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-20_1.PDB 3.71105 -7.71000 -2.10000 -3.48000 -9.11000 -1.36000 9.61000 -11.08000 2.23000 5.80000 3.57000 0.00000 0.00000 0.00000 0.05000 0.33000 0.00000 -0.58000 0.00000 -1.26000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_2.PDB 3.88803 -8.39000 -2.72000 -4.29000 -9.78000 -1.41000 10.23000 -11.83000 2.34000 7.02000 4.31000 0.00000 0.00000 0.00000 0.08000 0.43000 0.00000 -1.11000 0.00000 -1.23000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_3.PDB 3.99453 -8.08000 -2.96000 -5.31000 -10.31000 -0.92000 10.39000 -12.64000 2.49000 7.99000 4.50000 0.00000 0.00000 0.00000 0.13000 0.56000 0.00000 -0.56000 0.00000 -0.88000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_4.PDB 3.25740 -7.51000 -2.06000 -4.24000 -10.32000 -1.19000 10.45000 -12.66000 3.06000 7.23000 3.80000 0.00000 0.00000 0.00000 0.04000 0.52000 0.00000 -0.55000 0.00000 -1.07000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_5.PDB 3.96287 -7.11000 -2.06000 -4.40000 -8.62000 -1.26000 9.77000 -10.22000 2.35000 5.64000 3.66000 0.00000 0.00000 0.00000 0.06000 0.32000 0.00000 -0.77000 0.00000 -1.26000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_6.PDB 3.31580 -7.98000 -2.94000 -5.36000 -8.72000 -1.17000 9.36000 -10.36000 2.75000 6.84000 3.92000 0.00000 0.00000 0.00000 0.05000 0.37000 0.00000 -1.14000 0.00000 -1.20000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_7.PDB 3.97256 -8.50000 -2.99000 -4.43000 -9.75000 -1.12000 10.22000 -11.86000 2.61000 7.04000 3.63000 0.00000 0.00000 0.00000 0.05000 0.53000 0.00000 -0.87000 0.00000 -1.03000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_8.PDB 2.85157 -7.71000 -2.78000 -5.11000 -9.41000 -0.92000 9.68000 -11.49000 2.62000 7.30000 4.11000 0.00000 0.00000 0.00000 0.05000 0.40000 0.00000 -0.84000 0.00000 -0.93000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_9.PDB 4.18663 -7.81000 -2.81000 -4.29000 -9.90000 -1.48000 10.87000 -11.61000 2.16000 7.08000 4.06000 0.00000 0.00000 0.00000 0.10000 0.54000 0.00000 -0.68000 0.00000 -1.31000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_10.PDB 3.82307 -8.26000 -2.92000 -5.20000 -9.14000 -1.14000 10.04000 -10.83000 2.20000 6.88000 4.01000 0.00000 0.00000 0.00000 0.04000 0.36000 0.00000 -1.05000 0.00000 -1.15000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_11.PDB 3.40375 -8.65000 -3.73000 -5.19000 -10.86000 -1.42000 12.45000 -13.03000 2.83000 8.30000 3.99000 0.00000 0.00000 0.00000 0.09000 0.56000 0.00000 -0.90000 0.00000 -1.18000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_12.PDB 3.90080 -9.41000 -2.82000 -5.26000 -9.24000 -0.92000 9.10000 -11.44000 2.25000 6.92000 3.93000 0.00000 0.00000 0.00000 0.06000 0.46000 0.00000 -1.10000 0.00000 -0.92000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_13.PDB 3.64816 -7.36000 -2.96000 -4.41000 -10.02000 -0.67000 10.63000 -12.01000 2.08000 6.95000 4.51000 0.00000 0.00000 0.00000 0.04000 0.52000 0.00000 -0.97000 0.00000 -0.54000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_14.PDB 3.67406 -8.07000 -2.95000 -4.34000 -9.37000 -0.69000 9.64000 -11.49000 2.10000 6.39000 4.38000 0.00000 0.00000 0.00000 0.03000 0.48000 0.00000 -1.21000 0.00000 -0.55000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_15.PDB 3.69585 -8.60000 -2.96000 -4.50000 -8.82000 -0.78000 9.12000 -10.70000 1.84000 5.90000 4.12000 0.00000 0.00000 0.00000 0.05000 0.37000 0.00000 -1.14000 0.00000 -0.72000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_16.PDB 3.75181 -5.38000 -3.63000 -5.21000 -10.33000 -0.70000 11.70000 -12.45000 4.12000 7.61000 4.66000 0.00000 0.00000 0.00000 0.15000 0.52000 0.00000 -0.83000 0.00000 -0.48000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_17.PDB 3.83909 -7.71000 -2.94000 -4.41000 -10.37000 -0.37000 9.94000 -13.00000 2.40000 7.32000 4.71000 0.00000 0.00000 0.00000 0.08000 0.51000 0.00000 -0.77000 0.00000 -0.27000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_18.PDB 3.86795 -8.03000 -2.72000 -4.31000 -8.30000 -1.01000 9.51000 -10.01000 1.99000 5.11000 3.38000 0.00000 0.00000 0.00000 0.05000 0.27000 0.00000 -0.86000 0.00000 -0.86000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_19.PDB 2.98071 -7.07000 -2.93000 -4.34000 -9.51000 -0.48000 9.66000 -11.66000 2.95000 6.49000 4.01000 0.00000 0.00000 0.00000 0.04000 0.42000 0.00000 -0.92000 0.00000 -0.38000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_20.PDB 2.89325 -6.55000 -1.88000 -4.16000 -9.37000 -0.63000 9.35000 -11.41000 2.67000 6.03000 4.05000 0.00000 0.00000 0.00000 0.05000 0.49000 0.00000 -0.72000 0.00000 -0.52000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_21.PDB 2.90075 -7.02000 -2.98000 -4.31000 -9.56000 -0.58000 9.71000 -11.76000 3.02000 6.34000 4.34000 0.00000 0.00000 0.00000 0.06000 0.48000 0.00000 -0.78000 0.00000 -0.54000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_22.PDB 4.39318 -9.67000 -2.10000 -4.32000 -9.78000 -0.40000 9.20000 -12.41000 1.74000 6.19000 3.40000 0.00000 0.00000 0.00000 0.13000 0.48000 0.00000 -0.93000 0.00000 -0.38000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_23.PDB 4.18971 -7.71000 -2.02000 -3.57000 -8.23000 -0.84000 8.49000 -10.12000 1.97000 4.74000 3.61000 0.00000 0.00000 0.00000 0.06000 0.35000 0.00000 -1.11000 0.00000 -0.70000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_24.PDB 2.88471 -7.48000 -2.81000 -6.00000 -9.62000 -0.45000 9.97000 -11.48000 2.66000 7.24000 4.42000 0.00000 0.00000 0.00000 0.05000 0.50000 0.00000 -0.90000 0.00000 -0.54000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_25.PDB 4.06683 -8.05000 -2.96000 -6.19000 -9.89000 -0.47000 10.70000 -11.64000 1.81000 7.55000 4.36000 0.00000 0.00000 0.00000 0.13000 0.52000 0.00000 -0.92000 0.00000 -0.54000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_26.PDB 2.81608 -7.00000 -2.23000 -5.43000 -8.27000 -0.80000 8.98000 -9.75000 2.26000 6.49000 3.67000 0.00000 0.00000 0.00000 0.04000 0.38000 0.00000 -1.13000 0.00000 -0.81000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_27.PDB 2.92037 -6.57000 -2.96000 -5.04000 -9.45000 -0.90000 10.06000 -11.35000 3.51000 6.83000 3.98000 0.00000 0.00000 0.00000 0.06000 0.44000 0.00000 -0.69000 0.00000 -0.63000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_28.PDB 2.90343 -7.48000 -1.21000 -5.31000 -7.87000 -0.71000 8.01000 -9.72000 2.68000 4.96000 3.26000 0.00000 0.00000 0.00000 0.02000 0.23000 0.00000 -0.85000 0.00000 -0.76000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_29.PDB 3.76341 -8.61000 -2.72000 -5.95000 -9.53000 -0.51000 10.38000 -11.76000 2.21000 6.92000 3.61000 0.00000 0.00000 0.00000 0.07000 0.40000 0.00000 -0.85000 0.00000 -0.46000 0.00000 2.38000 66.00000 PIN3_1YNZ-20_30.PDB 2.96373 -8.65000 -2.70000 -5.89000 -10.25000 -0.41000 9.88000 -12.76000 2.60000 7.75000 4.52000 0.00000 0.00000 0.00000 0.06000 0.52000 0.00000 -1.04000 0.00000 -0.41000 0.00000 2.38000 66.00000