name total energy Backbone Hbon 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 -54.07792025 -266.57500000 -159.13750000 -454.73871446 -37.81998542 585.95911137 -557.47962354 21.23760149 255.29129763 541.34395015 0.00000000 0.00000000 0.00000000 25.24951760 24.33703320 -0.52604363 -3.00111157 0.00000000 -3.88141986 0.00000000 0.00000000 361.00000000 2_1XH72.PDB -54.89146574 -265.66250000 -159.05000000 -454.39743142 -40.00042793 586.67529024 -556.29667457 21.14051301 256.65924620 539.91757972 0.00000000 0.00000000 0.00000000 25.17652532 24.33654604 -1.18001557 -3.37984977 0.00000000 -4.49372096 0.00000000 0.00000000 361.00000000 3_1XH72.PDB -54.66399825 -266.53750000 -160.22500000 -455.81838623 -40.39831282 589.33971255 -557.33847796 21.37880835 256.36451344 539.90154892 0.00000000 0.00000000 0.00000000 26.58708468 24.35333479 -0.61452384 -3.02254588 0.00000000 -4.28091946 0.00000000 0.00000000 361.00000000 4_1XH72.PDB -58.82755817 -268.02500000 -162.67500000 -456.19664710 -38.92764131 591.63227750 -558.02932620 18.15343619 257.46528617 542.26733196 0.00000000 0.00000000 0.00000000 24.15483022 24.46846585 -0.88999861 -3.41090379 0.00000000 -4.34620319 0.00000000 0.00000000 361.00000000 5_1XH72.PDB -54.89683719 -266.36250000 -158.90000000 -455.28811973 -37.96271620 588.87087692 -557.33811049 18.32568348 255.43666405 542.03059304 0.00000000 0.00000000 0.00000000 24.17802273 24.44893242 -0.84779234 -2.95700157 0.00000000 -4.08243708 0.00000000 0.00000000 361.00000000 6_1XH72.PDB -57.82481915 -267.25000000 -160.63750000 -455.42073355 -39.51923756 588.89940729 -558.64214434 19.81552868 257.12313631 540.93064806 0.00000000 0.00000000 0.00000000 25.29442551 24.32724863 -0.86223524 -3.02952952 0.00000000 -4.52658479 0.00000000 0.00000000 361.00000000 7_1XH72.PDB -58.65282501 -265.66250000 -158.90000000 -455.40730072 -40.11600821 588.62574640 -557.08067076 17.81976034 255.56376547 540.84532662 0.00000000 0.00000000 0.00000000 24.60377793 24.43562498 -1.64601846 -3.15149681 0.00000000 -4.14720681 0.00000000 0.00000000 361.00000000 8_1XH72.PDB -59.62981448 -267.40000000 -162.71250000 -455.98059262 -40.39150460 590.74404683 -557.42914968 18.72230056 256.86257402 541.02151568 0.00000000 0.00000000 0.00000000 25.29821946 24.41875085 -1.15819826 -3.15959119 0.00000000 -4.04693468 0.00000000 0.00000000 361.00000000 9_1XH72.PDB -61.18972098 -269.38750000 -162.83750000 -455.48866208 -40.19399108 591.60169410 -558.62159348 18.63531046 257.55004625 541.09983065 0.00000000 0.00000000 0.00000000 25.22008952 24.41130623 -1.47602445 -3.17975367 0.00000000 -4.11166720 0.00000000 0.00000000 361.00000000 10_1XH72.PDB -52.77653809 -265.47500000 -159.17500000 -455.92910612 -39.03492513 588.79236677 -558.57524401 21.94498935 255.55088854 542.21068864 0.00000000 0.00000000 0.00000000 24.68906400 24.44098900 -0.56856991 -3.07015492 0.00000000 -4.13653531 0.00000000 0.00000000 361.00000000 11_1XH72.PDB -55.15740368 -266.36250000 -161.33750000 -455.31909157 -38.72504221 587.64577954 -557.11324264 21.80968671 256.15165705 540.49571188 0.00000000 0.00000000 0.00000000 25.53291280 24.35579873 -0.66467450 -3.03907629 0.00000000 -4.23202444 0.00000000 0.00000000 361.00000000 12_1XH72.PDB -57.96154053 -266.28750000 -159.32500000 -456.30419707 -39.94382891 588.71322085 -558.27326366 18.95154970 256.56719665 539.93193589 0.00000000 0.00000000 0.00000000 25.39842820 24.37677228 -0.39057153 -2.70650680 0.00000000 -4.29300385 0.00000000 0.00000000 361.00000000 13_1XH72.PDB -59.93184087 -268.06250000 -161.41250000 -456.53625823 -39.52216553 591.10437291 -559.28819301 18.40260816 256.74948955 541.14221850 0.00000000 0.00000000 0.00000000 25.63655525 24.40142484 -0.96730033 -3.06124805 0.00000000 -4.11692008 0.00000000 0.00000000 361.00000000 14_1XH72.PDB -53.15814099 -265.47500000 -156.00000000 -455.76047693 -38.06034351 586.08009304 -558.84802375 21.22868452 255.08722430 540.68814106 0.00000000 0.00000000 0.00000000 25.45359114 24.34217694 -0.51943559 -3.06712204 0.00000000 -3.96547322 0.00000000 0.00000000 361.00000000 15_1XH72.PDB -57.92754808 -264.55000000 -156.08750000 -455.76919111 -39.38367655 585.99175656 -559.25537489 17.94224724 256.25274158 540.12676862 0.00000000 0.00000000 0.00000000 25.37087436 24.37812384 -0.94269525 -3.06747025 0.00000000 -4.55602839 