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 NBP2_1SEM-13_1.PDB 1.48055 -12.16000 -2.66000 -2.63000 -7.92000 -2.98000 8.11000 -9.74000 0.40000 5.68000 2.69000 0.00000 0.00000 0.00000 0.07000 0.49000 0.00000 -0.50000 0.00000 -2.67000 0.00000 2.38000 65.00000 NBP2_1SEM-13_2.PDB 2.22422 -13.33000 -3.96000 -4.00000 -8.91000 -4.41000 10.66000 -10.28000 0.32000 6.65000 3.92000 0.00000 0.00000 0.00000 0.07000 0.59000 0.00000 -0.28000 0.00000 -3.10000 0.00000 2.38000 65.00000 NBP2_1SEM-13_3.PDB 2.58794 -14.58000 -3.52000 -3.54000 -8.80000 -3.99000 9.88000 -10.29000 0.12000 6.41000 2.41000 0.00000 0.00000 0.00000 0.06000 0.53000 0.00000 -0.66000 0.00000 -2.66000 0.00000 2.38000 65.00000 NBP2_1SEM-13_4.PDB 1.27909 -12.04000 -2.71000 -2.74000 -7.32000 -3.32000 8.26000 -8.64000 0.03000 5.59000 2.33000 0.00000 0.00000 0.00000 0.06000 0.48000 0.00000 -0.63000 0.00000 -2.94000 0.00000 2.38000 65.00000 NBP2_1SEM-13_5.PDB 2.23501 -10.55000 -2.67000 -2.64000 -7.46000 -2.65000 7.84000 -9.27000 0.60000 5.91000 2.56000 0.00000 0.00000 0.00000 0.09000 0.63000 0.00000 -0.30000 0.00000 -2.57000 0.00000 2.38000 65.00000 NBP2_1SEM-13_6.PDB 2.54061 -13.62000 -3.55000 -4.37000 -8.73000 -3.45000 10.70000 -10.30000 0.16000 6.35000 2.52000 0.00000 0.00000 0.00000 0.10000 0.59000 0.00000 -0.51000 0.00000 -2.52000 0.00000 2.38000 65.00000 NBP2_1SEM-13_7.PDB 2.68879 -13.70000 -3.56000 -4.42000 -8.52000 -3.10000 9.97000 -10.22000 0.11000 6.27000 2.40000 0.00000 0.00000 0.00000 0.10000 0.52000 0.00000 -0.50000 0.00000 -2.23000 0.00000 2.38000 65.00000 NBP2_1SEM-13_8.PDB 1.80997 -11.34000 -2.69000 -2.75000 -8.01000 -3.18000 8.47000 -9.95000 0.17000 6.42000 3.33000 0.00000 0.00000 0.00000 0.07000 0.50000 0.00000 -0.77000 0.00000 -2.45000 0.00000 2.38000 65.00000 NBP2_1SEM-13_9.PDB 2.38391 -13.75000 -3.52000 -3.57000 -8.45000 -3.56000 9.03000 -9.94000 0.23000 6.68000 2.69000 0.00000 0.00000 0.00000 0.06000 0.60000 0.00000 -0.88000 0.00000 -2.52000 0.00000 2.38000 65.00000 NBP2_1SEM-13_10.PDB 1.01163 -10.78000 -2.63000 -2.63000 -6.93000 -2.09000 6.90000 -8.65000 0.62000 4.83000 2.26000 0.00000 0.00000 0.00000 0.03000 0.44000 0.00000 -0.38000 0.00000 -2.11000 0.00000 2.38000 65.00000 NBP2_1SEM-13_11.PDB 2.76671 -14.25000 -3.51000 -3.51000 -9.50000 -4.37000 10.96000 -11.07000 0.44000 7.17000 2.82000 0.00000 0.00000 0.00000 0.11000 0.76000 0.00000 -0.71000 0.00000 -3.06000 0.00000 2.38000 65.00000 NBP2_1SEM-13_12.PDB 1.22484 -10.14000 -2.74000 -2.68000 -7.08000 -2.21000 7.60000 -8.81000 0.15000 5.83000 2.49000 0.00000 0.00000 0.00000 0.07000 0.64000 0.00000 -0.67000 0.00000 -2.08000 0.00000 2.38000 65.00000 NBP2_1SEM-13_13.PDB 2.20516 -13.60000 -3.59000 -4.50000 -8.32000 -3.46000 10.09000 -9.66000 0.51000 6.20000 2.13000 0.00000 0.00000 0.00000 0.05000 0.50000 0.00000 -0.38000 0.00000 -2.66000 0.00000 2.38000 65.00000 NBP2_1SEM-13_14.PDB 1.28394 -11.92000 -2.66000 -2.44000 -8.24000 -4.10000 9.22000 -9.71000 0.19000 6.51000 3.12000 0.00000 0.00000 0.00000 0.11000 0.52000 0.00000 -0.98000 0.00000 -2.93000 0.00000 2.38000 65.00000 NBP2_1SEM-13_15.PDB 2.00928 -10.96000 -2.74000 -2.72000 -8.20000 -3.37000 9.52000 -9.71000 0.08000 6.45000 2.75000 0.00000 0.00000 0.00000 0.08000 0.66000 0.00000 -0.40000 0.00000 -2.69000 