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 2C742_1.PDB 2.95433 -12.31000 -2.50000 -4.82000 -7.49000 -2.54000 10.09000 -10.02000 0.48000 5.54000 1.68000 0.00000 0.00000 0.00000 0.02000 0.48000 -0.05000 -1.08000 0.00000 -1.62000 0.00000 2.38000 240.00000 2C742_2.PDB 2.57154 -12.29000 -2.41000 -4.77000 -7.48000 -2.54000 10.00000 -10.05000 0.40000 5.84000 1.87000 0.00000 0.00000 0.00000 0.03000 0.41000 -0.05000 -1.58000 0.00000 -1.56000 0.00000 2.38000 240.00000 2C742_3.PDB 2.51982 -11.61000 -2.39000 -4.60000 -7.26000 -2.57000 10.54000 -9.40000 0.33000 5.68000 1.52000 0.00000 0.00000 0.00000 0.03000 0.46000 -0.05000 -1.85000 0.00000 -1.58000 0.00000 2.38000 240.00000 2C742_4.PDB 2.49637 -12.30000 -2.40000 -4.77000 -7.49000 -2.50000 10.18000 -10.01000 0.34000 5.81000 1.76000 0.00000 0.00000 0.00000 0.03000 0.48000 -0.05000 -1.65000 0.00000 -1.54000 0.00000 2.38000 240.00000 2C742_5.PDB 2.69238 -11.57000 -2.33000 -4.78000 -7.59000 -2.70000 10.44000 -10.04000 0.52000 6.16000 1.98000 0.00000 0.00000 0.00000 0.04000 0.34000 -0.05000 -1.69000 0.00000 -1.52000 0.00000 2.38000 240.00000 2C742_6.PDB 3.17135 -12.23000 -2.43000 -4.80000 -7.53000 -2.63000 10.44000 -10.01000 0.41000 5.52000 1.63000 0.00000 0.00000 0.00000 0.02000 0.39000 -0.05000 -1.29000 0.00000 -1.51000 0.00000 2.38000 240.00000 2C742_7.PDB 2.53638 -12.29000 -2.47000 -4.61000 -7.27000 -2.64000 9.94000 -9.66000 0.42000 5.53000 1.50000 0.00000 0.00000 0.00000 0.01000 0.43000 -0.05000 -1.34000 0.00000 -1.65000 0.00000 2.38000 240.00000 2C742_8.PDB 2.87856 -13.43000 -2.40000 -4.81000 -7.95000 -2.57000 10.08000 -11.02000 0.46000 6.44000 1.74000 0.00000 0.00000 0.00000 0.04000 0.28000 -0.05000 -1.74000 0.00000 -1.64000 0.00000 2.38000 240.00000 2C742_9.PDB 2.68351 -12.19000 -2.55000 -4.85000 -8.10000 -2.64000 10.93000 -10.69000 0.48000 6.32000 1.98000 0.00000 0.00000 0.00000 0.04000 0.46000 -0.05000 -1.51000 0.00000 -1.55000 0.00000 2.38000 240.00000 2C742_10.PDB 2.45652 -12.12000 -2.39000 -4.78000 -7.51000 -2.79000 10.49000 -9.79000 0.51000 5.93000 1.44000 0.00000 0.00000 0.00000 0.05000 0.30000 -0.05000 -1.67000 0.00000 -1.58000 0.00000 2.38000 240.00000 2C742_11.PDB 3.41354 -11.25000 -2.38000 -4.76000 -7.13000 -2.56000 10.19000 -9.31000 0.37000 5.97000 1.70000 0.00000 0.00000 0.00000 0.07000 0.35000 -0.05000 -1.71000 0.00000 -1.64000 0.00000 2.38000 240.00000 2C742_12.PDB 2.98768 -12.30000 -2.53000 -4.94000 -7.52000 -2.57000 10.04000 -10.24000 0.48000 6.17000 2.17000 0.00000 0.00000 0.00000 0.04000 0.35000 -0.05000 -1.71000 0.00000 -1.64000 0.00000 2.38000 240.00000 2C742_13.PDB 2.69403 -12.74000 -2.50000 -6.19000 -7.26000 -2.65000 10.93000 -9.50000 0.37000 6.08000 1.70000 0.00000 0.00000 0.00000 0.01000 0.26000 -0.12000 -1.71000 0.00000 -1.89000 0.00000 2.38000 240.00000 2C742_14.PDB 2.89561 -12.13000 -2.42000 -5.70000 -7.91000 -3.20000 12.11000 -10.16000 0.56000 6.54000 1.73000 0.00000 0.00000 0.00000 0.04000 0.41000 -0.09000 -1.67000 0.00000 -1.97000 0.00000 2.38000 240.00000 2C742_15.PDB 2.76011 -12.67000 -2.40000 -5.09000 -7.57000 -3.05000 11.11000 -9.69000 0.38000 5.18000 1.52000 0.00000 0.00000 0.00000 0.04000 0.45000 -0.05000 -1.01000 0.00000 -2.05000 