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_1PTT2.PDB	3.43484000	-11.04383267	-7.41250000	-9.95000000	-10.12267428	-2.98367678	19.83942230	-10.66679496	2.28341726	2.21522806	5.66641228	0.00000000	0.00000000	0.00000000	0.77886857	1.54671974	-0.06624578	-0.20985363	0.00000000	-0.41543570	0.00000000	2.38400000	301.00000000
2_1PTT2.PDB	3.01910000	-9.68153465	-6.52500000	-9.10000000	-9.65917925	-3.07064209	19.18035125	-10.10802245	1.81262669	2.33303457	5.49990750	0.00000000	0.00000000	0.00000000	0.63304325	1.38189139	-0.06426958	-0.17157336	0.00000000	-0.44181118	0.00000000	2.38400000	301.00000000
3_1PTT2.PDB	3.33377000	-10.78788063	-7.41250000	-8.25000000	-10.17264304	-2.79516933	19.27390388	-11.32321023	1.89937181	1.95199430	5.76712020	0.00000000	0.00000000	0.00000000	0.95210458	1.56826903	-0.09402891	-0.12179930	0.00000000	-0.46302460	0.00000000	2.38400000	301.00000000
4_1PTT2.PDB	3.36069000	-12.66846506	-7.37500000	-9.95000000	-10.66401784	-3.05877934	20.07841638	-11.91258499	1.96563170	2.09660870	6.01652962	0.00000000	0.00000000	0.00000000	0.67163711	1.78374107	-0.07303758	-0.22264237	0.00000000	-0.24122646	0.00000000	2.38400000	301.00000000
5_1PTT2.PDB	3.41386000	-12.89390618	-8.26250000	-10.50000000	-10.49672773	-2.51501914	19.97829448	-11.71246902	1.91851553	2.18968816	6.22021592	0.00000000	0.00000000	0.00000000	0.69251448	1.70846250	-0.09617902	-0.14531365	0.00000000	-0.16492619	0.00000000	2.38400000	301.00000000
6_1PTT2.PDB	3.13109000	-9.63885045	-7.41250000	-8.10000000	-10.72595134	-2.51045452	19.71672721	-12.58915682	3.81197921	1.84154525	6.22709275	0.00000000	0.00000000	0.00000000	0.51426591	1.77863343	-0.09744220	-0.12695220	0.00000000	-0.18800370	0.00000000	2.38400000	301.00000000
7_1PTT2.PDB	2.90646000	-8.21993583	-5.67500000	-6.85000000	-10.17934407	-2.78664486	19.15614781	-11.30596847	1.87167101	1.93494309	5.77894549	0.00000000	0.00000000	0.00000000	0.56886949	1.65326903	-0.08495168	-0.20822060	0.00000000	-0.44038303	0.00000000	2.38400000	301.00000000
8_1PTT2.PDB	3.12725000	-9.78428697	-4.82500000	-7.32500000	-10.01261531	-2.60704046	18.44654878	-11.65913782	2.19930799	1.07193471	4.75172902	0.00000000	0.00000000	0.00000000	0.62568236	1.51801145	-0.06167835	-0.05401110	0.00000000	-0.33500678	0.00000000	2.38400000	301.00000000
9_1PTT2.PDB	5.69931000	-11.23520566	-5.67500000	-8.17500000	-9.98825605	-2.60146821	18.24191943	-11.59644377	2.50449066	1.16090972	4.74606492	0.00000000	0.00000000	0.00000000	0.57705555	1.44192218	-0.07588751	0.00958679	0.00000000	-0.36317719	0.00000000	2.38400000	301.00000000
10_1PTT2.PDB	3.02458000	-10.80954219	-7.37500000	-8.21250000	-10.18281475	-3.10871068	19.21583251	-10.93927879	1.90302444	1.91389257	5.76350401	0.00000000	0.00000000	0.00000000	0.87865731	1.57733156	-0.07388049	-0.12591950	0.00000000	-0.46634882	0.00000000	2.38400000	301.00000000
