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-8_1.PDB 2.16364 -10.24000 -1.14000 -1.19000 -6.77000 -3.01000 6.75000 -8.35000 0.11000 4.97000 2.30000 0.00000 0.00000 0.00000 0.25000 0.36000 0.00000 -0.97000 0.00000 -3.19000 0.00000 2.38000 65.00000 NBP2_1SEM-8_2.PDB 2.26056 -10.84000 -2.76000 -2.77000 -8.29000 -3.95000 9.46000 -9.89000 0.33000 8.21000 3.03000 0.00000 0.00000 0.00000 0.31000 0.69000 0.00000 -0.82000 0.00000 -3.72000 0.00000 2.38000 65.00000 NBP2_1SEM-8_3.PDB 2.64853 -10.36000 -1.33000 -2.40000 -7.33000 -3.33000 8.01000 -8.80000 0.72000 5.86000 1.86000 0.00000 0.00000 0.00000 0.23000 0.57000 0.00000 -0.52000 0.00000 -3.33000 0.00000 2.38000 65.00000 NBP2_1SEM-8_4.PDB 2.06914 -7.73000 -0.96000 -0.91000 -6.27000 -1.43000 5.08000 -8.55000 0.11000 4.27000 2.62000 0.00000 0.00000 0.00000 0.15000 0.37000 0.00000 -0.08000 0.00000 -1.75000 0.00000 2.38000 65.00000 NBP2_1SEM-8_5.PDB 1.93362 -8.18000 -0.93000 -0.95000 -6.60000 -2.74000 6.17000 -8.37000 0.19000 5.47000 2.63000 0.00000 0.00000 0.00000 0.12000 0.57000 0.00000 -0.23000 0.00000 -2.93000 0.00000 2.38000 65.00000 NBP2_1SEM-8_6.PDB 2.46113 -8.33000 -0.98000 -1.02000 -7.85000 -3.21000 7.74000 -9.67000 0.13000 6.11000 3.35000 0.00000 0.00000 0.00000 0.17000 0.48000 0.00000 -0.53000 0.00000 -2.57000 0.00000 2.38000 65.00000 NBP2_1SEM-8_7.PDB 2.62114 -7.90000 -1.10000 -1.04000 -6.21000 -2.82000 6.24000 -7.88000 0.13000 5.54000 2.65000 0.00000 0.00000 0.00000 0.10000 0.66000 0.00000 -0.54000 0.00000 -2.97000 0.00000 2.38000 65.00000 NBP2_1SEM-8_8.PDB 1.79838 -7.79000 -0.90000 -0.85000 -6.49000 -1.81000 5.51000 -8.74000 0.27000 4.75000 2.73000 0.00000 0.00000 0.00000 0.14000 0.58000 0.00000 -0.22000 0.00000 -2.19000 0.00000 2.38000 65.00000 NBP2_1SEM-8_9.PDB 2.79939 -8.28000 0.19000 0.29000 -6.56000 -2.05000 5.30000 -8.51000 0.18000 2.95000 2.35000 0.00000 0.00000 0.00000 0.11000 0.39000 0.00000 -0.27000 0.00000 -2.26000 0.00000 2.38000 65.00000 NBP2_1SEM-8_10.PDB 2.90869 -8.21000 -1.05000 -1.01000 -7.00000 -1.70000 5.96000 -9.33000 0.24000 4.96000 2.93000 0.00000 0.00000 0.00000 0.12000 0.59000 0.00000 -0.26000 0.00000 -2.05000 0.00000 2.38000 65.00000 NBP2_1SEM-8_11.PDB 2.34791 -10.32000 -1.07000 -1.06000 -7.10000 -3.39000 7.59000 -8.54000 0.18000 4.89000 2.11000 0.00000 0.00000 0.00000 0.26000 0.36000 0.00000 -0.68000 0.00000 -3.51000 0.00000 2.38000 65.00000 NBP2_1SEM-8_12.PDB 2.20037 -8.89000 -1.72000 -2.47000 -7.68000 -2.15000 7.58000 -9.90000 0.09000 6.58000 3.38000 0.00000 0.00000 0.00000 0.28000 0.57000 0.00000 -0.38000 0.00000 -2.49000 0.00000 2.38000 65.00000 NBP2_1SEM-8_13.PDB 2.90639 -10.06000 -1.87000 -1.84000 -6.70000 -2.70000 6.58000 -8.41000 0.11000 5.76000 2.16000 0.00000 0.00000 0.00000 0.17000 0.46000 0.00000 -0.49000 0.00000 -2.85000 0.00000 2.38000 65.00000 NBP2_1SEM-8_14.PDB 2.92391 -9.82000 -1.90000 -1.84000 -6.98000 -3.23000 7.17000 -8.71000 0.15000 6.48000 2.67000 0.00000 0.00000 0.00000 0.20000 0.58000 0.00000 -0.62000 0.00000 -3.22000 0.00000 2.38000 65.00000 NBP2_1SEM-8_15.PDB 2.38819 -10.55000 -2.67000 -2.69000 -8.09000 -3.00000 8.90000 -9.80000 0.58000 7.34000 2.30000 0.00000 0.00000 0.00000 0.28000 0.71000 0.00000 -0.67000 0.00000 -3.03000 0.00000 