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_1TH14.PDB 3.68208000 -37.61174882 -3.93750000 -15.00000000 -18.05646500 -13.33528678 28.98814327 -20.91336155 0.15223734 10.31223510 3.55790572 0.00000000 0.00000000 0.00000000 1.21922427 0.87282416 0.01230536 -1.33919108 0.00000000 -9.27199547 0.00000000 2.38400000 534.00000000 2_1TH14.PDB 4.11263000 -33.50516645 -3.93750000 -15.90000000 -18.18903917 -12.13411326 28.96249140 -21.03909282 1.67490700 10.43971426 5.00443162 0.00000000 0.00000000 0.00000000 1.02926745 0.56584749 0.00872743 -1.00173318 0.00000000 -8.42322719 0.00000000 2.38400000 534.00000000 3_1TH14.PDB 3.06632000 -32.40624900 -3.05000000 -14.30000000 -17.47598340 -12.69666551 26.42893923 -20.53814003 1.53710635 10.78521325 5.49401187 0.00000000 0.00000000 0.00000000 1.05746268 0.42886139 0.07150027 -1.07880112 0.00000000 -8.64089259 0.00000000 2.38400000 534.00000000 4_1TH14.PDB 3.80433000 -32.67981579 -3.93750000 -12.90000000 -17.75921318 -12.21274144 27.51863392 -20.87501980 0.61624220 10.25192313 4.77640981 0.00000000 0.00000000 0.00000000 0.93566327 0.53743226 -0.01262341 -0.79386688 0.00000000 -8.28772341 0.00000000 2.38400000 534.00000000 5_1TH14.PDB 4.57244000 -37.43831542 -3.93750000 -14.32500000 -18.62203416 -12.89650996 29.60544337 -22.38939154 1.90402242 9.33415538 3.33928934 0.00000000 0.00000000 0.00000000 0.95763298 0.96718170 0.00958319 -1.31233332 0.00000000 -9.10567311 0.00000000 2.38400000 534.00000000 6_1TH14.PDB 3.26552000 -34.54983212 -3.93750000 -14.40000000 -18.33146985 -12.63161723 29.64367992 -21.92450964 0.79622130 10.57156042 4.84954732 0.00000000 0.00000000 0.00000000 0.89758873 0.90583548 0.00266979 -0.99351072 0.00000000 -9.09249215 0.00000000 2.38400000 534.00000000 7_1TH14.PDB 3.73112000 -33.45704322 -3.93750000 -12.81250000 -18.13155704 -11.80175894 28.17935492 -21.79402522 0.78553454 9.49364584 4.55529945 0.00000000 0.00000000 0.00000000 1.36993646 0.55834159 -0.00244650 -0.94574294 0.00000000 -8.41528380 0.00000000 2.38400000 534.00000000 8_1TH14.PDB 5.13200000 -34.07799911 -3.93750000 -14.86250000 -18.28023512 -13.11635627 29.66017305 -21.19484527 0.45610641 10.52864446 5.15233496 0.00000000 0.00000000 0.00000000 0.82024718 0.47481845 -0.00652839 -0.54660835 0.00000000 -8.75093177 0.00000000 2.38400000 534.00000000 9_1TH14.PDB 3.27756000 -35.70745667 -3.93750000 -14.32500000 -18.43503559 -11.79649335 28.80642579 -22.04887136 0.18994196 9.82196585 3.73669421 0.00000000 0.00000000 0.00000000 1.27136188 1.00151327 0.00707077 -0.66541644 0.00000000 -8.33260039 0.00000000 2.38400000 534.00000000 10_1TH14.PDB 4.72849000 -33.29717130 -3.93750000 -16.63750000 -18.48277269 -11.48039400 30.23536122 -21.47026838 1.52056130 10.13330757 3.97689749 0.00000000 0.00000000 0.00000000 1.39685316 0.48767300 0.02327832 -0.86753803 0.00000000 -7.70745726 0.00000000 