11_1PTT2.PDB	2.97667000	-11.45947303	-7.37500000	-9.98750000	-9.35945246	-2.75816898	19.23161802	-9.90502566	1.97653133	2.29534748	4.56337176	0.00000000	0.00000000	0.00000000	0.64967876	1.50134844	-0.09500973	-0.17286102	0.00000000	-0.52300253	0.00000000	2.38400000	301.00000000
12_1PTT2.PDB	2.72519000	-9.14977142	-5.67500000	-8.25000000	-9.27816298	-3.03978511	18.43925959	-9.81385775	1.83253864	2.38334474	4.39647058	0.00000000	0.00000000	0.00000000	0.58772676	1.40621504	-0.07044130	-0.11902409	0.00000000	-0.54284050	0.00000000	2.38400000	301.00000000
13_1PTT2.PDB	5.59593000	-12.66366963	-6.52500000	-6.98750000	-10.31033076	-2.21916611	17.82356612	-12.52455633	2.21009805	0.81540150	4.64939950	0.00000000	0.00000000	0.00000000	0.86482827	1.58663323	-0.09344572	-0.05398978	0.00000000	-0.31297437	0.00000000	2.38400000	301.00000000
14_1PTT2.PDB	3.32260000	-11.72027606	-7.41250000	-8.40000000	-10.72988858	-2.55851204	19.79732565	-12.50298964	1.88020584	1.83956795	6.17390828	0.00000000	0.00000000	0.00000000	0.51229332	1.83039025	-0.08745726	-0.07035797	0.00000000	-0.16187163	0.00000000	2.38400000	301.00000000
15_1PTT2.PDB	3.02569000	-9.58183373	-6.52500000	-9.10000000	-10.04218832	-2.59495649	19.39053643	-11.18882373	1.83278646	2.07984257	5.62232688	0.00000000	0.00000000	0.00000000	1.26139732	1.68464478	-0.06655176	-0.14370442	0.00000000	-0.10749867	0.00000000	2.38400000	301.00000000
16_1PTT2.PDB	2.96369000	-12.57679819	-8.26250000	-10.65000000	-9.54412456	-2.78875240	19.13354460	-10.37074349	1.91433590	2.17653848	5.61165127	0.00000000	0.00000000	0.00000000	0.64082353	1.52583644	-0.08291149	-0.14684626	0.00000000	-0.20781377	0.00000000	2.38400000	301.00000000
17_1PTT2.PDB	3.13303000	-13.03966660	-6.56250000	-8.72500000	-10.47912446	-1.92103676	18.82522693	-12.77588324	2.18361523	0.97646861	5.01650119	0.00000000	0.00000000	0.00000000	0.59891703	1.67634804	-0.09454560	-0.05463126	0.00000000	-0.02767430	0.00000000	2.38400000	301.00000000
18_1PTT2.PDB	3.13239000	-10.58364530	-4.82500000	-7.32500000	-10.44316498	-2.37278736	18.51240601	-12.67835574	2.10162903	1.05354722	5.12917532	0.00000000	0.00000000	0.00000000	0.46155423	1.68623199	-0.06334386	-0.06726068	0.00000000	-0.06704449	0.00000000	2.38400000	301.00000000
19_1PTT2.PDB	3.29967000	-12.18351610	-8.26250000	-10.53750000	-10.68451126	-2.53887908	19.94639858	-12.01456534	1.92184672	3.58835988	6.14546307	0.00000000	0.00000000	0.00000000	0.62696246	1.75736930	-0.09466969	-0.13103055	0.00000000	-0.14889089	0.00000000	2.38400000	301.00000000
20_1PTT2.PDB	2.97538000	-12.04312406	-5.63750000	-6.62500000	-9.16561770	-3.43664249	17.12045055	-10.39115139	1.68521472	1.87654696	3.47260526	0.00000000	0.00000000	0.00000000	0.73766140	1.45819039	-0.08647314	-0.51182641	0.00000000	-1.08139183	0.00000000	2.38400000	301.00000000
