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_2PHK2.PDB 3.82671000 -15.43427789 -4.71250000 -3.00000000 -11.60540861 -3.19341788 16.33028334 -16.96914012 0.55610288 2.99352243 5.54928935 0.00000000 0.00000000 0.00000000 0.25524411 0.04037776 0.03698211 -0.11339999 0.00000000 -1.56183551 0.00000000 2.38400000 286.00000000 2_2PHK2.PDB 4.24816000 -17.34742891 -4.71250000 -6.47500000 -11.62311243 -4.02668870 15.27879598 -15.43563690 0.26763187 4.02971570 6.75873181 0.00000000 0.00000000 0.00000000 0.40818834 0.02486452 0.03862458 -0.15206216 0.00000000 -1.70411697 0.00000000 2.38400000 286.00000000 3_2PHK2.PDB 4.03815000 -17.36988418 -4.71250000 -4.77500000 -11.68253352 -3.70166393 16.84415914 -16.76918744 0.26635776 3.42096451 5.46051209 0.00000000 0.00000000 0.00000000 0.41583100 0.03103409 0.04138759 -0.38516788 0.00000000 -1.79304351 0.00000000 2.38400000 286.00000000 4_2PHK2.PDB 3.98575000 -13.66156722 -4.71250000 -2.62500000 -11.90356210 -2.02832744 16.20034828 -17.72819106 0.53046299 2.25436402 6.43891857 0.00000000 0.00000000 0.00000000 0.32569534 0.03609833 -0.00282248 -0.00616891 0.00000000 -0.40478443 0.00000000 2.38400000 286.00000000 5_2PHK2.PDB 3.70541000 -17.49481369 -4.71250000 -6.47500000 -12.18921194 -4.30510650 15.79847787 -16.11790033 0.30408747 4.30958428 7.32135083 0.00000000 0.00000000 0.00000000 0.44692765 0.01602150 0.04410634 -0.20010607 0.00000000 -1.71952327 0.00000000 2.38400000 286.00000000 6_2PHK2.PDB 4.14063000 -16.93185861 -4.71250000 -4.77500000 -12.60065774 -3.36740272 18.07791977 -18.11576177 0.52948807 3.21894758 6.19608650 0.00000000 0.00000000 0.00000000 0.40117007 0.04385543 0.03668554 -0.17989827 0.00000000 -1.64093564 0.00000000 2.38400000 286.00000000 7_2PHK2.PDB 4.07003000 -15.12572802 -4.71250000 -3.00000000 -11.19082902 -3.24155468 16.10016568 -16.44264778 0.38502691 3.01629391 5.50741426 0.00000000 0.00000000 0.00000000 0.41118118 0.03370286 0.04004198 -0.31806775 0.00000000 -1.68025271 0.00000000 2.38400000 286.00000000 8_2PHK2.PDB 3.78814000 -18.82311093 -4.71250000 -8.25000000 -12.24007830 -4.29107220 16.52451077 -16.10971409 0.47707485 4.31264316 6.94709578 0.00000000 0.00000000 0.00000000 0.37962831 0.02533463 0.03350789 -0.20059684 0.00000000 -1.69361024 0.00000000 2.38400000 286.00000000 9_2PHK2.PDB 4.16879000 -16.71053426 -4.71250000 -7.87500000 -10.49624754 -3.20427903 14.21767442 -13.78371040 0.27557750 3.36962697 5.74003487 0.00000000 0.00000000 0.00000000 0.30450716 0.02461248 -0.00281673 -0.02464667 0.00000000 -0.51875479 0.00000000 2.38400000 286.00000000 10_2PHK2.PDB 3.71986000 -16.59311041 -4.71250000 -6.47500000 -11.37498346 -3.98513362 14.99917042 -15.03431526 0.26879765 3.91747430 6.62832856 0.00000000 0.00000000 0.00000000 0.52217881 0.01521117 0.02160847 -0.00858149 0.00000000 -1.36015478 0.00000000 