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_1RDQ2.PDB 7.76898000 -44.15938111 -11.13750000 -14.60000000 -27.58034614 -15.26749250 37.62878040 -34.02347064 4.28321670 11.83512309 9.55942009 0.00000000 0.00000000 0.00000000 2.25072117 0.74857154 -0.16983307 -0.62014395 0.00000000 -6.31785626 0.00000000 2.38400000 364.00000000 2_1RDQ2.PDB 8.16096000 -42.71642559 -6.98750000 -18.30000000 -27.31396007 -17.96181029 38.52587256 -33.42200641 7.98447947 11.20084192 8.18252455 0.00000000 0.00000000 0.00000000 2.85734623 0.64907118 -0.18741545 -0.57693034 0.00000000 -6.71786776 0.00000000 2.38400000 364.00000000 3_1RDQ2.PDB 8.20976000 -43.64996060 -9.36250000 -17.52500000 -26.97503325 -15.67756974 37.79622245 -32.86026626 5.01438139 12.09134897 8.60049702 0.00000000 0.00000000 0.00000000 2.12738039 0.55392937 -0.16241258 -0.47692723 0.00000000 -6.24008177 0.00000000 2.38400000 364.00000000 4_1RDQ2.PDB 8.43165000 -41.54177706 -9.40000000 -13.50000000 -26.86483129 -15.77272990 36.18479369 -33.48763827 4.73540015 10.69444394 9.89837114 0.00000000 0.00000000 0.00000000 3.02230679 0.63018885 -0.18743949 -0.62290646 0.00000000 -6.24154735 0.00000000 2.38400000 364.00000000 5_1RDQ2.PDB 8.12083000 -40.56141860 -10.25000000 -15.45000000 -27.15661564 -12.15231359 36.15039114 -33.85135100 6.83482053 10.79322226 8.59910978 0.00000000 0.00000000 0.00000000 2.23852215 0.72635485 -0.02844013 -0.65499949 0.00000000 -5.63376462 0.00000000 2.38400000 364.00000000 6_1RDQ2.PDB 8.77331000 -39.89727289 -8.51250000 -15.55000000 -26.35158064 -12.79877980 35.21208862 -32.79853229 5.32527927 11.37238614 9.29840403 0.00000000 0.00000000 0.00000000 2.54867915 0.60693235 -0.15559358 -1.39804238 0.00000000 -6.08908142 0.00000000 2.38400000 364.00000000 7_1RDQ2.PDB 8.33205000 -40.11725197 -8.72500000 -12.13750000 -26.57316773 -16.16091555 36.79823123 -32.72735426 4.21247798 10.45373033 9.51578227 0.00000000 0.00000000 0.00000000 2.54208191 0.58306939 -0.18018715 -0.45609212 0.00000000 -6.67933887 0.00000000 2.38400000 364.00000000 8_1RDQ2.PDB 9.20162000 -37.72112319 -10.25000000 -15.07500000 -26.21920490 -12.12153306 34.93154041 -32.66135253 6.60282418 11.79568735 8.74356294 0.00000000 0.00000000 0.00000000 2.87151361 0.70719196 -0.16343579 -0.59422100 0.00000000 -5.58150441 0.00000000 2.38400000 364.00000000 9_1RDQ2.PDB 7.70471000 -41.91485258 -10.25000000 -14.38750000 -26.97583338 -15.22690173 36.62325605 -33.14371860 4.71201554 12.13222779 8.57582189 0.00000000 0.00000000 0.00000000 3.51193453 0.57507103 -0.17745642 -0.99944758 0.00000000 -6.30925067 0.00000000 2.38400000 364.00000000 10_1RDQ2.PDB 8.61559000 -40.52611869 -9.36250000 -18.78750000 -26.72718869 -12.78738506 37.25860674 -32.79315388 5.65538582 11.94820200 9.46359969 0.00000000 0.00000000 0.00000000 2.44186784 0.69132791 -0.11050534 -0.70626498 0.00000000 -6.01928282 0.00000000 