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_1CTP2.PDB 16.64320000 -17.28871800 -7.95000000 -12.97500000 -14.35912466 -3.96473329 22.63888888 -17.44665200 1.79105985 7.82557732 8.47709999 0.00000000 0.00000000 0.00000000 1.34118704 1.18618837 0.01662665 -0.23598067 0.00000000 -2.44766712 0.00000000 2.38400000 351.00000000 2_1CTP2.PDB 15.47140000 -22.97131458 -7.98750000 -16.15000000 -14.33203338 -5.85458326 23.42985936 -16.84203384 1.53763776 8.92061046 6.61145854 0.00000000 0.00000000 0.00000000 1.54602084 1.31188413 0.02144589 -0.66952385 0.00000000 -3.20267311 0.00000000 2.38400000 351.00000000 3_1CTP2.PDB 15.13040000 -23.17743574 -7.98750000 -15.08750000 -14.66944949 -6.54044889 23.87113862 -17.59714598 2.75745221 8.01424185 6.94899865 0.00000000 0.00000000 0.00000000 1.40906024 1.31637738 0.01828684 -0.48519579 0.00000000 -3.82937401 0.00000000 2.38400000 351.00000000 4_1CTP2.PDB 16.07370000 -22.01334151 -7.13750000 -16.27500000 -14.47307329 -5.61565973 23.89823759 -17.31453797 2.12655293 8.88764246 6.50308873 0.00000000 0.00000000 0.00000000 1.54703251 1.39461970 0.01561139 -0.90573383 0.00000000 -3.27000229 0.00000000 2.38400000 351.00000000 5_1CTP2.PDB 15.37250000 -18.23719102 -8.58750000 -13.27500000 -13.85962675 -3.96801676 22.41195715 -16.80781318 1.59108954 7.90439160 7.90559775 0.00000000 0.00000000 0.00000000 1.22463644 1.27211807 0.01648632 -0.25492807 0.00000000 -2.53846505 0.00000000 2.38400000 351.00000000 6_1CTP2.PDB 15.12910000 -23.15508042 -7.98750000 -13.01250000 -14.85945947 -6.78924032 23.57325876 -17.86042123 2.02215916 8.17708750 6.67061390 0.00000000 0.00000000 0.00000000 1.62085602 1.38593960 0.01967290 -0.66788139 0.00000000 -4.06172626 0.00000000 2.38400000 351.00000000 7_1CTP2.PDB 16.44060000 -24.22493519 -7.98750000 -15.08750000 -14.62070064 -6.53656729 23.74423046 -17.57146919 1.59842709 8.38413536 6.79403765 0.00000000 0.00000000 0.00000000 1.27886709 1.30416276 0.01909121 -0.42625879 0.00000000 -3.81372814 0.00000000 2.38400000 351.00000000 8_1CTP2.PDB 16.56860000 -19.36309699 -8.58750000 -13.27500000 -14.14693750 -3.78201221 22.27400037 -17.49197860 1.53124255 7.79371058 7.81886005 0.00000000 0.00000000 0.00000000 1.29618607 1.29493796 0.01478112 -0.41008083 0.00000000 -2.39836859 0.00000000 2.38400000 351.00000000 9_1CTP2.PDB 16.82580000 -19.36854209 -8.58750000 -13.61250000 -14.34427216 -4.10087567 23.24062834 -17.32165567 1.71012411 8.27238591 7.35478886 0.00000000 0.00000000 0.00000000 1.41609977 1.26548068 0.02032970 -0.78363129 0.00000000 -2.63246398 0.00000000 2.38400000 351.00000000 10_1CTP2.PDB 15.24360000 -25.51175617 -8.87500000 -15.97500000 -15.04915626 -6.90755561 25.33038954 -18.00523260 1.69287666 8.98951540 6.67972079 0.00000000 0.00000000 0.00000000 1.38169404 1.36202065 0.01828173 -0.57608194 0.00000000 -4.21620792 0.00000000 