2.38400000 286.00000000 11_2PHK2.PDB 4.23304000 -15.42979542 -4.71250000 -3.00000000 -12.04449925 -3.25567185 16.97344073 -17.60539763 0.42682998 2.97847862 6.16628096 0.00000000 0.00000000 0.00000000 0.44451092 0.04166800 0.04121633 -0.16188964 0.00000000 -1.68059460 0.00000000 2.38400000 286.00000000 12_2PHK2.PDB 4.09870000 -20.19464361 -4.71250000 -8.25000000 -11.88578381 -4.67640542 15.78480373 -15.69540342 0.27054705 4.37017827 6.21065491 0.00000000 0.00000000 0.00000000 0.38757222 0.02739463 0.03986744 -0.16035522 0.00000000 -1.87781935 0.00000000 2.38400000 286.00000000 13_2PHK2.PDB 3.99458000 -19.42080510 -4.71250000 -3.00000000 -12.07569034 -4.21088810 14.11416433 -17.56129232 0.24342692 3.57995902 5.68533630 0.00000000 0.00000000 0.00000000 0.30565804 0.04555779 0.03984340 -0.11836542 0.00000000 -1.71045692 0.00000000 2.38400000 286.00000000 14_2PHK2.PDB 4.02331000 -17.19011972 -4.71250000 -2.62500000 -10.79650072 -2.69328194 12.13306702 -16.11137951 0.21417633 2.48772802 5.09016422 0.00000000 0.00000000 0.00000000 0.24722112 0.02841411 -0.00273550 0.01673038 0.00000000 -0.43780912 0.00000000 2.38400000 286.00000000 15_2PHK2.PDB 3.61273000 -14.52005458 -4.71250000 -3.00000000 -11.61687307 -2.30320543 16.34184785 -17.14321144 0.53056883 2.65281571 5.84373659 0.00000000 0.00000000 0.00000000 0.25997690 0.03027842 0.04249138 -0.18497574 0.00000000 -1.23072616 0.00000000 2.38400000 286.00000000 16_2PHK2.PDB 4.03835000 -17.78996055 -4.71250000 -3.33750000 -11.82185204 -4.16271745 14.78743650 -16.06897230 0.33791426 3.46524152 5.01022767 0.00000000 0.00000000 0.00000000 0.44291695 0.03605576 0.03536942 -0.08696603 0.00000000 -1.67855905 0.00000000 2.38400000 286.00000000 17_2PHK2.PDB 3.28480000 -12.16286634 -4.71250000 -2.62500000 -9.43781658 -1.93742415 11.67787153 -13.10789778 0.22856844 2.22240186 5.20515245 0.00000000 0.00000000 0.00000000 0.32195142 0.01374640 0.00454923 0.01933980 0.00000000 -0.02206256 0.00000000 2.38400000 286.00000000 18_2PHK2.PDB 3.91416000 -19.39292871 -4.71250000 -8.25000000 -12.86347867 -5.24049746 17.40358046 -16.50100431 0.45358484 4.77752969 6.91251979 0.00000000 0.00000000 0.00000000 0.62500197 0.01842164 0.04725263 -0.10606620 0.00000000 -1.93885145 0.00000000 2.38400000 286.00000000 19_2PHK2.PDB 4.10652000 -18.79554556 -4.71250000 -2.96250000 -12.02799587 -4.37296378 14.05704272 -17.64370193 0.52828949 2.63193330 5.82309231 0.00000000 0.00000000 0.00000000 0.67535283 0.03444605 -0.00272882 -0.00057399 0.00000000 -0.78829183 0.00000000 2.38400000 286.00000000 20_2PHK2.PDB 4.10935000 -15.58473290 -4.71250000 -3.00000000 -11.95010723 -3.06853542 16.64515683 -17.64332310 0.39324429 2.89162759 6.20224487 0.00000000 0.00000000 0.00000000 0.53718548 0.03928286 0.03556828 -0.30253434 0.00000000 -1.61276015 0.00000000 2.38400000 