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_1OTR2.PDB 3.58163000 -3.63383633 0.00000000 -1.73750000 -5.80251484 -0.64593499 6.92913659 -8.34751748 0.29895492 2.51438500 3.67952868 0.00000000 0.00000000 0.00000000 0.38963105 0.18327385 -0.01298314 -0.40773137 0.00000000 -0.49129075 0.00000000 2.38400000 96.00000000 2_1OTR2.PDB 5.60705000 -3.24337452 0.00000000 -1.73750000 -5.89390944 -0.62686203 6.99812045 -8.38126876 0.27565811 2.53767187 3.87175142 0.00000000 0.00000000 0.00000000 0.36739880 0.19681431 -0.01298314 -0.13796467 0.00000000 -0.50348714 0.00000000 2.38400000 96.00000000 3_1OTR2.PDB 2.57925000 -2.79644981 0.00000000 -1.73750000 -5.67352205 -0.33043668 6.61120411 -8.07551200 0.28014132 2.52173529 3.87261483 0.00000000 0.00000000 0.00000000 0.36599171 0.20369240 -0.01298314 -0.18385106 0.00000000 -0.43433214 0.00000000 2.38400000 96.00000000 4_1OTR2.PDB 1.94775000 -5.09055173 -1.73750000 -3.51250000 -5.77197053 -0.82346754 7.30309007 -7.68262899 0.31372797 2.81218229 4.03748669 0.00000000 0.00000000 0.00000000 0.65336055 0.16390002 -0.01331850 -0.12060334 0.00000000 -0.54841041 0.00000000 2.38400000 96.00000000 5_1OTR2.PDB 2.59471000 -4.92193818 -1.77500000 -1.77500000 -5.23946420 -0.79159874 5.65193342 -7.99967065 0.32926249 1.76197604 5.43921083 0.00000000 0.00000000 0.00000000 0.36677356 0.18819489 -0.01298314 -0.21225230 0.00000000 -0.66512548 0.00000000 2.38400000 96.00000000 6_1OTR2.PDB 1.65951000 -4.58508947 0.00000000 -1.73750000 -5.23032168 -0.77661609 5.57035465 -7.66903564 0.25509896 2.22393302 3.05919351 0.00000000 0.00000000 0.00000000 0.45454076 0.15367913 -0.01298314 -0.12285416 0.00000000 -0.59889966 0.00000000 2.38400000 96.00000000 7_1OTR2.PDB 4.62237000 -4.32487201 0.00000000 -1.73750000 -5.22319283 -0.42159630 5.92373780 -7.61039920 0.31067574 1.66944374 3.15917392 0.00000000 0.00000000 0.00000000 0.32655696 0.16767928 -0.01298314 -0.21798043 0.00000000 -0.49080827 0.00000000 2.38400000 96.00000000 8_1OTR2.PDB 2.52083000 -3.51007972 0.00000000 -1.73750000 -5.72588531 -0.67070446 6.71324376 -8.32969231 0.27156980 2.51013299 3.78657523 0.00000000 0.00000000 0.00000000 0.39532348 0.18411836 -0.01298314 -0.16952993 0.00000000 -0.54062983 0.00000000 2.38400000 96.00000000 9_1OTR2.PDB 2.51623000 -3.98996180 0.00000000 -1.73750000 -5.54062367 -0.44332917 6.05786719 -8.30660647 0.28311115 2.52199722 3.78333326 0.00000000 0.00000000 0.00000000 0.29285597 0.19453002 -0.01298314 -0.35885971 0.00000000 -0.52922444 0.00000000 2.38400000 96.00000000 10_1OTR2.PDB 1.44148000 -4.73329707 -0.88750000 -2.66250000 -5.77205770 -0.28303978 6.42865408 -8.19000588 0.32866180 3.11385284 3.36784867 0.00000000 0.00000000 0.00000000 0.40491222 0.16379215 -0.01327587 -0.17092331 0.00000000 -0.39792415 0.00000000 