2.38400000 351.00000000 11_1CTP2.PDB 19.29690000 -17.23696016 -7.73750000 -14.12500000 -14.05136616 -3.02816431 22.48765162 -17.06401892 1.58049077 8.00698169 7.56401256 0.00000000 0.00000000 0.00000000 1.59348380 1.31068225 0.01828280 -0.79859764 0.00000000 -1.68321636 0.00000000 2.38400000 351.00000000 12_1CTP2.PDB 15.43040000 -19.60431222 -8.58750000 -16.07500000 -13.78751433 -3.08374545 22.46784375 -16.84527976 1.65608478 8.46546322 7.27981051 0.00000000 0.00000000 0.00000000 1.17036846 1.27617365 0.01641531 -0.50178640 0.00000000 -1.77947230 0.00000000 2.38400000 351.00000000 13_1CTP2.PDB 16.14590000 -19.65807924 -9.47500000 -16.96250000 -14.03993419 -2.82545439 24.28060947 -17.06362110 1.57060766 8.72857666 7.18366451 0.00000000 0.00000000 0.00000000 1.24895448 1.27041402 0.01991070 -0.62355753 0.00000000 -1.70033550 0.00000000 2.38400000 351.00000000 14_1CTP2.PDB 16.16790000 -24.94191525 -7.98750000 -18.18750000 -14.56813723 -5.46286742 23.91575684 -17.47097826 1.39856450 9.19617052 6.64789754 0.00000000 0.00000000 0.00000000 1.25514934 1.30882566 0.01954952 -0.58218483 0.00000000 -3.11583575 0.00000000 2.38400000 351.00000000 15_1CTP2.PDB 16.94600000 -23.30304295 -7.98750000 -16.45000000 -14.43972223 -5.31383560 23.27805307 -17.56426708 1.93928481 8.64591732 6.60580106 0.00000000 0.00000000 0.00000000 1.33910540 1.30701791 0.01686683 -0.38534525 0.00000000 -2.98740128 0.00000000 2.38400000 351.00000000 16_1CTP2.PDB 17.75400000 -16.84191246 -7.98750000 -12.63750000 -14.41364382 -3.56086014 23.38506654 -18.17730626 1.55783014 7.78173459 8.25615382 0.00000000 0.00000000 0.00000000 1.71105188 1.33750023 0.01491194 -0.32202877 0.00000000 -2.44982238 0.00000000 2.38400000 351.00000000 17_1CTP2.PDB 16.54980000 -17.17015686 -7.73750000 -13.78750000 -14.05555752 -2.81262886 22.16737870 -17.25753476 1.54981399 8.05139506 7.62833262 0.00000000 0.00000000 0.00000000 1.47812202 1.30043823 0.01517582 -0.80324558 0.00000000 -1.60640835 0.00000000 2.38400000 351.00000000 18_1CTP2.PDB 14.75670000 -24.35394783 -7.35000000 -14.11250000 -14.96065448 -6.94907225 23.70858352 -18.52023764 1.81438574 8.11790301 6.51467186 0.00000000 0.00000000 0.00000000 1.97572149 1.34711459 0.02090778 -0.62794721 0.00000000 -3.98570965 0.00000000 2.38400000 351.00000000 19_1CTP2.PDB 17.12550000 -18.95254513 -7.10000000 -15.22500000 -14.48261078 -3.21547486 22.57394443 -18.49671901 1.61545426 8.18631137 7.61375008 0.00000000 0.00000000 0.00000000 1.84466149 1.34275479 0.01541645 -0.51081133 0.00000000 -1.77146723 0.00000000 2.38400000 351.00000000 20_1CTP2.PDB 15.60800000 -19.20281248 -8.58750000 -13.61250000 -14.31265381 -4.19066443 22.49966090 -17.47228609 2.03249936 8.09385228 8.04584980 0.00000000 0.00000000 0.00000000 1.17220869 1.26776761 0.01931692 -0.32954082 0.00000000 -2.56105528 0.00000000 2.38400000 