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_1PJM2.PDB 7.99148000 -36.01949158 -14.21250000 -22.21250000 -26.07403692 -9.40056325 40.36335882 -28.92394742 2.67021298 14.28604901 11.36201702 0.00000000 0.00000000 0.00000000 2.09571568 1.73910310 -0.45616082 -0.99991279 0.00000000 -4.51722390 0.00000000 2.38400000 448.00000000 2_1PJM2.PDB 6.37114000 -24.55845901 -12.43750000 -19.41250000 -25.43296287 -8.99234558 37.56375829 -27.74070278 11.21021629 13.46740910 9.98396898 0.00000000 0.00000000 0.00000000 2.19693182 1.70444635 -0.10331988 -0.78396980 0.00000000 -4.07744258 0.00000000 2.38400000 448.00000000 3_1PJM2.PDB 6.73300000 -33.11646192 -14.21250000 -22.51250000 -26.56628343 -12.71020776 41.00289630 -28.72553848 7.11616283 15.41012639 11.80731337 0.00000000 0.00000000 0.12122318 2.48540270 2.03380273 -0.53299572 -1.14924154 0.00000000 -4.65031975 0.00000000 2.38400000 448.00000000 4_1PJM2.PDB 7.55431000 -36.40343424 -12.51250000 -24.18750000 -27.38667225 -10.87929601 42.37412760 -30.20306345 2.63474418 16.40587857 11.74016551 0.00000000 0.00000000 0.00000000 2.10806158 1.98984005 -0.15193566 -1.14035266 0.00000000 -5.20509163 0.00000000 2.38400000 448.00000000 5_1PJM2.PDB 8.30341000 -30.21760909 -13.32500000 -24.93750000 -26.52356094 -10.34766759 38.16898871 -29.01898467 15.07727397 12.96763422 11.05912821 0.00000000 0.00000000 0.00000000 2.35920305 1.70332145 -0.14013775 -0.73954619 0.00000000 -4.81744010 0.00000000 2.38400000 448.00000000 6_1PJM2.PDB 6.93356000 -28.17448455 -13.36250000 -21.63750000 -25.81651719 -9.23015712 38.51990842 -28.20332029 10.33259870 14.08650355 10.52434644 0.00000000 0.00000000 0.10920767 2.39273168 2.03561416 -0.09563188 -1.16209483 0.00000000 -4.63205968 0.00000000 2.38400000 448.00000000 7_1PJM2.PDB 9.34648000 -35.66755016 -14.17500000 -27.32500000 -27.12314650 -9.32441502 40.86088022 -28.96606302 9.57934630 13.94221693 9.81989087 0.00000000 0.00000000 0.00000000 2.42523484 2.65153965 -0.17476677 -0.83913530 0.00000000 -4.36759271 0.00000000 2.38400000 448.00000000 8_1PJM2.PDB 8.95437000 -39.57347205 -10.73750000 -29.03750000 -27.57191033 -11.69251634 43.94815820 -29.63999766 2.70527211 14.63646638 11.35481554 0.00000000 0.00000000 0.00000000 2.54817960 2.11582279 -0.16840381 -0.69631084 0.00000000 -5.22222490 0.00000000 2.38400000 448.00000000 9_1PJM2.PDB 8.46077000 -31.53063755 -14.46250000 -25.83750000 -28.27216094 -10.38082828 41.87220284 -30.46764052 13.92915157 15.20355152 10.28214529 0.00000000 0.00000000 0.00000000 2.56377842 2.76313280 -0.16283644 -0.91257217 0.00000000 -4.88542884 0.00000000 2.38400000 448.00000000 10_1PJM2.PDB 13.69920000 -34.96375677 -14.21250000 -23.92500000 -26.54987953 -9.29031170 39.85308370 -27.97806338 5.92852427 13.10129648 9.72605341 0.00000000 0.00000000 0.00000000 3.91129439 2.82024086 -0.45264507 -0.57290226 0.00000000 -4.50270707 0.00000000 