2.38400000 96.00000000 11_1OTR2.PDB 4.71505000 -4.50176131 0.00000000 -1.73750000 -5.59481642 -1.18727258 7.11073072 -7.93003563 0.26723168 1.67837088 3.69305440 0.00000000 0.00000000 0.00000000 0.29382835 0.17777851 -0.01298314 -0.36432623 0.00000000 -0.71804334 0.00000000 2.38400000 96.00000000 12_1OTR2.PDB 1.81621000 -4.49038368 0.00000000 -1.73750000 -5.51485512 -0.65127698 6.57735678 -7.82689854 0.29184714 2.55390719 2.11421351 0.00000000 0.00000000 0.00000000 0.37417480 0.16790971 -0.01298314 -0.13862143 0.00000000 -0.51974789 0.00000000 2.38400000 96.00000000 13_1OTR2.PDB 2.72876000 -3.01577130 0.00000000 -1.73750000 -5.86153796 -0.24380237 6.77051121 -8.36290686 0.40293533 2.41549677 3.87214441 0.00000000 0.00000000 0.00000000 0.33084493 0.20628414 -0.01298314 -0.21180680 0.00000000 -0.37716681 0.00000000 2.38400000 96.00000000 14_1OTR2.PDB 1.45933000 -3.14109206 0.00000000 -1.73750000 -4.86902026 -0.69980680 6.07859450 -6.97438401 0.21802948 2.38792900 3.06774230 0.00000000 0.00000000 0.00000000 0.22288442 0.16335245 -0.01298314 -0.16308801 0.00000000 -0.65948954 0.00000000 2.38400000 96.00000000 15_1OTR2.PDB 5.04346000 -5.54072364 -0.88750000 -2.62500000 -5.29136252 -0.93293726 5.60429949 -7.68969006 0.22682022 1.69351196 4.83975809 0.00000000 0.00000000 0.00000000 0.41206431 0.16104750 -0.01300484 -0.15985845 0.00000000 -0.71782459 0.00000000 2.38400000 96.00000000 16_1OTR2.PDB 5.74957000 -5.46674989 -0.88750000 -2.62500000 -5.45441786 -0.88537024 5.68134488 -7.94867547 0.52932346 1.77274743 4.85084690 0.00000000 0.00000000 0.00000000 0.37467955 0.16373899 -0.01298314 -0.16673612 0.00000000 -0.69500927 0.00000000 2.38400000 96.00000000 17_1OTR2.PDB 3.75443000 -4.19348059 0.00000000 -2.07500000 -6.23901871 -1.14164094 7.73412968 -8.80356010 0.45668660 2.64142925 3.86620712 0.00000000 0.00000000 0.00000000 0.51500319 0.19336304 -0.01298314 -0.42363670 0.00000000 -0.71109685 0.00000000 2.38400000 96.00000000 18_1OTR2.PDB 2.94137000 -3.68424922 -0.88750000 -2.62500000 -6.63643730 -0.61317085 8.54454960 -8.92481175 1.07989992 3.04395007 3.97832723 0.00000000 0.00000000 0.00000000 0.48640194 0.19933861 -0.01298314 -0.44737749 0.00000000 -0.67009744 0.00000000 2.38400000 96.00000000 19_1OTR2.PDB 2.62979000 -5.06286812 -1.73750000 -3.51250000 -6.40134751 -0.45996236 8.18326197 -8.91147530 0.41076446 3.16522620 4.65194111 0.00000000 0.00000000 0.00000000 0.61121685 0.19758453 -0.01298314 -0.64210273 0.00000000 -0.40740768 0.00000000 2.38400000 96.00000000 20_1OTR2.PDB 5.10303000 -5.12626740 -0.88750000 -2.62500000 -6.36124958 -0.42228893 7.55065966 -9.04693181 0.34480006 2.80242374 3.95743950 0.00000000 0.00000000 0.00000000 0.48759551 0.20424019 -0.01298314 -0.42682837 0.00000000 -0.48640404 0.00000000 2.38400000 