2.38000 65.00000 NBP2_1SEM-8_16.PDB 1.84228 -8.38000 -0.45000 -0.36000 -7.16000 -1.70000 5.97000 -9.24000 0.07000 4.02000 2.77000 0.00000 0.00000 0.00000 0.12000 0.55000 0.00000 -0.49000 0.00000 -1.94000 0.00000 2.38000 65.00000 NBP2_1SEM-8_17.PDB 2.54096 -8.28000 -1.00000 -0.94000 -6.24000 -2.46000 5.86000 -8.04000 0.22000 5.10000 2.40000 0.00000 0.00000 0.00000 0.12000 0.55000 0.00000 -0.36000 0.00000 -2.95000 0.00000 2.38000 65.00000 NBP2_1SEM-8_18.PDB 2.22824 -8.84000 -1.05000 -1.00000 -6.58000 -2.11000 5.65000 -8.73000 0.14000 5.03000 2.66000 0.00000 0.00000 0.00000 0.12000 0.55000 0.00000 -0.31000 0.00000 -2.67000 0.00000 2.38000 65.00000 NBP2_1SEM-8_19.PDB 2.78246 -9.36000 -2.07000 -2.10000 -7.70000 -2.88000 8.43000 -9.45000 0.21000 6.59000 2.86000 0.00000 0.00000 0.00000 0.28000 0.46000 0.00000 -0.74000 0.00000 -2.80000 0.00000 2.38000 65.00000 NBP2_1SEM-8_20.PDB 2.39454 -10.41000 -0.70000 -0.59000 -7.01000 -3.22000 7.03000 -8.24000 0.22000 3.96000 1.75000 0.00000 0.00000 0.00000 0.30000 0.36000 0.00000 -0.66000 0.00000 -3.26000 0.00000 2.38000 65.00000 NBP2_1SEM-8_21.PDB 2.15544 -11.12000 -1.24000 -4.07000 -7.38000 -4.70000 9.42000 -8.32000 1.73000 5.95000 2.01000 0.00000 0.00000 0.00000 0.29000 0.43000 0.00000 -0.69000 0.00000 -4.12000 0.00000 2.38000 65.00000 NBP2_1SEM-8_22.PDB 1.81068 -9.06000 -0.26000 -0.26000 -6.88000 -1.49000 5.16000 -9.50000 0.13000 3.86000 2.17000 0.00000 0.00000 0.00000 0.14000 0.34000 0.00000 -0.26000 0.00000 -1.87000 0.00000 2.38000 65.00000 NBP2_1SEM-8_23.PDB 1.63114 -9.57000 -1.08000 -1.04000 -7.24000 -1.11000 5.19000 -10.15000 0.08000 4.91000 2.46000 0.00000 0.00000 0.00000 0.12000 0.42000 0.00000 -0.26000 0.00000 -1.45000 0.00000 2.38000 65.00000 NBP2_1SEM-8_24.PDB 2.45036 -10.45000 -2.08000 -2.74000 -7.90000 -2.94000 8.60000 -9.67000 1.48000 6.23000 2.52000 0.00000 0.00000 0.00000 0.23000 0.50000 0.00000 -1.01000 0.00000 -3.17000 0.00000 2.38000 65.00000 NBP2_1SEM-8_25.PDB 2.61393 -10.14000 -1.96000 -2.39000 -7.55000 -1.74000 6.88000 -9.82000 0.26000 5.88000 2.49000 0.00000 0.00000 0.00000 0.25000 0.45000 0.00000 -0.47000 0.00000 -1.96000 0.00000 2.38000 65.00000 NBP2_1SEM-8_26.PDB 2.19811 -7.84000 -1.07000 -1.02000 -6.23000 -2.49000 6.09000 -7.89000 0.12000 5.02000 2.57000 0.00000 0.00000 0.00000 0.14000 0.59000 0.00000 -0.23000 0.00000 -2.85000 0.00000 2.38000 65.00000 NBP2_1SEM-8_27.PDB 1.77237 -11.14000 -1.94000 -1.90000 -7.84000 -1.83000 6.74000 -10.28000 0.09000 5.67000 2.43000 0.00000 0.00000 0.00000 0.26000 0.43000 0.00000 -0.61000 0.00000 -1.91000 0.00000 2.38000 65.00000 NBP2_1SEM-8_28.PDB 2.01439 -8.62000 -1.09000 -1.69000 -6.62000 -2.28000 5.86000 -8.67000 0.14000 5.59000 2.72000 0.00000 0.00000 0.00000 0.15000 0.57000 0.00000 -0.12000 0.00000 -2.62000 0.00000 2.38000 65.00000 NBP2_1SEM-8_29.PDB 2.27792 -9.25000 -0.49000 -0.40000 -7.00000 -2.61000 6.49000 -8.49000 0.10000 4.19000 2.34000 0.00000 0.00000 0.00000 0.13000 0.51000 0.00000 -0.64000 0.00000 -2.88000 0.00000 2.38000 65.00000 NBP2_1SEM-8_30.PDB 1.96876 -9.82000 -1.86000 -1.89000 -7.19000 -3.32000 7.72000 -8.50000 0.18000 6.38000 2.59000 0.00000 0.00000 0.00000 0.17000 0.57000 0.00000 -0.71000 0.00000 -3.40000 0.00000 2.38000 65.00000