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 
PIN3_1CKB-8_1.PDB	3.56097	-7.94000	-0.72000	-0.56000	-9.38000	-0.03000	6.42000	-13.64000	2.30000	4.61000	2.97000	0.00000	0.00000	0.00000	0.29000	0.44000	0.00000	-0.19000	0.00000	-0.02000	0.00000	2.38000	63.00000
PIN3_1CKB-8_2.PDB	2.90098	-8.57000	-0.64000	-0.58000	-9.15000	0.07000	6.26000	-13.29000	1.10000	4.29000	2.96000	0.00000	0.00000	0.00000	0.32000	0.41000	0.00000	-0.10000	0.00000	0.18000	0.00000	2.38000	63.00000
PIN3_1CKB-8_3.PDB	4.23239	-8.00000	-0.60000	-0.58000	-9.04000	0.03000	6.12000	-13.20000	1.65000	4.19000	2.97000	0.00000	0.00000	0.00000	0.44000	0.40000	0.00000	-0.10000	0.00000	0.12000	0.00000	2.38000	63.00000
PIN3_1CKB-8_4.PDB	3.75404	-8.94000	-1.01000	-0.87000	-9.56000	0.01000	6.41000	-13.81000	1.61000	4.56000	3.65000	0.00000	0.00000	0.00000	0.28000	0.38000	0.00000	-0.26000	0.00000	0.05000	0.00000	2.38000	63.00000
PIN3_1CKB-8_5.PDB	3.63281	-8.56000	-0.72000	-0.55000	-9.70000	0.10000	6.60000	-13.96000	2.44000	4.69000	2.09000	0.00000	0.00000	0.00000	0.39000	0.38000	0.00000	-0.13000	0.00000	0.17000	0.00000	2.38000	63.00000
PIN3_1CKB-8_6.PDB	3.02500	-9.25000	-0.67000	-0.56000	-9.65000	0.16000	6.42000	-13.87000	1.77000	4.63000	2.07000	0.00000	0.00000	0.00000	0.30000	0.39000	0.00000	-0.10000	0.00000	0.26000	0.00000	2.38000	63.00000
PIN3_1CKB-8_7.PDB	3.72790	-8.97000	-0.68000	-0.58000	-9.57000	-0.09000	6.52000	-13.82000	1.28000	4.66000	3.20000	0.00000	0.00000	0.00000	0.30000	0.37000	0.00000	-0.14000	0.00000	-0.07000	0.00000	2.38000	63.00000
PIN3_1CKB-8_8.PDB	3.94039	-8.78000	-0.73000	-0.58000	-9.60000	0.07000	6.27000	-13.87000	1.65000	4.48000	3.20000	0.00000	0.00000	0.00000	0.28000	0.38000	0.00000	-0.14000	0.00000	0.18000	0.00000	2.38000	63.00000
PIN3_1CKB-8_9.PDB	3.68128	-8.60000	-0.72000	-0.58000	-9.37000	0.02000	6.33000	-13.55000	1.38000	4.44000	3.15000	0.00000	0.00000	0.00000	0.34000	0.37000	0.00000	-0.13000	0.00000	0.10000	0.00000	2.38000	63.00000
PIN3_1CKB-8_10.PDB	3.99228	-8.22000	-0.70000	-0.56000	-9.28000	-0.05000	5.69000	-13.83000	3.01000	4.53000	2.79000	0.00000	0.00000	0.00000	0.34000	0.50000	0.00000	-0.16000	0.00000	-0.01000	0.00000	2.38000	63.00000
PIN3_1CKB-8_11.PDB	4.09569	-9.36000	-0.90000	-0.86000	-9.04000	-0.07000	5.98000	-13.21000	1.11000	4.36000	3.14000	0.00000	0.00000	0.00000	0.37000	0.42000	0.00000	-0.17000	0.00000	-0.05000	0.00000	2.38000	63.00000
PIN3_1CKB-8_12.PDB	2.59430	-9.40000	-0.70000	-0.58000	-9.19000	0.07000	5.28000	-13.67000	1.91000	4.34000	2.79000	0.00000	0.00000	0.00000	0.33000	0.50000	0.00000	-0.15000	0.00000	0.17000	0.00000	2.38000	63.00000
PIN3_1CKB-8_13.PDB	3.05703	-9.08000	-0.65000	-0.58000	-9.08000	0.04000	5.55000	-13.45000	1.34000	4.34000	2.74000	0.00000	0.00000	0.00000	0.62000	0.53000	0.00000	-0.08000	0.00000	0.13000	0.00000	2.38000	63.00000
PIN3_1CKB-8_14.PDB	4.65573	-8.00000	-0.98000	-0.87000	-9.01000	0.12000	6.04000	-13.10000	2.09000	4.33000	3.00000	0.00000	0.00000	0.00000	0.30000	0.44000	0.00000	-0.10000	0.00000	0.19000	0.00000	2.38000	63.00000
PIN3_1CKB-8_15.PDB	3.56916	-9.48000	-1.02000	-0.87000	-9.55000	0.03000	6.26000	-13.93000	1.36000	4.58000	3.20000	0.00000	0.00000	0.00000	0.43000	0.43000	0.00000	-0.09000	0.00000	0.12000	0.00000	2.38000	63.00000
