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_2C1T2.PDB 3.61027000 -34.72720431 -5.81250000 -14.91250000 -22.68739664 -10.69620111 32.19330615 -27.17664740 0.84760668 10.28620490 6.23461520 0.00000000 0.00000000 0.00000000 1.35828816 0.97235197 -0.02180460 -0.59281601 0.00000000 -3.74735964 0.00000000 2.38400000 440.00000000 2_2C1T2.PDB 3.97378000 -37.88628267 -5.81250000 -16.33750000 -23.27054408 -11.89990093 32.29701452 -27.85091876 0.73744034 9.88070404 7.34331134 0.00000000 0.00000000 0.00000000 1.72674736 1.01604324 -0.01687971 -0.61830655 0.00000000 -4.06495023 0.00000000 2.38400000 440.00000000 3_2C1T2.PDB 4.89823000 -37.37548843 -5.17500000 -20.23750000 -23.16925607 -10.25413444 32.22741245 -27.08820042 1.07205722 10.72468006 6.45657036 0.00000000 0.00000000 0.00000000 2.23891899 1.31911416 -0.09816977 -0.78402066 0.00000000 -3.28884614 0.00000000 2.38400000 440.00000000 4_2C1T2.PDB 3.85552000 -37.11575877 -4.92500000 -18.78750000 -20.17147383 -11.10482328 27.84756515 -24.38209180 0.27612906 11.11700689 5.97651179 0.00000000 0.00000000 0.00000000 1.92761401 0.67970704 0.01033234 -0.64821031 0.00000000 -4.25181879 0.00000000 2.38400000 440.00000000 5_2C1T2.PDB 3.96867000 -39.05837005 -7.58750000 -20.40000000 -22.85999063 -11.43728503 34.53233200 -26.63643437 0.42200302 10.88220418 6.31696307 0.00000000 0.00000000 0.00000000 2.18192234 1.09619996 -0.16558600 -0.02387292 0.00000000 -4.28312572 0.00000000 2.38400000 440.00000000 6_2C1T2.PDB 4.15455000 -38.10394237 -7.58750000 -20.43750000 -23.87079983 -10.82492122 36.52223880 -27.51143998 0.74488943 10.51056189 7.63702527 0.00000000 0.00000000 0.00000000 1.65315427 1.09601193 -0.16426571 -0.83228951 0.00000000 -3.94309578 0.00000000 2.38400000 440.00000000 7_2C1T2.PDB 4.04265000 -36.46725869 -4.92500000 -16.08750000 -20.41499012 -11.38616444 28.78709074 -24.45912565 0.44661205 9.46268218 6.18519690 0.00000000 0.00000000 0.00000000 1.46677887 0.72592020 0.02857832 -1.22081960 0.00000000 -4.35059793 0.00000000 2.38400000 440.00000000 8_2C1T2.PDB 4.10644000 -37.16786467 -6.70000000 -19.57500000 -22.91161631 -10.17527974 32.86726601 -27.21266566 1.15963175 9.87620444 7.97315597 0.00000000 0.00000000 0.00000000 1.23838366 1.21572966 -0.06008497 -0.31761183 0.00000000 -3.33024800 0.00000000 2.38400000 440.00000000 9_2C1T2.PDB 3.59393000 -33.60745570 -5.81250000 -12.18750000 -21.73940619 -8.07267401 28.24345420 -27.91296638 0.67889986 9.00059242 6.17500753 0.00000000 0.00000000 0.00000000 1.24582789 0.96667661 -0.01868777 -0.17481992 0.00000000 -3.03268333 0.00000000 2.38400000 440.00000000 10_2C1T2.PDB 3.70002000 -38.09099904 -5.81250000 -15.28750000 -23.10724997 -8.55003810 29.91331338 -29.38065110 0.77792457 7.74383902 6.68667474 0.00000000 0.00000000 0.00000000 1.75338130 0.97046186 -0.01885331 -0.04432619 0.00000000 -2.76501336 