0.00000 2.38000 240.00000 2C742_16.PDB 2.57434 -12.69000 -2.43000 -5.11000 -7.43000 -3.09000 10.98000 -9.41000 0.52000 4.63000 1.49000 0.00000 0.00000 0.00000 0.05000 0.50000 -0.05000 -0.79000 0.00000 -2.07000 0.00000 2.38000 240.00000 2C742_17.PDB 3.23106 -12.34000 -2.36000 -6.03000 -6.93000 -2.73000 10.24000 -8.97000 0.50000 6.18000 1.58000 0.00000 0.00000 0.00000 0.03000 0.34000 -0.13000 -1.87000 0.00000 -1.86000 0.00000 2.38000 240.00000 2C742_18.PDB 2.75479 -12.94000 -2.43000 -6.11000 -8.17000 -2.81000 11.61000 -10.56000 0.58000 6.93000 2.00000 0.00000 0.00000 0.00000 0.03000 0.44000 -0.13000 -1.96000 0.00000 -1.93000 0.00000 2.38000 240.00000 2C742_19.PDB 2.84699 -12.70000 -2.50000 -4.58000 -7.35000 -2.55000 9.97000 -9.86000 0.60000 5.33000 1.59000 0.00000 0.00000 0.00000 0.02000 0.50000 -0.05000 -1.75000 0.00000 -1.57000 0.00000 2.38000 240.00000 2C742_20.PDB 2.61978 -11.39000 -2.40000 -4.78000 -7.39000 -2.49000 10.29000 -9.87000 0.31000 5.98000 2.17000 0.00000 0.00000 0.00000 0.04000 0.41000 -0.05000 -1.66000 0.00000 -1.56000 0.00000 2.38000 240.00000 2C742_21.PDB 2.68145 -11.30000 -2.35000 -5.08000 -7.08000 -3.07000 11.38000 -8.68000 0.39000 4.76000 1.30000 0.00000 0.00000 0.00000 0.05000 0.33000 -0.05000 -0.81000 0.00000 -2.05000 0.00000 2.38000 240.00000 2C742_22.PDB 2.66364 -12.14000 -2.52000 -5.23000 -7.13000 -3.27000 11.21000 -8.98000 0.31000 4.99000 1.44000 0.00000 0.00000 0.00000 0.06000 0.39000 -0.03000 -0.77000 0.00000 -2.22000 0.00000 2.38000 240.00000 2C742_23.PDB 2.58821 -13.03000 -2.34000 -5.08000 -7.69000 -3.34000 11.19000 -9.89000 0.43000 5.32000 1.53000 0.00000 0.00000 0.00000 0.06000 0.33000 -0.05000 -1.09000 0.00000 -2.07000 0.00000 2.38000 240.00000 2C742_24.PDB 2.91931 -12.35000 -2.41000 -5.04000 -7.27000 -3.27000 11.13000 -8.97000 0.42000 4.43000 1.36000 0.00000 0.00000 0.00000 0.04000 0.36000 -0.05000 -0.65000 0.00000 -2.06000 0.00000 2.38000 240.00000 2C742_25.PDB 2.78154 -10.75000 -2.41000 -4.78000 -7.17000 -2.46000 10.24000 -9.54000 0.35000 5.76000 2.09000 0.00000 0.00000 0.00000 0.02000 0.42000 -0.05000 -1.29000 0.00000 -1.53000 0.00000 2.38000 240.00000 2C742_26.PDB 2.47765 -11.42000 -2.60000 -4.97000 -7.25000 -2.44000 10.34000 -9.53000 0.31000 5.70000 2.07000 0.00000 0.00000 0.00000 0.02000 0.48000 -0.05000 -1.47000 0.00000 -1.57000 0.00000 2.38000 240.00000 2C742_27.PDB 2.57405 -11.06000 -2.38000 -4.78000 -7.56000 -2.68000 10.66000 -9.95000 0.31000 6.09000 2.16000 0.00000 0.00000 0.00000 0.04000 0.38000 -0.05000 -1.44000 0.00000 -1.48000 0.00000 2.38000 240.00000 2C742_28.PDB 2.85358 -12.00000 -2.40000 -4.76000 -7.43000 -2.81000 10.35000 -9.85000 0.38000 5.55000 1.85000 0.00000 0.00000 0.00000 0.03000 0.36000 -0.05000 -1.21000 0.00000 -1.66000 0.00000 2.38000 240.00000 2C742_29.PDB 2.66933 -11.62000 -2.38000 -4.80000 -7.25000 -2.64000 9.83000 -9.37000 0.30000 5.71000 2.47000 0.00000 0.00000 0.00000 0.03000 0.43000 -0.05000 -1.63000 0.00000 -1.83000 0.00000 2.38000 240.00000 2C742_30.PDB 2.61462 -12.31000 -2.47000 -4.80000 -7.25000 -2.67000 9.80000 -9.35000 0.43000 5.19000 2.01000 0.00000 0.00000 0.00000 0.02000 0.44000 -0.05000 -1.34000 0.00000 -1.83000 0.00000 2.38000 240.00000