PIN3_1CKB-8_16.PDB	2.50673	-10.84000	-0.68000	-0.58000	-9.75000	0.05000	6.13000	-14.29000	1.30000	4.81000	1.88000	0.00000	0.00000	0.00000	0.32000	0.50000	0.00000	-0.12000	0.00000	0.09000	0.00000	2.38000	63.00000
PIN3_1CKB-8_17.PDB	4.23871	-9.80000	-0.91000	-0.87000	-9.14000	-0.00000	6.14000	-13.30000	1.36000	4.55000	2.10000	0.00000	0.00000	0.00000	0.39000	0.38000	0.00000	-0.13000	0.00000	0.02000	0.00000	2.38000	63.00000
PIN3_1CKB-8_18.PDB	3.94424	-8.96000	-0.62000	-0.58000	-9.39000	0.12000	5.82000	-13.80000	1.50000	4.43000	2.86000	0.00000	0.00000	0.00000	0.63000	0.55000	0.00000	-0.16000	0.00000	0.22000	0.00000	2.38000	63.00000
PIN3_1CKB-8_19.PDB	3.58855	-9.76000	-0.70000	-0.56000	-9.55000	0.18000	5.65000	-14.01000	1.32000	4.49000	2.93000	0.00000	0.00000	0.00000	0.28000	0.43000	0.00000	-0.13000	0.00000	0.32000	0.00000	2.38000	63.00000
PIN3_1CKB-8_20.PDB	2.56641	-9.63000	-0.69000	-0.56000	-9.42000	0.16000	6.07000	-13.64000	1.73000	4.56000	1.80000	0.00000	0.00000	0.00000	0.28000	0.43000	0.00000	-0.18000	0.00000	0.26000	0.00000	2.38000	63.00000
PIN3_1CKB-8_21.PDB	4.22724	-9.54000	-1.04000	-0.89000	-9.54000	0.12000	6.29000	-13.89000	2.01000	4.67000	2.08000	0.00000	0.00000	0.00000	0.61000	0.42000	0.00000	-0.14000	0.00000	0.19000	0.00000	2.38000	63.00000
PIN3_1CKB-8_22.PDB	3.50346	-9.10000	-1.60000	-1.80000	-9.70000	-0.75000	8.49000	-13.10000	1.24000	5.76000	3.15000	0.00000	0.00000	0.00000	0.19000	0.42000	0.00000	-0.47000	0.00000	-0.53000	0.00000	2.38000	63.00000
PIN3_1CKB-8_23.PDB	3.90239	-7.41000	-1.54000	-1.42000	-9.45000	-0.49000	7.69000	-12.91000	2.66000	5.28000	3.03000	0.00000	0.00000	0.00000	0.23000	0.42000	0.00000	-0.20000	0.00000	-0.30000	0.00000	2.38000	63.00000
PIN3_1CKB-8_24.PDB	3.49059	-7.63000	-0.69000	-1.41000	-9.51000	-0.57000	7.99000	-12.87000	1.28000	5.30000	3.36000	0.00000	0.00000	0.00000	0.36000	0.46000	0.00000	-0.45000	0.00000	-0.42000	0.00000	2.38000	63.00000
PIN3_1CKB-8_25.PDB	4.05374	-7.00000	-0.63000	-0.57000	-8.82000	-0.22000	6.75000	-12.64000	2.04000	4.16000	3.14000	0.00000	0.00000	0.00000	0.21000	0.39000	0.00000	-0.23000	0.00000	-0.18000	0.00000	2.38000	63.00000
PIN3_1CKB-8_26.PDB	3.77531	-7.03000	-0.72000	-0.58000	-9.20000	-0.08000	6.31000	-13.38000	2.90000	4.46000	3.00000	0.00000	0.00000	0.00000	0.39000	0.41000	0.00000	-0.07000	0.00000	-0.05000	0.00000	2.38000	63.00000
PIN3_1CKB-8_27.PDB	5.72493	-9.07000	-1.68000	-1.58000	-9.57000	-0.55000	8.45000	-12.75000	1.40000	5.85000	1.75000	0.00000	0.00000	0.00000	0.20000	0.39000	0.00000	-0.19000	0.00000	-0.39000	0.00000	2.38000	63.00000
PIN3_1CKB-8_28.PDB	3.64326	-8.52000	-0.67000	-0.57000	-9.08000	-0.10000	6.55000	-13.18000	1.10000	4.41000	2.95000	0.00000	0.00000	0.00000	0.25000	0.40000	0.00000	-0.13000	0.00000	-0.06000	0.00000	2.38000	63.00000
PIN3_1CKB-8_29.PDB	4.26639	-6.76000	-1.57000	-1.72000	-9.37000	-0.52000	8.61000	-13.25000	2.62000	5.54000	3.00000	0.00000	0.00000	0.00000	0.49000	0.41000	0.00000	-0.31000	0.00000	-0.28000	0.00000	2.38000	63.00000
PIN3_1CKB-8_30.PDB	4.12615	-7.81000	-0.70000	-0.57000	-9.32000	0.04000	6.29000	-13.64000	2.21000	4.41000	3.03000	0.00000	0.00000	0.00000	0.41000	0.42000	0.00000	-0.09000	0.00000	0.12000	0.00000	2.38000	63.00000