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_1I8H2.PDB 2.79757000 -11.42756136 -0.63750000 -4.82500000 -7.44594538 -2.98059864 8.69370938 -9.90976339 0.95541293 4.31303494 3.49534518 0.00000000 0.00000000 0.00000000 0.82056162 0.00000000 0.00000000 -0.96566501 0.00000000 -2.94115297 0.00000000 2.38400000 52.00000000 2_1I8H2.PDB 2.44720000 -8.72323323 -0.63750000 -1.35000000 -7.00887779 -3.97644009 8.54541378 -8.86997504 0.87942987 3.25875482 4.34680646 0.00000000 0.00000000 0.00000000 0.45552183 0.00000000 0.00000000 -1.13816550 0.00000000 -3.22820158 0.00000000 2.38400000 52.00000000 3_1I8H2.PDB 2.68406000 -6.36717132 -0.63750000 -1.01250000 -6.29354443 -1.79165662 7.53384503 -8.10958653 0.81190162 2.28088350 3.17246461 0.00000000 0.00000000 0.00000000 0.25613454 0.00000000 0.00000000 -0.15028636 0.00000000 -2.42732667 0.00000000 2.38400000 52.00000000 4_1I8H2.PDB 3.16323000 -8.22878586 -0.63750000 -2.40000000 -6.77195595 -4.34532869 9.28802189 -8.60966072 0.74732618 4.24490537 3.66635207 0.00000000 0.00000000 0.00000000 0.61463630 0.00000000 0.00000000 -0.58712219 0.00000000 -3.43846011 0.00000000 2.38400000 52.00000000 5_1I8H2.PDB 2.29790000 -7.37076084 -0.63750000 -2.76250000 -6.68242970 -3.30030670 8.66436511 -8.58534389 0.89284512 3.74032212 4.01182395 0.00000000 0.00000000 0.00000000 0.50202825 0.00000000 0.00000000 -0.14089310 0.00000000 -3.07317200 0.00000000 2.38400000 52.00000000 6_1I8H2.PDB 2.42005000 -7.06954110 -0.63750000 -1.72500000 -6.08939912 -2.70747587 7.87708666 -7.72010850 0.15670573 3.64020547 2.92369757 0.00000000 0.00000000 0.00000000 0.38990776 0.00000000 0.00000000 -0.29991692 0.00000000 -2.87774388 0.00000000 2.38400000 52.00000000 7_1I8H2.PDB 2.50707000 -6.90490199 -0.63750000 -1.35000000 -6.46458073 -2.92353637 7.92132532 -8.10729441 0.22773796 3.52087759 3.69584600 0.00000000 0.00000000 0.00000000 0.40710317 0.00000000 0.00000000 -0.15960693 0.00000000 -3.03527358 0.00000000 2.38400000 52.00000000 8_1I8H2.PDB 2.80411000 -8.59170879 -0.63750000 -1.72500000 -6.93532257 -4.56350293 9.85732397 -8.63077342 0.59163442 3.95084946 3.18527967 0.00000000 0.00000000 0.00000000 0.59657945 0.00000000 0.00000000 -0.71465004 0.00000000 -3.56662680 0.00000000 2.38400000 52.00000000 9_1I8H2.PDB 2.28662000 -7.79441339 -0.63750000 -2.06250000 -6.56817959 -3.85178607 8.91423620 -8.24141522 0.81495913 4.01229635 2.81433070 0.00000000 0.00000000 0.00000000 0.54173630 0.00000000 0.00000000 -0.26206411 0.00000000 -3.26852709 0.00000000 2.38400000 52.00000000 10_1I8H2.PDB 2.57393000 -7.61965050 -0.63750000 -1.72500000 -7.26496524 -3.41025749 9.53991703 -9.47362508 1.02703363 4.09508388 3.50567316 0.00000000 0.00000000 0.00000000 0.38536947 0.00000000 0.00000000 -0.56450786 0.00000000 -3.09687200 0.00000000 