2.38400000 364.00000000 11_1RDQ2.PDB 8.33326000 -41.10990411 -11.10000000 -15.40000000 -26.91748214 -12.37873696 36.30368527 -33.60103095 5.41252599 11.65959109 10.19789215 0.00000000 0.00000000 0.00000000 1.73177437 0.68547880 -0.17933137 -1.01798841 0.00000000 -5.82080315 0.00000000 2.38400000 364.00000000 12_1RDQ2.PDB 7.71535000 -41.94084297 -10.25000000 -12.82500000 -27.24436505 -14.97383637 36.51440306 -33.73285712 5.07230065 11.02200741 8.60319106 0.00000000 0.00000000 0.00000000 2.77816056 0.70333887 -0.19793686 -0.62378945 0.00000000 -6.08312084 0.00000000 2.38400000 364.00000000 13_1RDQ2.PDB 8.07012000 -42.43859052 -11.98750000 -12.60000000 -27.76115603 -14.69627409 37.97558232 -34.24076542 5.95609569 10.87751324 8.75078644 0.00000000 0.00000000 0.00000000 2.16855017 0.66236690 -0.18262146 -0.79187943 0.00000000 -5.90692194 0.00000000 2.38400000 364.00000000 14_1RDQ2.PDB 8.99695000 -45.63420316 -11.13750000 -14.93750000 -27.96911935 -16.24668332 38.27479818 -34.47182339 4.90245952 12.66355140 8.84248880 0.00000000 0.00000000 0.00000000 2.41649531 0.67864808 -0.16751151 -1.24644900 0.00000000 -6.55740979 0.00000000 2.38400000 364.00000000 15_1RDQ2.PDB 7.60134000 -41.29338840 -9.36250000 -16.10000000 -26.95717201 -12.79813253 37.31255545 -33.43050186 4.93749087 12.12173523 9.70796941 0.00000000 0.00000000 0.00000000 1.67321554 0.72168184 -0.20505106 -1.97971871 0.00000000 -6.21327874 0.00000000 2.38400000 364.00000000 16_1RDQ2.PDB 7.87861000 -41.12827202 -9.36250000 -11.77500000 -27.55094184 -16.34936781 37.31985234 -33.93030975 4.32833155 11.15036877 9.39153004 0.00000000 0.00000000 0.00000000 2.54158289 0.63458340 -0.16099801 -0.22398786 0.00000000 -6.50683235 0.00000000 2.38400000 364.00000000 17_1RDQ2.PDB 7.83823000 -41.73245536 -9.36250000 -12.77500000 -26.70988343 -15.85882108 36.57930982 -32.95536964 4.66776154 10.55410591 9.10454397 0.00000000 0.00000000 0.00000000 1.97578224 0.65944196 -0.12824730 -0.42385352 0.00000000 -6.40028387 0.00000000 2.38400000 364.00000000 18_1RDQ2.PDB 7.78021000 -37.71630362 -11.10000000 -13.90000000 -26.54296543 -10.71071204 35.26699662 -33.46226690 8.14953857 9.55770563 9.04201699 0.00000000 0.00000000 0.00000000 1.86713543 0.71959741 -0.04504278 -0.40865164 0.00000000 -5.43005807 0.00000000 2.38400000 364.00000000 19_1RDQ2.PDB 7.82305000 -39.42989144 -9.61250000 -14.97500000 -27.07142114 -11.78010302 36.41076699 -33.69722154 6.10740575 11.58580677 7.30626016 0.00000000 0.00000000 0.00000000 2.52829953 0.69016723 -0.12828843 -0.60230637 0.00000000 -5.50159014 0.00000000 2.38400000 364.00000000 20_1RDQ2.PDB 7.87481000 -38.54320576 -11.10000000 -14.17500000 -26.88891138 -15.65032746 37.31831421 -33.22499310 8.39839382 11.65696861 8.79138512 0.00000000 0.00000000 0.00000000 2.78260136 0.68626190 -0.12948892 -0.38091190 0.00000000 -5.94123613 0.00000000 2.38400000 