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_1P3Q2.PDB 1.84405000 -13.86172181 -0.85000000 -3.33750000 -6.21374986 -1.55278796 4.19546565 -11.66169777 0.26494065 3.65431837 2.14778103 0.00000000 0.00000000 0.00000000 0.51813659 0.30865621 -0.00554710 -0.06140093 0.00000000 -0.95968047 0.00000000 2.38400000 93.00000000 2_1P3Q2.PDB 3.16630000 -15.66558516 -2.58750000 -5.11250000 -7.34692301 -1.43451264 6.33101361 -12.60546474 0.80027387 3.94396466 2.80594097 0.00000000 0.00000000 0.00000000 0.54866729 0.50744610 -0.00554710 -0.12230870 0.00000000 -0.88068936 0.00000000 2.38400000 93.00000000 3_1P3Q2.PDB 2.52028000 -13.95849753 -0.85000000 -3.67500000 -7.23322312 -1.19469660 5.51477215 -12.88419252 0.82121098 3.69546929 2.35606533 0.00000000 0.00000000 0.00000000 0.52249718 0.52090600 -0.00554710 -0.11362276 0.00000000 -0.91223035 0.00000000 2.38400000 93.00000000 4_1P3Q2.PDB 4.47794000 -14.52037495 -0.85000000 -3.67500000 -7.96335401 -1.07117948 5.71824041 -14.22641319 1.48605224 3.96541238 2.42008871 0.00000000 0.00000000 0.00000000 0.59130606 0.54137565 -0.00554710 -0.13969593 0.00000000 -0.77028504 0.00000000 2.38400000 93.00000000 5_1P3Q2.PDB 3.09096000 -14.50036047 -2.58750000 -5.11250000 -6.43938516 -1.45852630 5.83321929 -11.77549798 1.03372570 3.91501883 2.66024490 0.00000000 0.00000000 0.00000000 0.49671353 0.35413998 -0.00554710 -0.17217581 0.00000000 -0.88815037 0.00000000 2.38400000 93.00000000 6_1P3Q2.PDB 1.65145000 -13.77977522 -0.85000000 -3.33750000 -6.28803070 -1.45258621 4.29659488 -11.77687017 0.25848662 3.62570557 2.21441927 0.00000000 0.00000000 0.00000000 0.49729231 0.29130517 -0.00554710 -0.04860324 0.00000000 -0.91313645 0.00000000 2.38400000 93.00000000 7_1P3Q2.PDB 4.98827000 -13.08199542 -0.00000000 -3.88750000 -7.76762614 -1.09339128 6.01167917 -13.98869283 1.13814486 4.28899479 2.54551226 0.00000000 0.00000000 0.00000000 0.69151132 0.55983025 -0.00497998 -0.12241258 0.00000000 -0.89323502 0.00000000 2.38400000 93.00000000 8_1P3Q2.PDB 1.68478000 -14.14085836 -0.85000000 -3.33750000 -6.64740810 -1.45284846 4.70587280 -12.21467603 0.33987669 3.65247627 2.18890799 0.00000000 0.00000000 0.00000000 0.44690842 0.62598142 -0.00554710 -0.11415778 0.00000000 -0.85276306 0.00000000 2.38400000 93.00000000 9_1P3Q2.PDB 2.46936000 -12.21851875 -0.00000000 -1.77500000 -7.82116008 -0.38598209 5.49238454 -14.19815088 0.76160035 2.81582241 2.95737026 0.00000000 0.00000000 0.00000000 0.50693396 1.31441954 -0.00510610 -0.05182495 0.00000000 -0.51540617 0.00000000 2.38400000 93.00000000 10_1P3Q2.PDB 4.43813000 -11.65638487 -0.00000000 0.00000000 -7.06727781 -0.53092816 3.77280177 -13.68664498 1.07106165 2.57807331 2.23830714 0.00000000 0.00000000 0.00000000 0.53357861 0.23656561 -0.00616100 0.01790277 0.00000000 -0.57709817 