2.38400000 52.00000000 11_1I8H2.PDB 2.37400000 -8.72013726 -0.63750000 -3.42500000 -7.20617661 -3.55398818 9.36547192 -8.94798548 0.86744009 4.41481809 4.29724826 0.00000000 0.00000000 0.00000000 0.58077051 0.00000000 0.00000000 -1.42784340 0.00000000 -3.04739246 0.00000000 2.38400000 52.00000000 12_1I8H2.PDB 2.81030000 -8.31825707 -0.63750000 -3.42500000 -6.12744144 -2.50108160 7.72273810 -7.74278510 0.27057592 3.56023096 3.35488434 0.00000000 0.00000000 0.00000000 0.43782002 0.00000000 0.00000000 -0.32137576 0.00000000 -2.90932251 0.00000000 2.38400000 52.00000000 13_1I8H2.PDB 2.49139000 -8.31409897 -0.63750000 -2.40000000 -6.88556563 -4.63533102 10.10373695 -8.45790029 0.42903224 4.13088326 3.38884785 0.00000000 0.00000000 0.00000000 0.54150641 0.00000000 0.00000000 -0.39335232 0.00000000 -3.49845641 0.00000000 2.38400000 52.00000000 14_1I8H2.PDB 2.60821000 -7.15225010 -0.63750000 -1.72500000 -6.02780656 -2.58253080 7.71336461 -7.87008889 0.24170307 3.75053568 2.72743635 0.00000000 0.00000000 0.00000000 0.60947597 0.00000000 0.00000000 -0.64085374 0.00000000 -2.71098578 0.00000000 2.38400000 52.00000000 15_1I8H2.PDB 2.49531000 -9.16581162 -0.63750000 -2.10000000 -7.02922387 -4.19604054 9.10354576 -9.12418417 1.05963393 4.10961703 3.28352390 0.00000000 0.00000000 0.00000000 0.43190130 0.00000000 0.00000000 -0.63749899 0.00000000 -3.42958598 0.00000000 2.38400000 52.00000000 16_1I8H2.PDB 2.63395000 -8.28088880 -0.63750000 -3.08750000 -6.35393633 -2.63757095 8.04212262 -8.16255857 0.61972622 3.63631568 3.04017441 0.00000000 0.00000000 0.00000000 0.53372621 0.00000000 0.00000000 -0.40485764 0.00000000 -2.86903045 0.00000000 2.38400000 52.00000000 17_1I8H2.PDB 2.87946000 -8.04622125 -0.63750000 -3.68750000 -6.11601541 -2.18239515 8.27584441 -7.97760313 0.19489727 3.29462099 3.15318749 0.00000000 0.00000000 0.00000000 0.68726060 0.00000000 0.00000000 -0.41477245 0.00000000 -2.63624587 0.00000000 2.38400000 52.00000000 18_1I8H2.PDB 2.33116000 -8.72072827 -0.63750000 -2.40000000 -6.83265129 -4.51740687 9.59970640 -8.36705858 0.89989521 4.33102726 3.02121132 0.00000000 0.00000000 0.00000000 0.46762176 0.00000000 0.00000000 -0.84189928 0.00000000 -3.44367421 0.00000000 2.38400000 52.00000000 19_1I8H2.PDB 2.18274000 -8.10614665 -0.63750000 -1.72500000 -6.48725358 -4.36677408 8.55514174 -8.09789405 0.76467030 4.03391737 3.58532258 0.00000000 0.00000000 0.00000000 0.49485434 0.00000000 0.00000000 -0.84490448 0.00000000 -3.38072678 0.00000000 2.38400000 52.00000000 20_1I8H2.PDB 2.54674000 -7.66438054 -0.63750000 -2.38750000 -6.04725289 -2.28921894 7.76741170 -7.81360387 0.28254630 3.33356666 2.60574588 0.00000000 0.00000000 0.00000000 0.44025050 0.00000000 0.00000000 -0.32814533 0.00000000 -2.59068055 0.00000000 2.38400000 