2.38400000 448.00000000 11_1PJM2.PDB 6.66112000 -34.13950066 -12.47500000 -26.03750000 -27.64505482 -10.65223865 41.51964121 -29.54968261 6.61731724 15.91339408 11.56517743 0.00000000 0.00000000 0.10897896 2.66528646 2.46560624 -0.11804606 -0.97673251 0.00000000 -5.07504138 0.00000000 2.38400000 448.00000000 12_1PJM2.PDB 10.24960000 -28.98048279 -12.97500000 -22.68750000 -26.53016927 -11.05324527 39.70360895 -29.06141046 11.03313101 13.93548682 12.23761044 0.00000000 0.00000000 0.00000000 2.16228746 2.30757198 -0.12374866 -1.35322337 0.00000000 -4.26831045 0.00000000 2.38400000 448.00000000 13_1PJM2.PDB 5.93306000 -25.82135892 -11.62500000 -20.63750000 -27.31003145 -12.66032051 40.55881028 -29.12037264 11.89020699 14.52022077 11.62594603 0.00000000 0.00000000 0.12551227 2.73435547 2.04297953 -0.11543182 -0.99806022 0.00000000 -4.80969409 0.00000000 2.38400000 448.00000000 14_1PJM2.PDB 8.66571000 -37.17796092 -12.47500000 -23.48750000 -27.52760084 -12.09138150 42.83363501 -29.50477591 3.23380218 14.67946519 11.65358031 0.00000000 0.00000000 0.00000000 2.13145630 2.07808757 -0.17636098 -0.84700579 0.00000000 -5.60027490 0.00000000 2.38400000 448.00000000 15_1PJM2.PDB 9.89173000 -37.73085022 -12.47500000 -24.15000000 -25.61141556 -8.82019868 39.27354028 -28.80713206 3.20885268 13.40687838 10.12211903 0.00000000 0.00000000 0.00000000 1.34828745 2.03352544 -0.19069521 -0.86339859 0.00000000 -4.17268794 0.00000000 2.38400000 448.00000000 16_1PJM2.PDB 8.07260000 -37.45083010 -15.95000000 -27.32500000 -28.79630383 -13.69203443 46.21650945 -30.66157793 7.32039013 16.34610526 14.25824109 0.00000000 0.00000000 0.00000000 2.46414997 2.42633573 -0.39197186 -1.52153344 0.00000000 -5.71780451 0.00000000 2.38400000 448.00000000 17_1PJM2.PDB 7.46582000 -34.23570193 -11.87500000 -20.85000000 -25.40200411 -11.13678290 37.90452424 -28.44044110 2.28799493 15.34084281 11.38519132 0.00000000 0.00000000 0.00000000 2.02861741 1.86064004 -0.12555697 -1.00210958 0.00000000 -4.35097797 0.00000000 2.38400000 448.00000000 18_1PJM2.PDB 6.95571000 -31.94556396 -10.66250000 -25.18750000 -25.69910743 -9.12943000 38.61622741 -27.98912103 6.60556103 13.57983377 11.14995619 0.00000000 0.00000000 0.09556227 2.58841736 1.31890725 -0.30009190 -1.25478730 0.00000000 -4.35858433 0.00000000 2.38400000 448.00000000 19_1PJM2.PDB 6.73521000 -34.69239317 -11.58750000 -21.56250000 -25.05248061 -9.50271586 37.62728406 -27.76214714 3.42331965 13.19356678 10.49692845 0.00000000 0.00000000 0.00000000 1.72919503 1.69493890 -0.10987961 -0.91050476 0.00000000 -4.67495915 0.00000000 2.38400000 448.00000000 20_1PJM2.PDB 8.49272000 -29.85355526 -12.43750000 -18.81250000 -24.81451871 -9.71707388 37.18707796 -27.61112382 5.38823345 14.05311517 10.59963126 0.00000000 0.00000000 0.00000000 2.28095085 0.90472147 -0.03765910 -0.99166373 0.00000000 -4.94052470 0.00000000 2.38400000 