0.00000000 2.38400000 440.00000000 11_2C1T2.PDB 4.03147000 -38.43642406 -9.36250000 -22.83750000 -23.27551418 -10.64539745 36.64058690 -27.00165553 1.91301546 11.19875222 7.54231041 0.00000000 0.00000000 0.00000000 1.23131168 1.22842533 -0.23182258 0.09907817 0.00000000 -3.70708915 0.00000000 2.38400000 440.00000000 12_2C1T2.PDB 4.39599000 -36.58326051 -8.47500000 -23.38750000 -23.03958225 -10.30814097 35.89519449 -26.22665228 1.47523557 11.99304732 7.84191713 0.00000000 0.00000000 0.00000000 1.85349658 1.21378235 -0.21491107 -0.41222103 0.00000000 -3.57814399 0.00000000 2.38400000 440.00000000 13_2C1T2.PDB 3.73984000 -37.16916607 -4.92500000 -14.40000000 -22.73067951 -8.61436814 29.40419940 -28.83396570 0.69587473 7.97318647 6.22809115 0.00000000 0.00000000 0.00000000 1.51383179 1.00045776 -0.01854713 -0.30449858 0.00000000 -3.15729055 0.00000000 2.38400000 440.00000000 14_2C1T2.PDB 4.77561000 -35.15241114 -4.92500000 -14.40000000 -20.58280475 -8.35703757 26.22224338 -26.57405146 0.69745855 8.52209107 5.87717901 0.00000000 0.00000000 0.00000000 2.47316333 0.69988526 0.02654255 -0.79155899 0.00000000 -3.34063627 0.00000000 2.38400000 440.00000000 15_2C1T2.PDB 4.29221000 -36.92022251 -5.77500000 -18.68750000 -23.42967562 -10.07072994 33.27002309 -28.30381518 0.97167808 9.59502913 7.65470289 0.00000000 0.00000000 0.00000000 1.66057494 1.30971373 -0.07727478 -0.45035693 0.00000000 -3.27787819 0.00000000 2.38400000 440.00000000 16_2C1T2.PDB 4.10722000 -37.07266943 -5.81250000 -15.21250000 -22.31550886 -11.09617655 31.07507455 -27.33911805 0.97183070 9.51702101 6.07768477 0.00000000 0.00000000 0.00000000 1.62122747 0.94070690 -0.02824982 -0.54725881 0.00000000 -3.98419585 0.00000000 2.38400000 440.00000000 17_2C1T2.PDB 3.88079000 -37.68272779 -7.58750000 -20.77500000 -22.61680378 -11.04809357 34.62941661 -26.25416656 0.70022147 11.69064209 6.83384081 0.00000000 0.00000000 0.00000000 1.72465174 1.02595003 -0.15555577 -0.72948721 0.00000000 -4.09489362 0.00000000 2.38400000 440.00000000 18_2C1T2.PDB 3.88974000 -39.05074371 -8.47500000 -25.23750000 -23.66968557 -10.29270775 36.89049264 -27.13141001 1.30348106 12.88628176 7.61690892 0.00000000 0.00000000 0.00000000 1.49177818 1.19671038 -0.26909039 -0.65110268 0.00000000 -3.51318989 0.00000000 2.38400000 440.00000000 19_2C1T2.PDB 3.99280000 -35.97759603 -7.58750000 -17.36250000 -21.76581845 -8.85993425 31.69239404 -26.53997620 0.81246670 10.40195973 5.98034616 0.00000000 0.00000000 0.00000000 1.40834486 1.02618692 -0.15264816 -0.68199896 0.00000000 -3.32273149 0.00000000 2.38400000 440.00000000 20_2C1T2.PDB 4.05765000 -40.52361283 -7.58750000 -19.40000000 -23.48742873 -8.45405478 33.16678793 -29.28453618 0.35559512 9.53800306 7.44709157 0.00000000 0.00000000 0.00000000 1.16456263 1.08306778 -0.14958749 -0.35189199 0.00000000 -3.48065399 0.00000000 2.38400000 