364.00000000 21_1RDQ2.PDB 8.73822000 -39.78829451 -10.46250000 -13.37500000 -25.50032761 -11.07446034 33.72375839 -31.97539906 5.59430133 8.79867757 8.44971184 0.00000000 0.00000000 0.00000000 2.08894641 0.67411099 -0.20127660 -0.68128881 0.00000000 -5.17343762 0.00000000 2.38400000 364.00000000 22_1RDQ2.PDB 8.62123000 -43.11378153 -9.36250000 -12.77500000 -27.72339877 -16.69602631 37.75187785 -34.24921571 3.81916718 10.83712713 10.18034623 0.00000000 0.00000000 0.00000000 2.58527796 0.71055850 -0.19543814 -0.77060885 0.00000000 -6.51539009 0.00000000 2.38400000 364.00000000 23_1RDQ2.PDB 8.40850000 -42.39260117 -11.10000000 -13.97500000 -26.82557404 -14.53607294 36.14004889 -33.39717660 5.51793637 10.45954315 9.52925844 0.00000000 0.00000000 0.00000000 2.07399722 0.68951452 -0.18337953 -0.40798405 0.00000000 -5.68819806 0.00000000 2.38400000 364.00000000 24_1RDQ2.PDB 7.71420000 -36.08600994 -11.13750000 -17.48750000 -26.36758408 -12.37279931 35.80059348 -32.69070325 12.58280449 11.73987644 8.53477809 0.00000000 0.00000000 0.00000000 2.07309763 0.70479673 -0.18569534 -0.83387618 0.00000000 -5.74150191 0.00000000 2.38400000 364.00000000 25_1RDQ2.PDB 8.44335000 -38.72092846 -10.25000000 -11.21250000 -26.94609839 -13.95093511 35.91894324 -33.44334251 5.34542324 11.02309270 8.67090616 0.00000000 0.00000000 0.00000000 2.50768538 0.59569713 -0.11806662 -0.33245622 0.00000000 -5.93358031 0.00000000 2.38400000 364.00000000 26_1RDQ2.PDB 7.77041000 -41.54891252 -11.10000000 -11.75000000 -26.17560282 -15.66603278 35.56887583 -32.52625343 5.02801889 11.18498917 9.44592693 0.00000000 0.00000000 0.00000000 1.77293676 0.62304607 -0.12150778 -0.52344745 0.00000000 -6.68681583 0.00000000 2.38400000 364.00000000 27_1RDQ2.PDB 9.25963000 -34.36522344 -9.36250000 -14.33750000 -26.34046055 -13.09931989 35.96667524 -32.89616132 10.36370725 11.33415095 8.81100165 0.00000000 0.00000000 0.00000000 2.34599910 0.69549762 -0.16042670 -0.87154036 0.00000000 -6.11884881 0.00000000 2.38400000 364.00000000 28_1RDQ2.PDB 7.51997000 -40.49875644 -11.13750000 -15.33750000 -27.39937959 -11.72008906 37.40413142 -34.15267863 5.89549577 11.22036900 8.98905238 0.00000000 0.00000000 0.00000000 2.13179186 0.88240122 -0.19681250 -0.46791374 0.00000000 -5.72772335 0.00000000 2.38400000 364.00000000 29_1RDQ2.PDB 7.84148000 -37.71083308 -10.46250000 -12.82500000 -27.47067759 -14.33938874 37.73696360 -33.93579822 8.32959841 10.50490149 8.55825906 0.00000000 0.00000000 0.00000000 2.95035631 0.78844025 -0.10142355 -0.91829085 0.00000000 -5.73783301 0.00000000 2.38400000 364.00000000 30_1RDQ2.PDB 8.43411000 -38.24879176 -9.36250000 -14.32500000 -26.63454517 -16.12168869 36.87771434 -32.75833711 7.92411643 11.22380042 9.79454500 0.00000000 0.00000000 0.00000000 2.58186932 0.60687640 -0.16171580 -0.62534549 0.00000000 -6.66170501 0.00000000 2.38400000 364.00000000