448.00000000 21_1PJM2.PDB 10.55640000 -30.89782005 -14.25000000 -22.52500000 -27.28404707 -10.37945752 40.98335359 -29.21790405 7.38449895 14.30617687 10.99020574 0.00000000 0.00000000 0.00000000 4.60578914 2.81592676 -0.10272006 -0.53948895 0.00000000 -4.86922670 0.00000000 2.38400000 448.00000000 22_1PJM2.PDB 11.47800000 -37.08336186 -13.36250000 -24.35000000 -26.91990938 -11.80718336 40.78078439 -30.06915882 5.86343274 15.07367164 12.44372726 0.00000000 0.00000000 0.00000000 2.25657622 1.08781484 -0.15467479 -1.12783008 0.00000000 -5.71029767 0.00000000 2.38400000 448.00000000 23_1PJM2.PDB 7.01724000 -26.50248378 -10.95000000 -19.32500000 -26.99304771 -11.88180311 40.79094809 -28.72290839 9.15449374 13.77060803 10.30937393 0.00000000 0.00000000 0.13774547 3.14504969 2.54903496 -0.10744201 -1.22545992 0.00000000 -4.60504159 0.00000000 2.38400000 448.00000000 24_1PJM2.PDB 7.61451000 -28.87884598 -14.17500000 -21.17500000 -25.85066410 -11.97616710 39.78229586 -27.73315513 9.23561142 15.26372955 11.31557844 0.00000000 0.00000000 0.00000000 2.34774568 1.81707326 -0.32101185 -1.37930015 0.00000000 -4.21350859 0.00000000 2.38400000 448.00000000 25_1PJM2.PDB 9.46113000 -32.68219380 -13.36250000 -21.62500000 -27.28462644 -9.92499722 40.14049219 -28.79375138 7.72255846 13.06882665 10.76527863 0.00000000 0.00000000 0.00000000 2.74381791 2.96335941 -0.45943948 -0.99808241 0.00000000 -4.67477072 0.00000000 2.38400000 448.00000000 26_1PJM2.PDB 12.37080000 -26.79521649 -12.43750000 -20.75000000 -26.05347763 -9.53237866 40.34644089 -27.45772917 8.20714147 13.77007456 10.23550311 0.00000000 0.00000000 0.00000000 2.38102636 2.70416453 -0.11136173 -0.88729145 0.00000000 -4.50566424 0.00000000 2.38400000 448.00000000 27_1PJM2.PDB 9.50035000 -34.02375489 -14.17500000 -23.48750000 -27.85534736 -12.54283130 42.77990349 -29.56324870 6.30166948 15.40998528 12.46428635 0.00000000 0.00000000 0.09556227 2.75941564 3.04586218 -0.13582820 -1.26553451 0.00000000 -4.80928734 0.00000000 2.38400000 448.00000000 28_1PJM2.PDB 8.70294000 -32.38901126 -13.28750000 -22.73750000 -26.26606632 -9.47598908 40.20131827 -28.00485923 5.51723525 13.97331234 10.77226423 0.00000000 0.00000000 0.00000000 2.66411372 2.85062563 -0.09710560 -1.19287710 0.00000000 -4.45535772 0.00000000 2.38400000 448.00000000 29_1PJM2.PDB 9.50296000 -27.76231328 -13.32500000 -23.03750000 -26.41554421 -9.45441659 39.82761087 -28.03430167 11.08802821 12.91943366 11.44108257 0.00000000 0.00000000 0.09556227 2.76798775 2.67116179 -0.15521789 -0.85798896 0.00000000 -4.62204928 0.00000000 2.38400000 448.00000000 30_1PJM2.PDB 8.27586000 -39.25246685 -14.28750000 -26.30000000 -27.36211792 -10.88351543 43.81050917 -29.38446380 1.97506289 15.25475459 10.86144236 0.00000000 0.00000000 0.00000000 2.88082509 2.75030994 -0.15891002 -0.60265354 0.00000000 -5.05590024 0.00000000 2.38400000 448.00000000