0.00000 2.38000 65.00000 NBP2_1SEM-13_16.PDB 2.14472 -11.27000 -3.47000 -3.53000 -8.41000 -3.37000 9.02000 -10.32000 0.78000 6.62000 4.45000 0.00000 0.00000 0.00000 0.04000 0.55000 0.00000 -0.56000 0.00000 -2.51000 0.00000 2.38000 65.00000 NBP2_1SEM-13_17.PDB 1.67891 -10.96000 -2.67000 -2.72000 -8.24000 -2.94000 8.70000 -10.17000 0.08000 6.49000 3.32000 0.00000 0.00000 0.00000 0.07000 0.58000 0.00000 -0.77000 0.00000 -2.10000 0.00000 2.38000 65.00000 NBP2_1SEM-13_18.PDB 1.85878 -11.66000 -3.69000 -4.58000 -8.46000 -3.31000 9.56000 -10.09000 0.24000 6.85000 4.69000 0.00000 0.00000 0.00000 0.06000 0.57000 0.00000 -0.37000 0.00000 -2.55000 0.00000 2.38000 65.00000 NBP2_1SEM-13_19.PDB 1.25718 -11.15000 -2.70000 -2.71000 -6.95000 -2.84000 7.38000 -8.47000 0.16000 5.69000 2.13000 0.00000 0.00000 0.00000 0.05000 0.44000 0.00000 -0.29000 0.00000 -2.60000 0.00000 2.38000 65.00000 NBP2_1SEM-13_20.PDB 2.23866 -13.15000 -3.54000 -3.59000 -8.05000 -3.27000 9.14000 -9.38000 0.19000 6.24000 2.34000 0.00000 0.00000 0.00000 0.05000 0.49000 0.00000 -1.03000 0.00000 -2.24000 0.00000 2.38000 65.00000 NBP2_1SEM-13_21.PDB 1.07542 -10.85000 -2.67000 -2.74000 -6.42000 -2.21000 6.65000 -8.27000 0.07000 5.02000 2.52000 0.00000 0.00000 0.00000 0.03000 0.45000 0.00000 -0.58000 0.00000 -2.25000 0.00000 2.38000 65.00000 NBP2_1SEM-13_22.PDB 2.85452 -13.90000 -3.59000 -4.33000 -9.37000 -3.89000 11.51000 -11.05000 0.09000 7.05000 2.79000 0.00000 0.00000 0.00000 0.13000 0.76000 0.00000 -0.53000 0.00000 -2.71000 0.00000 2.38000 65.00000 NBP2_1SEM-13_23.PDB 2.06508 -11.46000 -2.67000 -2.68000 -7.63000 -3.29000 8.23000 -9.15000 0.42000 5.78000 2.41000 0.00000 0.00000 0.00000 0.09000 0.44000 0.00000 -0.35000 0.00000 -2.64000 0.00000 2.38000 65.00000 NBP2_1SEM-13_24.PDB 1.79189 -12.03000 -3.86000 -3.91000 -8.27000 -3.87000 9.95000 -9.44000 0.18000 6.36000 3.86000 0.00000 0.00000 0.00000 0.05000 0.55000 0.00000 -0.30000 0.00000 -2.77000 0.00000 2.38000 65.00000 NBP2_1SEM-13_25.PDB 2.09396 -10.88000 -2.66000 -2.74000 -7.51000 -2.61000 8.02000 -9.10000 0.12000 5.55000 2.42000 0.00000 0.00000 0.00000 0.06000 0.42000 0.00000 -0.32000 0.00000 -2.13000 0.00000 2.38000 65.00000 NBP2_1SEM-13_26.PDB 2.92658 -13.38000 -3.58000 -4.42000 -9.25000 -3.31000 10.95000 -11.11000 0.48000 6.79000 2.74000 0.00000 0.00000 0.00000 0.09000 0.75000 0.00000 -0.44000 0.00000 -2.32000 0.00000 2.38000 65.00000 NBP2_1SEM-13_27.PDB 2.52772 -12.04000 -3.47000 -3.50000 -8.99000 -3.45000 9.95000 -11.03000 0.46000 6.95000 4.27000 0.00000 0.00000 0.00000 0.13000 0.72000 0.00000 -0.81000 0.00000 -2.55000 0.00000 2.38000 65.00000 NBP2_1SEM-13_28.PDB 2.12450 -11.59000 -3.59000 -3.58000 -9.32000 -3.98000 10.86000 -10.93000 0.10000 7.06000 4.60000 0.00000 0.00000 0.00000 0.10000 0.73000 0.00000 -0.28000 0.00000 -2.63000 0.00000 2.38000 65.00000 NBP2_1SEM-13_29.PDB 3.34018 -13.58000 -3.60000 -3.58000 -8.60000 -4.17000 10.23000 -9.83000 0.29000 7.00000 2.20000 0.00000 0.00000 0.00000 0.11000 0.75000 0.00000 -0.61000 0.00000 -3.05000 0.00000 2.38000 65.00000 NBP2_1SEM-13_30.PDB 1.92743 -11.00000 -2.69000 -2.67000 -7.07000 -2.35000 7.05000 -8.87000 0.04000 5.56000 2.49000 0.00000 0.00000 0.00000 0.04000 0.43000 0.00000 -0.39000 0.00000 -2.14000 0.00000 2.38000 65.00000