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-16_1.PDB 3.87416 -3.56000 -1.58000 -2.31000 -7.67000 -0.85000 7.74000 -10.28000 3.35000 6.65000 2.88000 0.00000 0.00000 0.00000 0.12000 0.34000 0.00000 -0.70000 0.00000 -0.90000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_2.PDB 4.20569 -3.71000 -0.76000 -0.81000 -7.11000 -0.55000 6.72000 -9.62000 1.55000 4.75000 2.74000 0.00000 0.00000 0.00000 0.59000 0.30000 0.00000 -0.57000 0.00000 -0.63000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_3.PDB 2.72211 -2.83000 -1.43000 -2.27000 -7.71000 -0.87000 7.80000 -10.30000 3.94000 6.68000 2.84000 0.00000 0.00000 0.00000 0.16000 0.30000 0.00000 -0.75000 0.00000 -0.93000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_4.PDB 4.73349 -2.89000 -2.32000 -3.04000 -7.69000 -0.57000 9.33000 -10.06000 3.45000 6.14000 2.70000 0.00000 0.00000 0.00000 0.30000 0.31000 0.00000 -0.52000 0.00000 -0.62000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_5.PDB 3.63389 -3.34000 -1.50000 -1.46000 -7.36000 -0.63000 7.25000 -9.87000 3.10000 5.60000 2.76000 0.00000 0.00000 0.00000 0.16000 0.30000 0.00000 -0.67000 0.00000 -0.73000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_6.PDB 5.09539 -5.48000 -1.64000 -2.45000 -7.89000 -0.86000 7.87000 -10.52000 1.63000 6.65000 3.15000 0.00000 0.00000 0.00000 0.19000 0.31000 0.00000 -0.70000 0.00000 -0.91000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_7.PDB 2.63250 -2.05000 -2.22000 -2.99000 -6.84000 -0.70000 9.05000 -8.73000 2.69000 5.80000 3.07000 0.00000 0.00000 0.00000 0.07000 0.23000 0.00000 -0.50000 0.00000 -0.74000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_8.PDB 3.49547 -3.98000 -1.52000 -2.36000 -7.63000 -0.88000 7.60000 -10.04000 3.04000 6.77000 2.79000 0.00000 0.00000 0.00000 0.10000 0.28000 0.00000 -0.91000 0.00000 -0.94000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_9.PDB 3.36037 -2.89000 -1.61000 -1.57000 -7.25000 -0.43000 7.13000 -9.70000 3.49000 5.36000 2.71000 0.00000 0.00000 0.00000 0.12000 0.29000 0.00000 -0.66000 0.00000 -0.49000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_10.PDB 3.38331 -2.49000 -1.37000 -1.33000 -7.40000 -0.48000 7.25000 -9.97000 3.81000 5.32000 2.77000 0.00000 0.00000 0.00000 0.10000 0.29000 0.00000 -0.63000 0.00000 -0.58000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_11.PDB 4.38045 -2.94000 -1.55000 -1.56000 -6.95000 -0.43000 7.20000 -9.34000 3.17000 5.04000 2.35000 0.00000 0.00000 0.00000 0.13000 0.29000 0.00000 -0.47000 0.00000 -0.50000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_12.PDB 3.56462 -3.31000 -1.49000 -1.45000 -7.51000 -0.47000 7.25000 -9.92000 3.04000 5.59000 2.71000 0.00000 0.00000 0.00000 0.12000 0.27000 0.00000 -0.63000 0.00000 -0.56000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_13.PDB 2.50922 -3.01000 -1.59000 -1.53000 -7.30000 -0.44000 7.10000 -9.87000 3.56000 5.36000 2.73000 0.00000 0.00000 0.00000 0.14000 0.28000 0.00000 -0.69000 0.00000 -0.47000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_14.PDB 3.35430 -4.61000 -1.56000 -1.52000 -7.05000 -0.71000 6.84000 -9.54000 1.53000 5.34000 3.21000 0.00000 0.00000 0.00000 0.34000 0.28000 0.00000 -0.62000 0.00000 -0.84000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_15.PDB 4.82133 -3.45000 -2.45000 -3.20000 -6.09000 -0.77000 7.99000 -7.80000 1.37000 5.12000 3.55000 0.00000 0.00000 0.00000 0.17000 0.27000 0.00000 -0.54000 0.00000 -0.78000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_16.PDB 3.72769 -2.43000 -1.54000 -1.48000 -7.51000 -0.59000 7.49000 -10.03000 3.75000 5.59000 2.87000 0.00000 0.00000 0.00000 0.14000 0.29000 0.00000 -0.44000 0.00000 -0.67000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_17.PDB 4.38996 -4.94000 -1.68000 -2.51000 -7.70000 -0.82000 7.92000 -10.53000 2.24000 6.08000 3.06000 0.00000 0.00000 0.00000 0.41000 0.30000 0.00000 -0.56000 0.00000 -0.87000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_18.PDB 2.43053 -2.69000 -1.65000 -1.59000 -7.13000 -0.37000 6.76000 -9.65000 3.56000 5.29000 3.03000 0.00000 0.00000 0.00000 0.15000 0.27000 0.00000 -0.60000 0.00000 -0.48000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_19.PDB 2.57057 -3.90000 -1.62000 -2.43000 -7.98000 -0.88000 7.74000 -10.56000 3.57000 6.94000 2.87000 0.00000 0.00000 0.00000 0.11000 0.26000 0.00000 -0.74000 0.00000 -0.93000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_20.PDB 3.35537 -4.16000 -1.59000 -2.55000 -6.79000 -0.85000 7.20000 -8.96000 2.21000 5.83000 2.89000 0.00000 0.00000 0.00000 0.07000 0.41000 0.00000 -0.73000 0.00000 -0.91000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_21.PDB 3.57245 -3.35000 -1.64000 -1.58000 -7.32000 -0.51000 7.31000 -9.73000 3.21000 5.34000 2.76000 0.00000 0.00000 0.00000 0.16000 0.26000 0.00000 -0.71000 0.00000 -0.62000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_22.PDB 6.28125 -4.69000 -1.63000 -1.56000 -7.82000 -0.48000 7.62000 -10.52000 1.83000 5.71000 3.09000 0.00000 0.00000 0.00000 0.38000 0.32000 0.00000 -0.77000 0.00000 -0.56000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_23.PDB 3.28895 -3.15000 -1.58000 -1.53000 -7.62000 -0.49000 7.35000 -10.06000 3.46000 5.60000 2.76000 0.00000 0.00000 0.00000 0.10000 0.26000 0.00000 -0.59000 0.00000 -0.53000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_24.PDB 3.54336 -3.64000 -1.68000 -2.60000 -7.64000 -0.92000 7.51000 -10.16000 3.67000 6.74000 2.98000 0.00000 0.00000 0.00000 0.10000 0.26000 0.00000 -0.69000 0.00000 -0.94000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_25.PDB 2.68820 -3.54000 -2.54000 -2.53000 -7.54000 -0.61000 8.52000 -9.94000 3.36000 5.93000 2.90000 0.00000 0.00000 0.00000 0.16000 0.30000 0.00000 -0.67000 0.00000 -0.57000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_26.PDB 5.20400 -4.05000 -1.58000 -1.50000 -7.57000 -0.35000 6.92000 -10.53000 3.40000 4.94000 3.09000 0.00000 0.00000 0.00000 0.34000 0.32000 0.00000 -0.73000 0.00000 -0.47000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_27.PDB 3.57323 -3.66000 -1.57000 -1.53000 -7.25000 -0.57000 7.04000 -9.74000 2.46000 5.43000 3.14000 0.00000 0.00000 0.00000 0.32000 0.28000 0.00000 -0.75000 0.00000 -0.64000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_28.PDB 3.33521 -4.27000 -2.37000 -3.95000 -7.43000 -1.14000 9.08000 -9.74000 2.08000 6.92000 3.22000 0.00000 0.00000 0.00000 0.52000 0.28000 0.00000 -0.35000 0.00000 -1.11000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_29.PDB 3.46869 -3.55000 -1.45000 -1.40000 -6.52000 -0.34000 6.44000 -8.80000 2.05000 4.56000 2.83000 0.00000 0.00000 0.00000 0.10000 0.31000 0.00000 -0.56000 0.00000 -0.45000 0.00000 2.38000 66.00000 PIN3_1YNZ-16_30.PDB 2.89013 -4.03000 -1.51000 -1.42000 -8.15000 -0.51000 7.66000 -10.86000 2.80000 6.04000 2.91000 0.00000 0.00000 0.00000 0.27000 0.28000 0.00000 -0.64000 0.00000 -0.62000 0.00000 2.38000 66.00000