440.00000000 21_2C1T2.PDB 4.08278000 -35.68777041 -5.81250000 -13.92500000 -22.86446614 -8.61640770 29.63103354 -29.06466718 0.83479499 8.46697042 7.71459954 0.00000000 0.00000000 0.00000000 1.51874523 0.95776030 -0.02485224 -0.41384007 0.00000000 -3.13218080 0.00000000 2.38400000 440.00000000 22_2C1T2.PDB 3.70620000 -33.88185040 -4.92500000 -13.37500000 -19.61964459 -8.69805370 25.31154947 -25.10774791 0.96636964 8.56117226 6.12123645 0.00000000 0.00000000 0.00000000 1.17040177 0.65013458 0.02522369 -0.90023798 0.00000000 -3.41211947 0.00000000 2.38400000 440.00000000 23_2C1T2.PDB 4.02178000 -36.51559048 -5.77500000 -17.32500000 -22.70557494 -9.41565957 31.90497926 -27.69982863 0.82393643 10.03008587 5.42432940 0.00000000 0.00000000 0.00000000 1.51484128 1.08550419 -0.09262826 -0.19154556 0.00000000 -3.00852576 0.00000000 2.38400000 440.00000000 24_2C1T2.PDB 4.51924000 -36.44319511 -6.06250000 -14.47500000 -22.03082360 -10.51685253 30.64386173 -27.17212647 0.33676487 9.59893807 5.88806463 0.00000000 0.00000000 0.00000000 1.77632016 0.91250290 -0.01777183 -0.82456883 0.00000000 -3.58750129 0.00000000 2.38400000 440.00000000 25_2C1T2.PDB 3.65239000 -41.06197849 -6.70000000 -24.48750000 -23.11741005 -7.90777434 34.47784449 -28.38982574 0.54981139 10.48111321 6.95296969 0.00000000 0.00000000 0.00000000 1.11364493 0.96072497 -0.27105835 -0.95833905 0.00000000 -2.80545465 0.00000000 2.38400000 440.00000000 26_2C1T2.PDB 4.36581000 -33.79980679 -6.70000000 -13.33750000 -22.26318314 -8.11703077 31.62367666 -27.33408979 0.38625494 8.69100159 5.74216756 0.00000000 0.00000000 0.00000000 1.52425417 1.08041332 -0.17588177 -0.76428238 0.00000000 -3.07519384 0.00000000 2.38400000 440.00000000 27_2C1T2.PDB 4.77025000 -35.90015649 -7.58750000 -18.76250000 -23.43635215 -9.60918819 33.17574404 -28.26540786 3.71889112 9.74905877 6.95779112 0.00000000 0.00000000 0.00000000 1.47777793 1.17334313 -0.10432301 -0.36029525 0.00000000 -2.85385302 0.00000000 2.38400000 440.00000000 28_2C1T2.PDB 4.45363000 -35.72176968 -5.81250000 -16.96250000 -24.04419657 -10.93300758 32.70051566 -29.06564757 4.32080846 10.30779612 5.73267493 0.00000000 0.00000000 0.00000000 1.96319555 0.94315811 -0.04353105 -0.35762449 0.00000000 -3.52775313 0.00000000 2.38400000 440.00000000 29_2C1T2.PDB 4.77754000 -34.15297750 -7.55000000 -20.50000000 -22.14449723 -9.66670791 34.08801531 -25.97430354 0.76760132 11.90950284 6.83921400 0.00000000 0.00000000 0.00000000 1.69821885 1.14511323 -0.17437925 0.03937312 0.00000000 -3.48501503 0.00000000 2.38400000 440.00000000 30_2C1T2.PDB 3.97812000 -41.59446844 -7.58750000 -20.15000000 -23.88753264 -11.93867098 36.42904251 -28.05499552 0.38043504 11.00955635 6.43094218 0.00000000 0.00000000 0.00000000 1.53372937 1.03377783 -0.13844557 -1.38150068 0.00000000 -4.23952850 0.00000000 2.38400000 440.00000000