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_1TH12.PDB	3.39348000	-31.42470653	-2.60000000	-17.17500000	-13.54810766	-11.41120607	23.53486382	-15.56667194	1.20843772	9.82287463	4.12013551	0.00000000	0.00000000	0.00000000	0.57519034	0.52015980	0.15613100	-2.51948866	0.00000000	-8.02186522	0.00000000	2.38400000	534.00000000
2_1TH12.PDB	3.00625000	-33.92092866	-2.60000000	-17.17500000	-13.32273797	-11.07632343	23.34937490	-15.35891992	1.49800918	9.33346675	0.69564997	0.00000000	0.00000000	0.00000000	0.59605987	0.54506974	0.13491417	-2.23497064	0.00000000	-7.76045154	0.00000000	2.38400000	534.00000000
3_1TH12.PDB	3.57802000	-33.35835434	-2.60000000	-17.88750000	-13.33885114	-11.24003196	23.02679018	-15.43013989	1.17429774	9.44463104	2.74831601	0.00000000	0.00000000	0.00000000	0.56853241	0.51657164	0.15069497	-2.11824164	0.00000000	-7.85685207	0.00000000	2.38400000	534.00000000
4_1TH12.PDB	2.83780000	-30.74555952	-2.60000000	-17.58750000	-13.63235250	-11.75031352	23.69639747	-15.74113447	1.91333948	9.93149622	4.25861017	0.00000000	0.00000000	0.00000000	0.74212062	0.54723103	0.14872009	-2.08974972	0.00000000	-8.03519337	0.00000000	2.38400000	534.00000000
5_1TH12.PDB	2.64967000	-32.92553824	-2.60000000	-16.15000000	-13.30865424	-11.40376618	22.62320085	-15.37798323	1.74657060	9.41431159	0.84931289	0.00000000	0.00000000	0.00000000	0.58152836	0.50045516	0.15728130	-1.77136337	0.00000000	-7.68597681	0.00000000	2.38400000	534.00000000
6_1TH12.PDB	2.63764000	-32.70300398	-2.60000000	-17.55000000	-13.35448747	-11.13096667	23.30455935	-15.33727911	1.52508401	9.49846799	2.26954725	0.00000000	0.00000000	0.00000000	0.57799874	0.54882493	0.15648790	-2.19889255	0.00000000	-7.86352342	0.00000000	2.38400000	534.00000000
7_1TH12.PDB	2.47836000	-32.76702382	-2.41250000	-17.32500000	-13.19879138	-10.71585534	22.60466322	-15.28502390	0.95852365	9.15722026	2.49410707	0.00000000	0.00000000	0.00000000	0.52695992	0.52142124	0.15137714	-2.09129098	0.00000000	-7.63141349	0.00000000	2.38400000	534.00000000
8_1TH12.PDB	2.35427000	-31.09525243	-2.60000000	-15.77500000	-13.34462611	-11.10508744	22.70801193	-15.42072288	1.55349483	9.46268441	2.85531852	0.00000000	0.00000000	0.00000000	0.52580063	0.56090676	0.15030013	-2.28280802	0.00000000	-7.82261843	0.00000000	2.38400000	534.00000000
9_1TH12.PDB	3.02760000	-31.78355278	-2.60000000	-14.45000000	-13.33749410	-11.23321223	22.21434927	-15.45611739	1.57269214	9.36169924	0.91143633	0.00000000	0.00000000	0.00000000	0.62057954	0.55070995	0.15705645	-1.87533706	0.00000000	-7.66920497	0.00000000	2.38400000	534.00000000
10_1TH12.PDB	4.20800000	-32.05607115	-2.60000000	-17.51250000	-13.54752940	-11.49353591	23.48171275	-15.61726020	2.71896554	9.58093281	2.35420883	0.00000000	0.00000000	0.00000000	0.55641411	0.51887702	0.16073097	-2.14378056	0.00000000	-7.99443008	0.00000000	2.38400000	534.00000000