351.00000000 21_1CTP2.PDB 15.05040000 -24.01563962 -7.98750000 -15.08750000 -14.97806456 -6.53224564 24.02470019 -18.01574819 1.62589465 8.49573510 7.40521942 0.00000000 0.00000000 0.00000000 1.44631289 1.45652588 0.01961903 -0.50584399 0.00000000 -3.92621852 0.00000000 2.38400000 351.00000000 22_1CTP2.PDB 17.28320000 -23.79234958 -7.35000000 -17.92500000 -14.50681524 -5.66585788 24.40514823 -17.66087956 1.57316611 9.10586628 6.16485913 0.00000000 0.00000000 0.00000000 1.75210848 1.28287521 0.01905251 -0.47448261 0.00000000 -3.22951503 0.00000000 2.38400000 351.00000000 23_1CTP2.PDB 16.02570000 -18.93619913 -8.83750000 -13.52500000 -14.04930421 -3.67311709 23.16832481 -17.42045052 1.60949713 7.53581036 7.58930243 0.00000000 0.00000000 0.00000000 1.30722411 1.19289013 0.01540896 -0.24403389 0.00000000 -2.41236124 0.00000000 2.38400000 351.00000000 24_1CTP2.PDB 16.55520000 -18.78512094 -8.58750000 -16.07500000 -14.56426055 -3.60885773 23.67163486 -17.60718931 1.93220531 8.93540953 8.90924943 0.00000000 0.00000000 0.00000000 1.22787004 1.27271373 0.01783369 -0.75121204 0.00000000 -2.28530419 0.00000000 2.38400000 351.00000000 25_1CTP2.PDB 15.91250000 -17.97602902 -7.95000000 -13.01250000 -13.68997357 -3.90130121 21.71951289 -16.63620843 1.61456244 7.78605281 7.76238440 0.00000000 0.00000000 0.00000000 1.30141280 1.18369785 0.01606179 -0.44979161 0.00000000 -2.53624132 0.00000000 2.38400000 351.00000000 26_1CTP2.PDB 15.95580000 -19.93905536 -8.58750000 -16.07500000 -14.19660332 -3.27996099 22.96495153 -17.46825892 1.56325795 8.65082148 7.75880380 0.00000000 0.00000000 0.00000000 1.24600284 1.29289753 0.01892218 -0.67799035 0.00000000 -1.85650156 0.00000000 2.38400000 351.00000000 27_1CTP2.PDB 15.55900000 -23.47040537 -7.13750000 -17.30000000 -14.33436023 -5.34138048 22.84747165 -17.45437062 1.55360138 8.99227106 6.71876766 0.00000000 0.00000000 0.00000000 1.24095572 1.32819078 0.01948482 -0.55510399 0.00000000 -2.72024234 0.00000000 2.38400000 351.00000000 28_1CTP2.PDB 15.35470000 -17.77171091 -7.95000000 -12.30000000 -13.97867729 -4.21396696 22.56823033 -16.90098081 1.47539535 7.42597207 7.54814198 0.00000000 0.00000000 0.00000000 1.44488247 1.22409095 0.02190183 -0.35217117 0.00000000 -2.56043870 0.00000000 2.38400000 351.00000000 29_1CTP2.PDB 15.99470000 -18.95255118 -7.73750000 -15.52500000 -13.93249254 -3.25591304 22.22950213 -17.13749040 1.56966403 8.64111418 7.36777918 0.00000000 0.00000000 0.00000000 1.30230185 1.26286099 0.01646294 -0.67725707 0.00000000 -1.81372245 0.00000000 2.38400000 351.00000000 30_1CTP2.PDB 16.10540000 -23.96426716 -9.72500000 -16.10000000 -15.18374203 -5.94063026 24.78334224 -17.89712969 1.55318481 9.96959506 6.81935485 0.00000000 0.00000000 0.00000000 1.42718505 1.35447164 -0.04482805 -0.34973770 0.00000000 -3.27586144 0.00000000 2.38400000 351.00000000