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_1YNZ-21_1.PDB 5.19837 -8.29000 -0.49000 -1.85000 -4.75000 -0.32000 2.44000 -6.94000 0.21000 3.72000 0.43000 0.00000 0.00000 0.00000 0.15000 0.19000 0.00000 -0.53000 0.00000 -0.36000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_2.PDB 6.51613 -6.82000 -0.42000 -0.45000 -4.73000 -0.10000 2.29000 -7.14000 0.78000 2.88000 0.46000 0.00000 0.00000 0.00000 0.28000 0.13000 0.00000 -0.55000 0.00000 -0.13000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_3.PDB 3.38533 -7.33000 -0.52000 -0.49000 -4.39000 -0.21000 2.20000 -6.44000 0.19000 2.71000 0.33000 0.00000 0.00000 0.00000 0.13000 0.17000 0.00000 -0.61000 0.00000 -0.23000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_4.PDB 6.03471 -8.29000 -0.51000 -1.24000 -5.30000 -1.26000 3.71000 -7.39000 0.27000 4.48000 0.52000 0.00000 0.00000 0.00000 0.25000 0.12000 0.00000 -0.69000 0.00000 -1.12000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_5.PDB 4.75071 -7.11000 -0.49000 -0.47000 -4.38000 -0.26000 2.29000 -6.30000 0.21000 2.71000 0.39000 0.00000 0.00000 0.00000 0.12000 0.18000 0.00000 -0.59000 0.00000 -0.33000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_6.PDB 4.23995 -5.72000 -0.47000 -0.44000 -3.87000 -0.36000 2.52000 -5.33000 0.28000 2.44000 0.36000 0.00000 0.00000 0.00000 0.08000 0.17000 0.00000 -0.52000 0.00000 -0.40000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_7.PDB 4.45251 -7.06000 -0.46000 -0.46000 -4.58000 0.03000 2.19000 -7.12000 0.34000 2.67000 0.83000 0.00000 0.00000 0.00000 0.21000 0.16000 0.00000 -0.69000 0.00000 -0.02000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_8.PDB 5.71961 -7.08000 -0.44000 -0.46000 -4.53000 -0.15000 2.39000 -6.74000 0.39000 2.68000 0.56000 0.00000 0.00000 0.00000 0.11000 0.18000 0.00000 -0.62000 0.00000 -0.25000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_9.PDB 3.52586 -10.10000 -0.49000 -2.72000 -5.17000 -1.26000 3.69000 -7.06000 0.21000 4.08000 0.35000 0.00000 0.00000 0.00000 0.14000 0.19000 0.00000 -0.85000 0.00000 -1.04000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_10.PDB 6.17743 -7.72000 -0.46000 -0.48000 -4.98000 -0.07000 2.54000 -7.54000 0.44000 2.93000 0.54000 0.00000 0.00000 0.00000 0.14000 0.18000 0.00000 -0.68000 0.00000 -0.10000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_11.PDB 5.77425 -6.01000 -0.44000 -0.46000 -4.17000 -0.10000 2.50000 -6.16000 0.37000 2.42000 0.32000 0.00000 0.00000 0.00000 0.22000 0.24000 0.00000 -0.38000 0.00000 -0.11000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_12.PDB 3.73466 -7.67000 -0.52000 -1.20000 -5.27000 -0.96000 3.71000 -7.28000 0.27000 4.51000 0.48000 0.00000 0.00000 0.00000 0.23000 0.18000 0.00000 -0.93000 0.00000 -0.71000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_13.PDB 3.38675 -5.68000 -0.48000 -0.47000 -4.06000 -0.31000 2.68000 -5.60000 0.27000 2.58000 0.46000 0.00000 0.00000 0.00000 0.15000 0.17000 0.00000 -0.51000 0.00000 -0.39000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_14.PDB 4.21787 -6.05000 -0.47000 -0.45000 -3.90000 -0.47000 2.55000 -5.38000 0.23000 2.52000 0.38000 0.00000 0.00000 0.00000 0.09000 0.18000 0.00000 -0.54000 0.00000 -0.61000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_15.PDB 4.83705 -7.02000 -0.43000 -0.47000 -4.63000 -0.06000 2.31000 -6.96000 0.45000 2.85000 0.42000 0.00000 0.00000 0.00000 0.16000 0.17000 0.00000 -0.54000 0.00000 -0.13000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_16.PDB 4.55416 -6.93000 -0.44000 -0.45000 -4.58000 0.05000 2.16000 -6.96000 0.45000 2.73000 0.39000 0.00000 0.00000 0.00000 0.19000 0.15000 0.00000 -0.55000 0.00000 0.07000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_17.PDB 5.37255 -7.41000 -0.49000 -2.34000 -4.60000 -1.10000 4.03000 -5.74000 0.44000 3.78000 0.30000 0.00000 0.00000 0.00000 0.16000 0.23000 0.00000 -0.80000 0.00000 -1.05000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_18.PDB 4.04378 -5.53000 -0.44000 -0.42000 -3.70000 -0.05000 2.19000 -5.51000 0.28000 2.13000 0.36000 0.00000 0.00000 0.00000 0.10000 0.14000 0.00000 -0.37000 0.00000 -0.09000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_19.PDB 5.20689 -6.16000 -0.44000 -0.45000 -4.43000 -0.14000 2.79000 -6.41000 0.36000 2.60000 0.37000 0.00000 0.00000 0.00000 0.24000 0.25000 0.00000 -0.41000 0.00000 -0.23000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_20.PDB 4.06231 -7.33000 -1.27000 -3.50000 -4.80000 -1.03000 4.49000 -6.27000 0.34000 5.59000 0.75000 0.00000 0.00000 0.00000 0.14000 0.29000 0.00000 -0.76000 0.00000 -1.02000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_21.PDB 5.19364 -5.66000 -0.46000 -0.46000 -4.01000 -0.13000 2.52000 -5.85000 0.51000 2.34000 0.46000 0.00000 0.00000 0.00000 0.10000 0.16000 0.00000 -0.51000 0.00000 -0.18000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_22.PDB 5.93016 -7.92000 -0.53000 -1.37000 -4.28000 -0.96000 2.79000 -6.40000 0.20000 3.68000 0.28000 0.00000 0.00000 0.00000 0.23000 0.14000 0.00000 -0.82000 0.00000 -0.74000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_23.PDB 3.43150 -7.21000 -0.50000 -1.92000 -4.90000 -1.13000 4.22000 -6.15000 0.25000 3.65000 0.41000 0.00000 0.00000 0.00000 0.12000 0.30000 0.00000 -0.47000 0.00000 -0.79000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_24.PDB 6.28698 -6.80000 -0.45000 -0.47000 -4.24000 -0.02000 2.18000 -6.70000 0.46000 2.39000 0.38000 0.00000 0.00000 0.00000 0.24000 0.17000 0.00000 -0.54000 0.00000 -0.02000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_25.PDB 4.15790 -5.44000 -0.45000 -0.46000 -3.91000 -0.11000 2.64000 -5.50000 0.28000 2.32000 0.39000 0.00000 0.00000 0.00000 0.08000 0.17000 0.00000 -0.54000 0.00000 -0.18000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_26.PDB 4.08260 -8.73000 -0.49000 -2.65000 -4.78000 -0.89000 3.61000 -6.72000 0.28000 3.78000 0.36000 0.00000 0.00000 0.00000 0.24000 0.23000 0.00000 -0.81000 0.00000 -0.65000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_27.PDB 6.47683 -9.48000 -0.52000 -2.70000 -4.92000 -1.68000 3.84000 -6.85000 0.34000 4.46000 0.35000 0.00000 0.00000 0.00000 0.26000 0.15000 0.00000 -0.79000 0.00000 -1.28000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_28.PDB 4.98742 -5.94000 -0.46000 -0.48000 -4.35000 -0.09000 2.47000 -6.32000 0.68000 2.50000 0.33000 0.00000 0.00000 0.00000 0.26000 0.18000 0.00000 -0.40000 0.00000 -0.10000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_29.PDB 5.62848 -7.64000 -0.53000 -1.26000 -4.64000 -0.94000 3.11000 -6.81000 0.21000 3.84000 0.39000 0.00000 0.00000 0.00000 0.25000 0.19000 0.00000 -0.49000 0.00000 -0.76000 0.00000 2.38000 67.00000 PIN3_1YNZ-21_30.PDB 4.95779 -6.94000 -0.44000 -0.47000 -4.58000 0.06000 2.34000 -7.18000 0.41000 2.66000 0.39000 0.00000 0.00000 0.00000 0.34000 0.21000 0.00000 -0.52000 0.00000 0.05000 0.00000 2.38000 67.00000