0.00000000 2.38400000 93.00000000 11_1P3Q2.PDB 2.43354000 -14.69735979 -0.00000000 -1.77500000 -7.53655536 -0.35184851 4.59375782 -14.33614001 0.20542464 2.14087624 2.10251345 0.00000000 0.00000000 0.00000000 0.62127719 0.70096785 -0.00468665 -0.07581842 0.00000000 -0.28116017 0.00000000 2.38400000 93.00000000 12_1P3Q2.PDB 2.54707000 -16.13433297 -2.58750000 -5.11250000 -7.51053936 -1.46562379 6.19343567 -13.05963488 0.75622150 4.01819331 2.91820721 0.00000000 0.00000000 0.00000000 0.65393049 0.63173172 -0.00554710 -0.03625940 0.00000000 -0.89671663 0.00000000 2.38400000 93.00000000 13_1P3Q2.PDB 4.61588000 -14.60965442 -0.85000000 -3.33750000 -7.40234642 -1.37695039 4.90753145 -13.52812484 1.12537477 4.00096209 2.22197440 0.00000000 0.00000000 0.00000000 0.54537570 0.33965046 -0.00554710 -0.01863159 0.00000000 -0.89177249 0.00000000 2.38400000 93.00000000 14_1P3Q2.PDB 4.13113000 -11.78708599 -0.88750000 -0.88750000 -6.81553970 -0.56622800 4.18517771 -12.72550764 0.83452635 2.20709292 2.91016419 0.00000000 0.00000000 0.00000000 0.52349349 0.36733919 -0.00516479 -0.03660513 0.00000000 -0.52349538 0.00000000 2.38400000 93.00000000 15_1P3Q2.PDB 1.49907000 -13.12391251 -0.85000000 -3.33750000 -6.02117645 -1.51899567 4.45013467 -11.06982553 0.19759023 3.41615615 2.13197359 0.00000000 0.00000000 0.00000000 0.43400104 0.38412227 -0.00554710 -0.06049688 0.00000000 -0.89022656 0.00000000 2.38400000 93.00000000 16_1P3Q2.PDB 2.90158000 -12.65746101 -0.00000000 -2.45000000 -7.22998986 -0.81939564 5.09379012 -13.19685851 0.97970569 2.95681772 2.26366900 0.00000000 0.00000000 0.00000000 0.56235492 0.51304361 -0.00641239 -0.03869614 0.00000000 -0.77244591 0.00000000 2.38400000 93.00000000 17_1P3Q2.PDB 2.99485000 -13.79614313 -0.85000000 -3.33750000 -7.18103090 -1.50621336 5.25117602 -12.89011958 1.15437255 3.72642883 2.32682866 0.00000000 0.00000000 0.00000000 0.57250122 0.50331861 -0.00554710 -0.08466171 0.00000000 -0.97237778 0.00000000 2.38400000 93.00000000 18_1P3Q2.PDB 2.64917000 -14.14836534 -0.85000000 -3.67500000 -7.23291747 -1.17794239 5.34233349 -12.90187352 0.71615540 3.73769891 2.32025514 0.00000000 0.00000000 0.00000000 0.56450357 0.50045493 -0.00554710 -0.12002710 0.00000000 -0.86600427 0.00000000 2.38400000 93.00000000 19_1P3Q2.PDB 4.33742000 -10.32355130 -0.00000000 0.00000000 -6.74872433 -0.33504197 4.09730893 -12.70432752 1.00761755 1.96681599 2.28023478 0.00000000 0.00000000 0.00000000 0.49849626 0.45927990 -0.00633164 0.01510743 0.00000000 -0.39470678 0.00000000 2.38400000 93.00000000 20_1P3Q2.PDB 2.46207000 -11.57843336 -0.00000000 -0.67500000 -7.32552707 -0.82639386 4.83398517 -13.48387230 1.11325073 2.69201956 2.37738010 0.00000000 0.00000000 0.00000000 0.51767928 0.48097419 -0.00642909 -0.04313326 0.00000000 -0.75239263 0.00000000 2.38400000 