2.38400000 534.00000000 11_1TH14.PDB 4.25658000 -37.06901174 -3.93750000 -17.81250000 -18.55166502 -11.35411870 29.14854000 -21.94006842 0.31894676 10.63564388 4.06116957 0.00000000 0.00000000 0.00000000 1.44603497 1.00274314 0.02254237 -1.14039734 0.00000000 -7.96563980 0.00000000 2.38400000 534.00000000 12_1TH14.PDB 3.88362000 -34.99437453 -3.93750000 -15.18750000 -18.14331888 -12.17829453 28.16137243 -21.15777483 0.19713250 10.73837233 4.65614992 0.00000000 0.00000000 0.00000000 1.55359941 0.91253039 0.04783975 -1.04778559 0.00000000 -8.69666705 0.00000000 2.38400000 534.00000000 13_1TH14.PDB 4.04787000 -34.43094361 -3.93750000 -15.97500000 -18.06933464 -12.75662008 29.49069790 -20.83149342 0.98152585 10.43509791 4.71580060 0.00000000 0.00000000 0.00000000 1.10845282 0.59030743 0.04492020 -0.96200042 0.00000000 -8.67549032 0.00000000 2.38400000 534.00000000 14_1TH14.PDB 3.62733000 -32.59937314 -3.93750000 -12.86250000 -17.84703126 -12.53888903 28.00043159 -20.71234982 1.21849066 10.52807301 4.74691515 0.00000000 0.00000000 0.00000000 1.20173471 0.95134315 0.00159239 -1.22374283 0.00000000 -9.17459769 0.00000000 2.38400000 534.00000000 15_1TH14.PDB 3.76152000 -34.24770282 -3.93750000 -14.90000000 -18.07824996 -12.69005414 29.14683647 -21.03402991 0.64321415 10.53625054 4.50716676 0.00000000 0.00000000 0.00000000 0.97744351 0.95664328 0.01336603 -0.67293522 0.00000000 -8.75921105 0.00000000 2.38400000 534.00000000 16_1TH14.PDB 4.29614000 -37.47937758 -3.93750000 -15.96250000 -18.35368194 -12.25072959 28.72226360 -21.65621102 0.70117482 9.97714660 3.74226806 0.00000000 0.00000000 0.00000000 1.06204068 0.98303745 -0.00022327 -0.74766793 0.00000000 -8.77575759 0.00000000 2.38400000 534.00000000 17_1TH14.PDB 3.88829000 -31.78514068 -3.93750000 -11.75000000 -17.68761985 -12.61490800 27.92144201 -20.69481353 0.31592517 10.19725298 4.68159562 0.00000000 0.00000000 0.00000000 1.49834653 0.99851013 0.02206453 -0.80927385 0.00000000 -8.92765230 0.00000000 2.38400000 534.00000000 18_1TH14.PDB 4.60747000 -33.71449646 -3.93750000 -15.22500000 -18.34487397 -10.91223496 27.64994432 -21.67367008 1.54129739 10.51459735 3.97858810 0.00000000 0.00000000 0.00000000 1.06340644 0.66655195 -0.01482030 -0.76478421 0.00000000 -7.58944653 0.00000000 2.38400000 534.00000000 19_1TH14.PDB 3.21930000 -35.99477029 -3.93750000 -15.76250000 -18.79622315 -13.04629320 30.91990896 -22.19862772 0.95392887 10.54496771 4.96919270 0.00000000 0.00000000 0.00000000 0.70679803 1.02663214 0.07222238 -1.15744630 0.00000000 -9.26319860 0.00000000 2.38400000 534.00000000 20_1TH14.PDB 5.82509000 -36.52874095 -3.93750000 -15.96250000 -18.62879287 -11.94790497 28.88385698 -22.68679826 0.98386051 10.06466729 4.03363021 0.00000000 0.00000000 0.00000000 1.32984416 0.89470143 0.04147046 -0.32446039 0.00000000 -8.37811405 0.00000000 2.38400000 