000 -21.98197733 -11.64873679 31.56594043 -27.49530653 1.28021657 11.29455929 9.26261177 0.00000000 0.00000000 0.00000000 2.23765488 0.34263967 0.04839558 -1.36019000 0.00000000 -4.35737738 0.00000000 2.38400000 361.00000000 23_1XH72.PDB 7.24212000 -40.35422571 -8.33750000 -18.92500000 -21.96279091 -11.43408516 29.19342042 -28.62597971 1.48810025 11.43780475 9.26656095 0.00000000 0.00000000 0.00000000 2.43319443 0.30959252 0.04047065 -0.56513360 0.00000000 -4.36328779 0.00000000 2.38400000 361.00000000 24_1XH72.PDB 7.43328000 -40.10024671 -9.22500000 -19.06250000 -21.88801634 -11.81372542 30.36777315 -27.70967873 1.71178150 12.13116426 8.28242767 0.00000000 0.00000000 0.00000000 2.26555192 0.32136079 0.02415303 -0.64384939 0.00000000 -4.54032837 0.00000000 2.38400000 361.00000000 25_1XH72.PDB 8.74790000 -37.64281717 -7.70000000 -19.50000000 -21.49570575 -10.57298301 28.93764405 -27.83060324 3.01683769 10.38920377 9.15539516 0.00000000 0.00000000 0.00000000 2.55407032 0.30195366 0.05246565 -0.53505817 0.00000000 -4.11408363 0.00000000 2.38400000 361.00000000 26_1XH72.PDB 5.47088000 -37.98234375 -10.96250000 -20.42500000 -22.35553539 -10.26405493 31.15157301 -28.38755303 2.24580233 12.35005303 9.85913401 0.00000000 0.00000000 0.00000000 3.22691329 0.33281084 -0.00462531 -0.41732946 0.00000000 -3.99922130 0.00000000 2.38400000 361.00000000 27_1XH72.PDB 5.58277000 -40.68332920 -8.33750000 -22.28750000 -22.73477213 -11.46320861 32.56545416 -29.11029597 2.97866510 11.46685034 9.00170891 0.00000000 0.00000000 0.00000000 3.03788369 0.33005365 0.03869833 -1.35280082 0.00000000 -4.48651220 0.00000000 2.38400000 361.00000000 28_1XH72.PDB 8.98190000 -41.73236948 -10.07500000 -21.86250000 -22.59046605 -9.34348301 31.43158629 -29.05992115 1.68758594 10.86559524 8.85359229 0.00000000 0.00000000 0.00000000 3.16268118 0.31848991 0.05163337 -1.16942261 0.00000000 -3.68425098 0.00000000 2.38400000 361.00000000 29_1XH72.PDB 4.77722000 -38.29254659 -9.82500000 -24.06250000 -22.21926866 -9.86574120 31.02706894 -28.25598094 5.23616855 12.85817143 8.81948146 0.00000000 0.00000000 0.00000000 2.56124302 0.34912873 0.09260721 -0.91661113 0.00000000 -3.74218527 0.00000000 2.38400000 361.00000000 30_1XH72.PDB 6.71854000 -37.89387315 -10.96250000 -22.10000000 -22.40392837 -9.82907793 31.78009081 -28.40045199 5.70750528 11.28919872 9.19605179 0.00000000 0.00000000 0.00000000 2.03907051 0.34210557 0.07949527 -0.52942415 0.00000000 -3.75990310 0.00000000 2.38400000 361.00000000