11_1TH12.PDB	2.35185000	-30.58016399	-2.60000000	-17.92500000	-13.68630554	-11.17098440	24.01243110	-15.49757072	1.47313993	9.71982005	4.93374898	0.00000000	0.00000000	0.00000000	0.52355725	0.51879839	0.12555116	-2.99552853	0.00000000	-7.49302326	0.00000000	2.38400000	534.00000000
12_1TH12.PDB	4.85209000	-32.10193412	-2.60000000	-20.00000000	-14.09162439	-11.87022565	25.42568182	-15.99471726	1.53570173	9.71580605	5.40722359	0.00000000	0.00000000	0.00000000	0.54416526	0.48480522	0.14456575	-2.59657679	0.00000000	-7.72193423	0.00000000	2.38400000	534.00000000
13_1TH12.PDB	2.32059000	-28.55193243	-2.60000000	-17.55000000	-12.27967861	-11.22990663	23.03373643	-13.46269307	0.78843425	9.50100514	4.87636458	0.00000000	0.00000000	0.00000000	0.55500864	0.45831517	0.14050593	-2.43844710	0.00000000	-7.88626199	0.00000000	2.38400000	534.00000000
14_1TH12.PDB	3.36923000	-35.68990816	-2.60000000	-17.55000000	-13.29118609	-11.26779703	22.88319907	-15.45286195	1.30901720	9.26382802	0.47168144	0.00000000	0.00000000	0.00000000	0.58896490	0.58661918	0.14945966	-2.38586085	0.00000000	-7.80835253	0.00000000	2.38400000	534.00000000
15_1TH12.PDB	2.54446000	-29.51598608	-2.60000000	-17.92500000	-13.83635756	-11.08848326	24.28471025	-15.42665453	1.88818537	9.42787699	4.81476325	0.00000000	0.00000000	0.00000000	0.66630935	0.58822237	0.12317659	-2.41437659	0.00000000	-7.43013595	0.00000000	2.38400000	534.00000000
16_1TH12.PDB	2.36922000	-32.44886588	-2.60000000	-17.51250000	-13.28253397	-11.01504600	23.04383473	-15.41764281	1.66039153	9.46917447	2.73090810	0.00000000	0.00000000	0.00000000	0.51737476	0.54134469	0.14387691	-2.40605853	0.00000000	-7.78064507	0.00000000	2.38400000	534.00000000
17_1TH12.PDB	2.87864000	-31.07762085	-2.41250000	-19.47500000	-13.67635060	-11.35915895	24.95411950	-15.48920595	1.60456012	9.30316468	4.75960852	0.00000000	0.00000000	0.00000000	0.64313291	0.58394787	0.12566092	-2.47000790	0.00000000	-7.58564410	0.00000000	2.38400000	534.00000000
18_1TH12.PDB	4.31033000	-29.72397285	-2.60000000	-17.51250000	-12.60057036	-11.05121736	23.22616328	-14.24889249	0.77296542	9.35049305	3.21642281	0.00000000	0.00000000	0.00000000	0.47561145	0.46166956	0.15237066	-1.22913335	0.00000000	-7.67568595	0.00000000	2.38400000	534.00000000
19_1TH12.PDB	1.97958000	-28.25641287	-2.60000000	-14.07500000	-12.29405033	-11.02514031	21.82369122	-13.68958995	1.17311832	9.14555452	2.74337043	0.00000000	0.00000000	0.00000000	0.43256360	0.50561716	0.14556066	-2.34407771	0.00000000	-7.69241332	0.00000000	2.38400000	534.00000000
20_1TH12.PDB	2.77496000	-32.06696746	-2.41250000	-17.70000000	-13.11331663	-10.44950123	22.73573303	-15.07550950	1.40041351	9.05669421	2.67053988	0.00000000	0.00000000	0.00000000	0.54286192	0.54533199	0.13613074	-2.44128978	0.00000000	-7.41722361	0.00000000	2.38400000	534.00000000