534.00000000 21_1TH14.PDB 3.96401000 -37.70419461 -3.93750000 -14.02500000 -18.55235619 -13.53171736 29.69390805 -22.04251402 1.14084379 9.48392091 3.51816347 0.00000000 0.00000000 0.00000000 1.12985389 0.96272555 0.01196282 -0.92591868 0.00000000 -9.66784130 0.00000000 2.38400000 534.00000000 22_1TH14.PDB 3.45159000 -35.62189495 -3.93750000 -13.32500000 -18.67555130 -13.31840137 29.38351466 -22.43477946 0.62832852 10.83095568 5.20126497 0.00000000 0.00000000 0.00000000 1.04388905 0.95071313 0.01104280 -1.45862575 0.00000000 -9.57103276 0.00000000 2.38400000 534.00000000 23_1TH14.PDB 3.47239000 -33.43004566 -3.93750000 -14.43750000 -18.42754559 -12.98998405 30.63281864 -21.82791854 0.91302130 10.35424325 5.21205915 0.00000000 0.00000000 0.00000000 1.15474926 1.00609763 0.01103910 -0.89860992 0.00000000 -9.18891825 0.00000000 2.38400000 534.00000000 24_1TH14.PDB 3.54096000 -36.33635994 -3.93750000 -14.72500000 -19.08853049 -12.08174544 29.01459175 -23.22572321 1.02056426 9.84390098 4.73259210 0.00000000 0.00000000 0.00000000 0.97609065 0.63563159 0.03902407 -0.41849446 0.00000000 -8.48613015 0.00000000 2.38400000 534.00000000 25_1TH14.PDB 4.08503000 -35.11190225 -3.93750000 -13.86250000 -18.04442555 -12.80705970 29.77519753 -20.73096659 0.64039715 9.24833754 3.38332058 0.00000000 0.00000000 0.00000000 1.19867475 0.61961516 0.04795475 -1.20885911 0.00000000 -8.81447360 0.00000000 2.38400000 534.00000000 26_1TH14.PDB 3.47123000 -33.41644231 -3.93750000 -13.56250000 -18.49938521 -11.52423702 28.02682284 -22.12681770 0.88692675 10.10429918 5.19595977 0.00000000 0.00000000 0.00000000 1.32116192 0.96317203 -0.01675528 -1.14481311 0.00000000 -8.13960446 0.00000000 2.38400000 534.00000000 27_1TH14.PDB 4.45653000 -34.51162426 -5.67500000 -17.30000000 -18.15052816 -11.96679186 30.42971330 -20.73665983 0.11336877 10.89495926 5.21275331 0.00000000 0.00000000 0.00000000 1.65935178 0.99463441 0.01803865 -1.10403780 0.00000000 -7.90679168 0.00000000 2.38400000 534.00000000 28_1TH14.PDB 4.42808000 -38.37731801 -3.93750000 -17.87500000 -18.80141881 -12.04077179 29.63055590 -22.74634908 0.82949870 10.37248073 3.94600888 0.00000000 0.00000000 0.00000000 1.33678083 0.48639205 0.01021821 -0.60952806 0.00000000 -8.49229352 0.00000000 2.38400000 534.00000000 29_1TH14.PDB 3.61747000 -34.47058111 -5.67500000 -17.01250000 -18.38998607 -12.89941180 31.29007485 -20.82200399 0.74102587 11.78419385 5.08169295 0.00000000 0.00000000 0.00000000 1.18905383 0.95593725 0.01469475 -1.10133281 0.00000000 -8.67108255 0.00000000 2.38400000 534.00000000 30_1TH14.PDB 3.91523000 -33.42043863 -3.93750000 -13.56250000 -18.13683280 -12.84452153 28.86588387 -21.22815996 0.22555645 10.19862637 5.47651186 0.00000000 0.00000000 0.00000000 1.35045166 0.62809559 0.01163228 -0.94170309 0.00000000 -8.89788374 0.00000000 2.38400000 534.00000000