96.00000000 21_1OTR2.PDB 1.37438000 -4.27308735 -0.88750000 -2.62500000 -6.30161152 -0.89078892 8.23110289 -8.59344120 0.41637950 2.89937337 3.94299192 0.00000000 0.00000000 0.00000000 0.44633903 0.19105967 -0.01404894 -0.17930644 0.00000000 -0.71757705 0.00000000 2.38400000 96.00000000 22_1OTR2.PDB 5.88774000 -4.16212162 0.00000000 -1.73750000 -5.25820482 -0.71018403 6.18081876 -7.76504368 0.30678633 1.57449162 3.63056929 0.00000000 0.00000000 0.00000000 0.39429722 0.18025591 -0.01298314 -0.17009627 0.00000000 -0.59507292 0.00000000 2.38400000 96.00000000 23_1OTR2.PDB 2.59564000 -4.76614940 -1.77500000 -1.77500000 -5.19730615 -0.27741028 5.09500052 -8.05358682 0.43305127 1.64330989 5.43097403 0.00000000 0.00000000 0.00000000 0.24789039 0.19230156 -0.01287970 -0.12314776 0.00000000 -0.40204478 0.00000000 2.38400000 96.00000000 24_1OTR2.PDB 4.36385000 -4.09031241 0.00000000 -1.73750000 -5.75605520 -0.87366805 7.34302488 -8.10090730 0.25786349 1.80867935 3.67184349 0.00000000 0.00000000 0.00000000 0.34093531 0.16956550 -0.01298314 -0.21494144 0.00000000 -0.81660380 0.00000000 2.38400000 96.00000000 25_1OTR2.PDB 2.15401000 -4.86420411 -1.77500000 -3.51250000 -6.09387142 -0.89526701 7.56807376 -8.35748947 0.32037279 2.96511141 5.36872991 0.00000000 0.00000000 0.00000000 0.51845156 0.18147558 -0.01298314 -0.22415312 0.00000000 -0.73367936 0.00000000 2.38400000 96.00000000 26_1OTR2.PDB 3.13902000 -2.96252219 0.00000000 -1.73750000 -6.02162960 -0.67987264 7.76790721 -8.22851652 0.36698315 2.61833590 3.32654151 0.00000000 0.00000000 0.00000000 0.47649652 0.17447715 -0.01298314 -0.26625411 0.00000000 -0.57203046 0.00000000 2.38400000 96.00000000 27_1OTR2.PDB 2.14719000 -4.59724362 -1.77500000 -3.51250000 -4.86279775 -0.89961293 6.68915442 -6.94421922 0.29705046 2.28202154 4.83910292 0.00000000 0.00000000 0.00000000 0.24339253 0.15613590 -0.01298314 -0.19809929 0.00000000 -0.74275317 0.00000000 2.38400000 96.00000000 28_1OTR2.PDB 2.59475000 -2.44131556 0.00000000 -1.73750000 -5.75936106 -0.06343546 6.76344804 -8.21355798 0.27161868 2.53259285 3.91465138 0.00000000 0.00000000 0.00000000 0.38934482 0.19415101 -0.01298314 -0.18983213 0.00000000 -0.33630157 0.00000000 2.38400000 96.00000000 29_1OTR2.PDB 2.78227000 -3.62601412 -1.77500000 -1.77500000 -4.67511156 -0.28916924 4.83654709 -7.02403467 0.37352167 1.49842643 5.43371764 0.00000000 0.00000000 0.00000000 0.29367527 0.18712031 -0.01298314 -0.11557554 0.00000000 -0.39502807 0.00000000 2.38400000 96.00000000 30_1OTR2.PDB 1.48343000 -3.18460823 -0.00000000 -1.73750000 -5.40459076 -0.37626612 6.38004181 -7.71723520 0.25734723 2.52495273 3.21281149 0.00000000 0.00000000 0.00000000 0.36974078 0.17156156 -0.01298314 -0.22888052 0.00000000 -0.45204652 0.00000000 2.38400000 96.00000000