21_1TH12.PDB	2.84722000	-32.55770939	-2.60000000	-17.51250000	-13.26582869	-11.38069837	23.05639421	-15.37662250	1.62274402	9.43717852	2.67604692	0.00000000	0.00000000	0.00000000	0.52579913	0.48622696	0.14888368	-2.02558868	0.00000000	-7.86351762	0.00000000	2.38400000	534.00000000
22_1TH12.PDB	2.12350000	-28.34448534	-2.41250000	-17.32500000	-12.30097898	-10.92258060	22.67728084	-13.57089234	0.97679037	9.20512402	4.64954093	0.00000000	0.00000000	0.00000000	0.65816387	0.54992768	0.15581012	-2.38701539	0.00000000	-7.74822818	0.00000000	2.38400000	534.00000000
23_1TH12.PDB	3.95805000	-30.53714991	-2.60000000	-17.51250000	-13.46482480	-11.53429467	23.64473202	-15.40652636	1.69175103	9.82532743	4.47231336	0.00000000	0.00000000	0.00000000	0.54684737	0.50579645	0.14384186	-2.25751021	0.00000000	-8.08630694	0.00000000	2.38400000	534.00000000
24_1TH12.PDB	2.46876000	-31.31437120	-2.60000000	-17.55000000	-13.26061990	-11.07747985	23.12336133	-15.35551249	2.20897569	9.57277098	2.80410838	0.00000000	0.00000000	0.00000000	0.63284939	0.47659686	0.13925858	-2.21171723	0.00000000	-7.74036607	0.00000000	2.38400000	534.00000000
25_1TH12.PDB	3.09252000	-32.76668254	-2.60000000	-17.88750000	-13.48779070	-11.11704283	23.29162971	-15.65323878	1.43429814	9.50019829	2.79623734	0.00000000	0.00000000	0.00000000	0.49526819	0.55243482	0.13498478	-1.99844308	0.00000000	-7.67528359	0.00000000	2.38400000	534.00000000
26_1TH12.PDB	2.88241000	-34.79734499	-2.60000000	-17.51250000	-13.31655241	-11.43458216	23.22362939	-15.36889226	1.49777194	9.32193692	0.63839348	0.00000000	0.00000000	0.00000000	0.59868988	0.54813898	0.13464022	-2.25025350	0.00000000	-7.72962649	0.00000000	2.38400000	534.00000000
27_1TH12.PDB	2.43432000	-32.10840322	-2.41250000	-17.70000000	-12.99824772	-10.52582432	22.55201273	-15.02117537	1.56460402	8.98711867	2.41806022	0.00000000	0.00000000	0.00000000	0.52866545	0.58473141	0.14177924	-2.13864037	0.00000000	-7.50425578	0.00000000	2.38400000	534.00000000
28_1TH12.PDB	2.82479000	-28.46302396	-2.60000000	-17.51250000	-12.98539007	-11.45693156	23.05341788	-14.63178456	2.86506002	9.66611780	4.73139277	0.00000000	0.00000000	0.00000000	0.50490056	0.55380957	0.15111991	-2.17494479	0.00000000	-8.07348193	0.00000000	2.38400000	534.00000000
29_1TH12.PDB	2.12251000	-29.96527574	-2.41250000	-16.30000000	-13.81076871	-12.21463838	22.66853879	-15.98468324	2.70609699	10.89526166	2.72811774	0.00000000	0.00000000	0.00000000	0.41197300	0.53640470	0.09636480	-0.92781202	0.00000000	-7.82122637	0.00000000	2.38400000	534.00000000
30_1TH12.PDB	2.40881000	-32.19120453	-2.41250000	-17.36250000	-13.27605894	-10.51285169	22.88164836	-15.28062184	1.03135180	9.19784908	2.51784403	0.00000000	0.00000000	0.00000000	0.57854650	0.60326187	0.15302480	-2.17447522	0.00000000	-7.53246142	0.00000000	2.38400000	534.00000000