93.00000000 21_1P3Q2.PDB 1.66782000 -13.55699373 -0.85000000 -3.33750000 -6.64526561 -1.48207385 4.73828784 -12.18689395 0.54960044 3.71307891 2.36152480 0.00000000 0.00000000 0.00000000 0.51036549 0.50730474 -0.00579661 -0.02535123 0.00000000 -0.89696996 0.00000000 2.38400000 93.00000000 22_1P3Q2.PDB 1.27219000 -1.20570930 -1.73750000 -4.22500000 -9.54394833 -1.73286318 7.81948189 -16.22109074 17.10895986 4.28467084 3.25023951 0.00000000 0.00000000 0.00000000 0.62787319 0.71158126 -0.00587090 -0.05580745 0.00000000 -0.77485398 0.00000000 2.38400000 93.00000000 23_1P3Q2.PDB 2.27173000 -13.70557993 -0.85000000 -3.33750000 -6.79062474 -1.58693735 4.59294377 -12.65472118 1.39697881 3.70150095 2.34616407 0.00000000 0.00000000 0.00000000 0.57873037 0.64365115 -0.00554710 -0.10338730 0.00000000 -0.99318024 0.00000000 2.38400000 93.00000000 24_1P3Q2.PDB 3.99177000 -12.88983982 -0.00000000 -0.00000000 -8.45455653 -0.50640711 5.32759247 -15.67900680 0.89162426 2.24269576 3.24575176 0.00000000 0.00000000 0.00000000 0.52561362 1.30016668 -0.00439291 -0.01431518 0.00000000 -0.46443917 0.00000000 2.38400000 93.00000000 25_1P3Q2.PDB 1.92488000 -13.20515215 -0.85000000 -1.90000000 -6.87796003 -1.21731452 4.53927334 -12.90858547 0.46630341 3.49604284 2.22495095 0.00000000 0.00000000 0.00000000 0.61251571 0.59065500 -0.00554710 0.03095099 0.00000000 -0.81578230 0.00000000 2.38400000 93.00000000 26_1P3Q2.PDB 2.51030000 -13.85102429 -0.85000000 -3.33750000 -7.19591736 -1.38710660 5.29186425 -12.83992270 0.81175280 3.69621806 2.37192851 0.00000000 0.00000000 0.00000000 0.53871420 0.52039464 -0.00554710 -0.01947539 0.00000000 -0.92603296 0.00000000 2.38400000 93.00000000 27_1P3Q2.PDB 2.50263000 -13.37088699 -0.85000000 -3.67500000 -7.26722741 -1.05316220 5.49314578 -12.89976139 0.88557040 3.85888901 2.37101830 0.00000000 0.00000000 0.00000000 0.58664481 0.49055306 -0.00554710 -0.06532828 0.00000000 -0.75012891 0.00000000 2.38400000 93.00000000 28_1P3Q2.PDB 2.41262000 -13.24412248 -0.00000000 -1.77500000 -7.27806906 -0.42863527 3.98521746 -13.97991782 1.13080801 2.47614715 2.46026179 0.00000000 0.00000000 0.00000000 0.62432151 0.45226008 -0.00441050 -0.00745222 0.00000000 -0.44739353 0.00000000 2.38400000 93.00000000 29_1P3Q2.PDB 1.66098000 -14.65046584 -0.85000000 -3.03750000 -7.77576168 -1.88834391 6.46334799 -13.57427136 0.17257716 3.84543523 2.28423381 0.00000000 0.00000000 0.00000000 0.57121935 0.59452091 -0.00571230 -0.04035816 0.00000000 -0.81533197 0.00000000 2.38400000 93.00000000 30_1P3Q2.PDB 2.46594000 -14.51410534 -0.85000000 -3.33750000 -8.32705864 -1.84016632 6.99794846 -14.26328823 0.83479108 3.86554434 2.74005959 0.00000000 0.00000000 0.00000000 0.60164839 0.60474508 -0.00554710 -0.06306016 0.00000000 -0.86747674 0.00000000 2.38400000 93.00000000