52.00000000 21_1I8H2.PDB 2.81904000 -6.80905977 -0.63750000 -1.68750000 -6.19153208 -2.67928848 7.61573417 -7.80887638 0.27545834 3.60615473 3.08793267 0.00000000 0.00000000 0.00000000 0.85578087 0.00000000 0.00000000 -0.41941983 0.00000000 -2.82600379 0.00000000 2.38400000 52.00000000 22_1I8H2.PDB 2.59797000 -9.24942618 -0.63750000 -1.38750000 -8.02409733 -3.87259962 9.39427121 -10.93586185 0.79782374 4.62553776 4.04823901 0.00000000 0.00000000 0.00000000 0.63799556 0.00000000 0.00000000 -0.57502901 0.00000000 -3.32070565 0.00000000 2.38400000 52.00000000 23_1I8H2.PDB 2.51807000 -8.47020679 -0.63750000 -2.40000000 -7.61548508 -3.63285831 9.35118017 -9.98065738 1.14914580 4.49058089 4.07036807 0.00000000 0.00000000 0.00000000 0.45835758 0.00000000 0.00000000 -0.46604027 0.00000000 -3.25729826 0.00000000 2.38400000 52.00000000 24_1I8H2.PDB 3.38123000 -10.72172461 -0.63750000 -4.57500000 -6.25069805 -2.86569135 8.22453038 -7.79799360 0.38470497 2.42403327 3.29237471 0.00000000 0.00000000 0.00000000 0.43645698 0.00000000 0.00000000 -0.28072258 0.00000000 -3.07621935 0.00000000 2.38400000 52.00000000 25_1I8H2.PDB 2.54054000 -7.74677097 -0.63750000 -1.76250000 -6.60013567 -3.83537163 8.83077402 -8.31416616 0.41724580 3.52012579 4.07313026 0.00000000 0.00000000 0.00000000 0.54108338 0.00000000 0.00000000 -0.82426948 0.00000000 -3.15518727 0.00000000 2.38400000 52.00000000 26_1I8H2.PDB 2.31089000 -8.17338359 -0.63750000 -2.40000000 -7.17493154 -4.06651760 9.38517345 -9.15899103 1.09240757 4.40167187 3.65797465 0.00000000 0.00000000 0.00000000 0.44986896 0.00000000 0.00000000 -0.33360843 0.00000000 -3.38893149 0.00000000 2.38400000 52.00000000 27_1I8H2.PDB 2.38487000 -8.35632800 -0.63750000 -1.38750000 -6.31209420 -4.33561602 8.11163774 -8.02428674 0.93127821 3.87469797 3.18896527 0.00000000 0.00000000 0.00000000 0.47476097 0.00000000 0.00000000 -1.00158614 0.00000000 -3.23908506 0.00000000 2.38400000 52.00000000 28_1I8H2.PDB 2.09104000 -7.38079552 -0.63750000 -2.40000000 -7.26411488 -3.75769566 9.48940033 -9.16981101 0.78727463 4.78365933 3.89203009 0.00000000 0.00000000 0.00000000 0.43326240 0.00000000 0.00000000 -0.32819885 0.00000000 -3.20910191 0.00000000 2.38400000 52.00000000 29_1I8H2.PDB 2.21571000 -7.53811879 -0.63750000 -2.13750000 -7.45220247 -4.13654215 10.05639722 -9.13877188 0.72822961 4.98212104 3.64816296 0.00000000 0.00000000 0.00000000 0.49259085 0.00000000 0.00000000 -0.44123311 0.00000000 -3.50187086 0.00000000 2.38400000 52.00000000 30_1I8H2.PDB 2.55960000 -8.60455852 -0.63750000 -2.40000000 -6.98196363 -4.79652227 9.97907595 -8.65153698 0.42162445 4.21727781 3.59245672 0.00000000 0.00000000 0.00000000 0.57300508 0.00000000 0.00000000 -0.18968779 0.00000000 -3.73078785 0.00000000 2.38400000 52.00000000