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_1ZX6-23_1.PDB 0.93410 -4.24000 -0.22000 -0.19000 -3.84000 -0.48000 3.07000 -5.33000 0.17000 1.98000 1.15000 0.00000 0.00000 0.00000 0.01000 0.82000 0.00000 -0.12000 0.00000 -0.46000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_2.PDB 0.77513 -4.74000 -1.13000 -1.10000 -4.25000 -0.61000 3.93000 -5.59000 0.31000 3.11000 1.62000 0.00000 0.00000 0.00000 0.01000 0.80000 0.00000 -0.38000 0.00000 -0.65000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_3.PDB 0.78643 -4.60000 -0.26000 -0.24000 -4.06000 -0.52000 3.20000 -5.54000 0.25000 2.08000 1.32000 0.00000 0.00000 0.00000 0.01000 0.84000 0.00000 -0.32000 0.00000 -0.51000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_4.PDB 0.78762 -4.51000 -0.43000 -0.41000 -4.28000 -0.56000 3.35000 -5.65000 0.33000 2.36000 1.57000 0.00000 0.00000 0.00000 0.02000 0.87000 0.00000 -0.28000 0.00000 -0.53000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_5.PDB 0.68624 -4.50000 -0.21000 -0.19000 -3.95000 -0.45000 3.12000 -5.48000 0.17000 2.07000 1.15000 0.00000 0.00000 0.00000 0.02000 0.83000 0.00000 -0.33000 0.00000 -0.40000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_6.PDB 0.77682 -3.23000 -0.22000 -0.19000 -3.70000 -0.16000 2.97000 -5.22000 0.78000 1.71000 1.13000 0.00000 0.00000 0.00000 0.01000 0.82000 0.00000 -0.16000 0.00000 -0.18000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_7.PDB 0.64992 -4.25000 -0.22000 -0.19000 -3.84000 -0.37000 3.03000 -5.28000 0.18000 2.00000 1.08000 0.00000 0.00000 0.00000 0.01000 0.75000 0.00000 -0.31000 0.00000 -0.34000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_8.PDB 0.81540 -3.24000 -0.39000 -0.37000 -3.76000 -0.12000 2.97000 -5.35000 0.91000 1.78000 1.38000 0.00000 0.00000 0.00000 0.01000 0.75000 0.00000 -0.15000 0.00000 -0.15000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_9.PDB 0.73145 -4.22000 -0.21000 -0.19000 -3.91000 -0.34000 3.02000 -5.36000 0.16000 1.97000 1.16000 0.00000 0.00000 0.00000 0.00000 0.86000 0.00000 -0.18000 0.00000 -0.33000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_10.PDB 0.85289 -3.26000 -0.35000 -0.34000 -3.88000 -0.16000 3.06000 -5.35000 1.03000 1.74000 1.45000 0.00000 0.00000 0.00000 0.00000 0.80000 0.00000 -0.27000 0.00000 -0.19000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_11.PDB 0.83427 -4.35000 -0.37000 -0.33000 -4.06000 -0.37000 3.08000 -5.40000 0.16000 2.16000 1.28000 0.00000 0.00000 0.00000 0.01000 0.87000 0.00000 -0.16000 0.00000 -0.35000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_12.PDB 0.80578 -3.74000 -0.27000 -0.23000 -3.97000 -0.14000 3.05000 -5.38000 0.55000 1.79000 1.15000 0.00000 0.00000 0.00000 0.01000 1.00000 0.00000 -0.15000 0.00000 -0.14000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_13.PDB 0.84575 -4.65000 -0.25000 -0.23000 -4.13000 -0.14000 2.93000 -5.97000 0.19000 1.94000 1.31000 0.00000 0.00000 0.00000 0.01000 0.84000 0.00000 -0.17000 0.00000 -0.14000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_14.PDB 0.93433 -4.15000 -0.22000 -0.19000 -3.48000 -0.62000 3.09000 -4.74000 0.15000 1.75000 0.98000 0.00000 0.00000 0.00000 0.01000 0.72000 0.00000 -0.29000 0.00000 -0.59000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_15.PDB 0.68995 -4.52000 -0.36000 -0.34000 -3.89000 -0.16000 2.78000 -5.63000 0.29000 1.85000 1.35000 0.00000 0.00000 0.00000 0.01000 0.76000 0.00000 -0.20000 0.00000 -0.22000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_16.PDB 0.46800 -2.60000 -0.21000 -0.19000 -3.86000 -0.02000 2.86000 -5.55000 1.68000 1.76000 1.13000 0.00000 0.00000 0.00000 0.01000 0.78000 0.00000 -0.18000 0.00000 -0.02000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_17.PDB 0.82611 -4.86000 -0.24000 -0.19000 -4.47000 -0.16000 3.09000 -6.18000 0.16000 2.17000 1.33000 0.00000 0.00000 0.00000 0.01000 0.96000 0.00000 -0.17000 0.00000 -0.19000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_18.PDB 1.12638 -4.97000 -0.21000 -0.19000 -4.28000 -0.91000 3.44000 -5.59000 0.38000 2.46000 1.27000 0.00000 0.00000 0.00000 0.02000 0.95000 0.00000 -0.43000 0.00000 -0.92000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_19.PDB 0.72450 -4.80000 -0.24000 -0.19000 -4.42000 -0.13000 2.94000 -6.08000 0.21000 2.16000 1.26000 0.00000 0.00000 0.00000 0.01000 0.97000 0.00000 -0.16000 0.00000 -0.17000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_20.PDB 1.26991 -2.86000 -0.28000 -0.26000 -3.69000 0.00000 2.90000 -5.17000 0.90000 1.70000 1.17000 0.00000 0.00000 0.00000 0.01000 0.67000 0.00000 -0.14000 0.00000 0.01000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_21.PDB 0.63992 -4.50000 -0.25000 -0.23000 -3.94000 -0.49000 3.12000 -5.46000 0.21000 2.04000 1.24000 0.00000 0.00000 0.00000 0.01000 0.78000 0.00000 -0.31000 0.00000 -0.45000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_22.PDB 0.60059 -3.45000 -0.22000 -0.19000 -4.11000 -0.02000 3.09000 -5.65000 0.78000 1.91000 1.15000 0.00000 0.00000 0.00000 0.01000 0.98000 0.00000 -0.18000 0.00000 -0.02000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_23.PDB 0.45537 -2.08000 -0.25000 -0.23000 -3.82000 -0.00000 2.99000 -5.26000 1.75000 1.77000 1.16000 0.00000 0.00000 0.00000 0.01000 0.82000 0.00000 -0.17000 0.00000 -0.02000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_24.PDB 0.74773 -4.29000 -0.26000 -0.24000 -3.80000 -0.39000 2.97000 -5.26000 0.19000 1.98000 1.15000 0.00000 0.00000 0.00000 0.01000 0.76000 0.00000 -0.28000 0.00000 -0.38000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_25.PDB 0.64312 -4.50000 -1.01000 -0.99000 -4.45000 -0.05000 3.76000 -6.14000 0.16000 2.91000 1.57000 0.00000 0.00000 0.00000 0.01000 0.88000 0.00000 -0.22000 0.00000 -0.05000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_26.PDB 0.71418 -3.81000 -0.25000 -0.23000 -3.40000 -0.41000 2.87000 -4.67000 0.30000 1.63000 0.99000 0.00000 0.00000 0.00000 0.01000 0.75000 0.00000 -0.28000 0.00000 -0.38000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_27.PDB 0.70396 -4.45000 -0.21000 -0.19000 -4.21000 -0.39000 3.08000 -5.70000 0.14000 2.23000 1.30000 0.00000 0.00000 0.00000 0.02000 0.88000 0.00000 -0.13000 0.00000 -0.37000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_28.PDB 0.49778 -4.14000 -0.22000 -0.19000 -3.81000 -0.01000 2.73000 -5.51000 0.17000 1.79000 1.08000 0.00000 0.00000 0.00000 0.01000 0.74000 0.00000 -0.16000 0.00000 -0.01000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_29.PDB 0.81603 -2.95000 -0.22000 -0.19000 -3.25000 -0.14000 2.84000 -4.56000 0.54000 1.35000 0.97000 0.00000 0.00000 0.00000 0.01000 0.74000 0.00000 -0.13000 0.00000 -0.16000 0.00000 2.38000 63.00000 PIN3_1ZX6-23_30.PDB 0.80676 -4.52000 -0.22000 -0.19000 -4.11000 -0.45000 3.07000 -5.51000 0.18000 2.22000 1.18000 0.00000 0.00000 0.00000 0.01000 0.89000 0.00000 -0.30000 0.00000 -0.41000 0.00000 2.38000 63.00000