0.00000000 0.00000000 361.00000000 16_1XH72.PDB -56.55442240 -267.21250000 -159.22500000 -454.72027533 -37.48338611 586.43741305 -557.73221917 18.33024644 256.32779705 541.89966223 0.00000000 0.00000000 0.00000000 24.70096964 24.49215999 -0.80110716 -3.27709092 0.00000000 -3.79893213 0.00000000 0.00000000 361.00000000 17_1XH72.PDB -56.88823589 -270.23750000 -162.61250000 -455.56882918 -39.45110553 593.33012848 -556.83895058 20.44264351 256.47540467 542.07232253 0.00000000 0.00000000 0.00000000 24.07185496 24.44425295 -1.47294694 -3.13925708 0.00000000 -3.95950072 0.00000000 0.00000000 361.00000000 18_1XH72.PDB -54.16287027 -265.43750000 -160.80000000 -455.27969939 -38.97461576 586.99872720 -557.31949311 22.29471867 256.96045422 539.53517577 0.00000000 0.00000000 0.00000000 25.47741933 24.30796556 -0.52767451 -2.96581346 0.00000000 -4.12456922 0.00000000 0.00000000 361.00000000 19_1XH72.PDB -48.70986508 -266.36250000 -159.60000000 -456.50556196 -38.00446305 590.90452723 -558.07180510 23.85784732 255.16143556 541.59551441 0.00000000 0.00000000 0.00000000 25.75484689 24.48996213 -0.62880082 -3.16732969 0.00000000 -3.64357587 0.00000000 0.00000000 361.00000000 20_1XH72.PDB -57.56318422 -266.32500000 -157.93750000 -455.73383375 -39.49540371 587.62962968 -558.71698180 19.11651867 255.52119394 540.89251243 0.00000000 0.00000000 0.00000000 25.52928514 24.41606430 -0.92559731 -2.79407551 0.00000000 -4.32393199 0.00000000 0.00000000 361.00000000 21_1XH72.PDB -58.52993606 -264.13750000 -159.50000000 -453.36046425 -40.77470441 586.23811265 -555.49436865 18.56914623 255.74993518 539.13824951 0.00000000 0.00000000 0.00000000 24.10566532 24.38617240 -1.74050842 -2.85363416 0.00000000 -4.46986506 0.00000000 0.00000000 361.00000000 22_1XH72.PDB -59.54439855 -265.66250000 -160.01250000 -455.22754785 -41.04861100 589.51742094 -557.50670672 18.46717836 256.57737049 540.64999654 0.00000000 0.00000000 0.00000000 24.37191065 24.45884505 -1.49913723 -3.81389536 0.00000000 -4.35737738 0.00000000 0.00000000 361.00000000 23_1XH72.PDB -58.04888017 -266.47500000 -157.57500000 -454.69441930 -40.49839435 586.20166749 -557.24157791 18.27440465 256.82535354 541.47230100 0.00000000 0.00000000 0.00000000 24.43871965 24.40646281 -1.36262241 -3.05102474 0.00000000 -4.36328779 0.00000000 0.00000000 361.00000000 24_1XH72.PDB -55.60434013 -266.32500000 -157.05000000 -455.46236629 -40.24532683 587.89560687 -557.37812838 18.80573977 257.02234104 541.39585795 0.00000000 0.00000000 0.00000000 24.16377222 24.40735773 -0.88863372 -2.99787439 0.00000000 -4.54032837 0.00000000 0.00000000 361.00000000 25_1XH72.PDB -53.02970781 -264.55000000 -156.93750000 -454.72879926 -39.40543417 585.98037188 -558.32266591 21.13811234 255.43860014 541.01142367 0.00000000 0.00000000 0.00000000 25.27033433 24.35690716 -0.83207367 -2.97799352 0.00000000 -4.11408363 0.00000000 0.00000000 361.00000000 26_1XH72.PDB -54.67130585 -268.10000000 -157.96250000 -456.06361511 -38.61728604 587.11132762 -558.39332354 19.21843427 257.69397715 541.97618872 0.00000000 0.00000000 0.00000000 26.15332739 24.41367170 -0.95120425 -2.73741077 0.00000000 -3.99922130 0.00000000 0.00000000 361.00000000 27_1XH72.PDB -57.98557893 -266.32500000 -162.01250000 -455.90226266 -39.81578470 588.78295459 -558.51579138 19.76905526 256.53103260 541.77862982 0.00000000 0.00000000 0.00000000 25.96614400 24.41874446 -0.68410178 -3.07144246 0.00000000 -4.48651220 0.00000000 0.00000000 361.00000000 28_1XH72.PDB -59.81427934 -270.65000000 -162.98750000 -456.42004108 -37.38410676 589.81882160 -559.04113096 18.96538978 257.58198342 541.66291447 0.00000000 0.00000000 0.00000000 26.36458487 24.39432242 -0.48102306 -3.55992064 0.00000000 -3.68425098 0.00000000 0.00000000 361.00000000 29_1XH72.PDB -57.27575661 -266.36250000 -161.71250000 -455.13305569 -38.75005498 586.31813097 -558.79847484 21.85888861 257.03106662 540.71437227 0.00000000 0.00000000 0.00000000 24.91271823 24.42689068 -0.53110193 -3.08106061 0.00000000 -3.74218527 0.00000000 0.00000000 361.00000000 30_1XH72.PDB -53.97470382 -268.10000000 -159.63750000 -454.43377286 -37.89634729 587.40732304 -556.88808944 22.35201501 255.85768415 540.65014581 0.00000000 0.00000000 0.00000000 24.05960770 24.42089363 -0.63961952 -2.94624733 0.00000000 -3.75990310 0.00000000 0.00000000 361.00000000