21_1PTT2.PDB	3.34879000	-9.77251093	-6.52500000	-8.72500000	-9.17566520	-2.21488349	18.39535916	-9.61254907	2.30853612	0.65696029	5.13501147	0.00000000	0.00000000	0.00000000	0.59429631	1.45707780	-0.09208394	-0.20659738	0.00000000	-0.31089521	0.00000000	2.38400000	301.00000000
22_1PTT2.PDB	2.76398000	-11.08120757	-7.41250000	-8.25000000	-10.32399577	-2.58924202	19.43429744	-11.91344159	2.05160503	1.84338412	5.92504387	0.00000000	0.00000000	0.00000000	0.62439874	1.75475568	-0.09340858	-0.17941871	0.00000000	-0.19793009	0.00000000	2.38400000	301.00000000
23_1PTT2.PDB	3.36721000	-5.19264684	-4.78750000	-5.96250000	-9.01672641	-1.90212104	17.81534034	-9.53576820	1.91873548	0.74223191	5.37611823	0.00000000	0.00000000	0.00000000	0.51971874	1.38114666	-0.09107404	-0.02628485	0.00000000	-0.24281699	0.00000000	2.38400000	301.00000000
24_1PTT2.PDB	3.07652000	-12.44550382	-5.67500000	-6.43750000	-10.67957092	-2.46343828	18.06324103	-13.46659568	2.27218672	0.65624713	5.05161863	0.00000000	0.00000000	0.00000000	0.47961826	1.80019435	-0.06958836	-0.04812035	0.00000000	-0.12860199	0.00000000	2.38400000	301.00000000
25_1PTT2.PDB	3.09822000	-9.96149543	-4.78750000	-5.92500000	-10.01023566	-2.43926986	17.58592982	-12.08244448	2.23507577	0.75454612	4.62877652	0.00000000	0.00000000	0.00000000	0.53869552	1.62980125	-0.07560523	-0.06493719	0.00000000	-0.31952677	0.00000000	2.38400000	301.00000000
26_1PTT2.PDB	3.08037000	-12.00568311	-7.37500000	-9.95000000	-8.85898394	-2.82605891	17.93596120	-9.35801681	1.82733850	2.21483141	4.28044065	0.00000000	0.00000000	0.00000000	0.69217824	0.72661707	-0.08134370	-0.13829691	0.00000000	-0.36873283	0.00000000	2.38400000	301.00000000
27_1PTT2.PDB	2.96066000	-11.25735354	-6.52500000	-9.10000000	-8.91720141	-3.03109384	17.83310728	-9.49602632	1.94727602	2.12025689	3.89692328	0.00000000	0.00000000	0.00000000	0.58775706	0.67700937	-0.06858948	-0.13168875	0.00000000	-0.37307426	0.00000000	2.38400000	301.00000000
28_1PTT2.PDB	5.91986000	-11.69334609	-5.63750000	-8.17500000	-9.92574698	-2.69647905	18.27460464	-11.17567422	1.93164321	0.98410284	4.56871461	0.00000000	0.00000000	0.00000000	0.68992127	1.45820436	-0.06802717	-0.09812471	0.00000000	-0.36578053	0.00000000	2.38400000	301.00000000
29_1PTT2.PDB	3.52334000	-11.72880555	-4.82500000	-7.32500000	-10.07683952	-3.08548421	16.99401770	-12.05122165	2.28227288	1.62219298	4.61124026	0.00000000	0.00000000	0.00000000	0.97260133	1.52706813	-0.06375886	0.02908508	0.00000000	-0.81291153	0.00000000	2.38400000	301.00000000
30_1PTT2.PDB	3.51429000	-9.64280555	-4.78750000	-7.32500000	-9.80832135	-2.63988393	18.10130554	-10.99242709	1.85097649	1.08270816	4.75234781	0.00000000	0.00000000	0.00000000	0.59999483	1.38983281	-0.06327678	-0.06541559	0.00000000	-0.34831365	0.00000000	2.38400000	301.00000000