286.00000000 21_2PHK2.PDB 4.08151000 -19.20607465 -4.71250000 -4.40000000 -11.21370365 -2.93555904 12.82790181 -16.66580693 0.33096530 3.05531927 4.95543784 0.00000000 0.00000000 0.00000000 0.24295558 0.03399840 -0.00291162 -0.20691789 0.00000000 -0.48125533 0.00000000 2.38400000 286.00000000 22_2PHK2.PDB 3.71280000 -18.27016286 -4.71250000 -3.00000000 -11.72674856 -4.00446616 13.97289150 -17.20235767 0.42198286 3.34906680 5.93223825 0.00000000 0.00000000 0.00000000 0.32684335 0.03535204 0.03842269 -0.02860575 0.00000000 -1.63693016 0.00000000 2.38400000 286.00000000 23_2PHK2.PDB 4.30281000 -21.59829238 -4.71250000 -5.62500000 -12.00157829 -4.94609994 14.50341934 -17.31531517 0.28745058 3.82206949 5.90084986 0.00000000 0.00000000 0.00000000 0.47818220 0.03157901 0.03802943 -0.14698311 0.00000000 -1.88081678 0.00000000 2.38400000 286.00000000 24_2PHK2.PDB 3.53274000 -17.96379092 -4.71250000 -8.25000000 -11.75625155 -4.66417069 16.56756218 -14.90993321 0.34237926 4.55899829 6.25479510 0.00000000 0.00000000 0.00000000 0.56165222 0.02874257 0.04336072 -0.22675171 0.00000000 -1.77293151 0.00000000 2.38400000 286.00000000 25_2PHK2.PDB 3.74254000 -16.50398891 -4.71250000 -4.40000000 -12.47932419 -2.83719818 15.30208301 -17.09716175 0.64274084 3.29150029 5.97580689 0.00000000 0.00000000 0.00000000 0.41359357 0.03125596 -0.00275149 -0.19010217 0.00000000 -0.41067574 -0.00000000 2.38400000 286.00000000 26_2PHK2.PDB 3.60866000 -15.85371631 -4.71250000 -3.00000000 -12.01372501 -3.82454349 15.37552188 -16.31548417 0.71308490 3.32968532 5.97319695 0.00000000 0.00000000 0.00000000 0.41486966 0.02612707 0.03397091 -0.27282114 0.00000000 -1.55497211 0.00000000 2.38400000 286.00000000 27_2PHK2.PDB 3.91712000 -17.41218810 -4.71250000 -8.72500000 -10.23401829 -3.73075683 13.97499643 -13.54896666 0.76209967 3.44756952 5.27941786 0.00000000 0.00000000 0.00000000 0.81046648 0.01156492 -0.00275952 -0.06520315 0.00000000 -0.66753360 0.00000000 2.38400000 286.00000000 28_2PHK2.PDB 3.75133000 -15.37491203 -4.71250000 -3.00000000 -12.01616438 -3.36551678 17.60131059 -17.29580179 0.42051517 2.93305022 5.58729147 0.00000000 0.00000000 0.00000000 0.36522292 0.03981531 0.04064897 -0.19409021 0.00000000 -1.73887821 0.00000000 2.38400000 286.00000000 29_2PHK2.PDB 4.23047000 -16.49784023 -4.71250000 -4.73750000 -11.76368297 -3.17396504 16.50229567 -17.28274244 0.29727655 3.07428664 5.66456391 0.00000000 0.00000000 0.00000000 0.48443445 0.03569844 -0.00269893 -0.17377994 0.00000000 -0.67382815 0.00000000 2.38400000 286.00000000 30_2PHK2.PDB 3.94938000 -19.92002726 -4.71250000 -8.25000000 -12.28990282 -4.33696478 16.07617195 -16.07204615 0.28783547 4.47801840 6.35770671 0.00000000 0.00000000 0.00000000 0.51670270 0.02245882 0.03839983 -0.30443814 0.00000000 -1.70901044 0.00000000 2.38400000 286.00000000