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_1GCQ-14_1.PDB 3.13218 -12.87000 -2.95000 -6.24000 -9.79000 -5.65000 13.88000 -10.83000 0.74000 8.45000 3.75000 0.00000 0.00000 0.00000 0.08000 1.28000 0.00000 -0.54000 0.00000 -3.77000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_2.PDB 3.23245 -14.37000 -2.75000 -5.19000 -10.34000 -5.07000 12.49000 -12.02000 1.25000 7.70000 2.79000 0.00000 0.00000 0.00000 0.23000 0.99000 0.00000 -0.21000 0.00000 -3.26000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_3.PDB 2.32490 -10.26000 -1.64000 -3.28000 -9.50000 -4.63000 12.78000 -11.05000 0.85000 6.40000 3.02000 0.00000 0.00000 0.00000 0.26000 0.83000 0.00000 -0.16000 0.00000 -3.32000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_4.PDB 3.24362 -13.46000 -2.94000 -4.56000 -9.46000 -4.25000 11.64000 -11.37000 1.20000 7.45000 2.69000 0.00000 0.00000 0.00000 0.07000 1.15000 0.00000 -0.86000 0.00000 -3.06000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_5.PDB 2.30684 -13.10000 -2.85000 -4.63000 -8.90000 -4.57000 11.72000 -10.21000 0.41000 6.99000 2.98000 0.00000 0.00000 0.00000 0.03000 0.99000 0.00000 -0.31000 0.00000 -3.76000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_6.PDB 2.27036 -13.81000 -1.91000 -3.70000 -9.82000 -5.07000 11.67000 -11.74000 1.40000 6.94000 2.38000 0.00000 0.00000 0.00000 0.12000 0.91000 0.00000 -0.42000 0.00000 -3.66000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_7.PDB 3.01890 -15.35000 -5.19000 -7.02000 -10.04000 -6.54000 15.56000 -10.44000 1.21000 9.74000 3.46000 0.00000 0.00000 0.00000 0.06000 0.92000 0.00000 -1.12000 0.00000 -5.01000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_8.PDB 3.11168 -14.34000 -2.01000 -3.76000 -10.03000 -4.90000 11.88000 -11.95000 0.45000 7.66000 2.48000 0.00000 0.00000 0.00000 0.13000 0.90000 0.00000 -0.45000 0.00000 -3.85000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_9.PDB 4.29161 -11.90000 -2.95000 -4.61000 -8.93000 -4.28000 11.68000 -10.51000 1.62000 7.15000 2.98000 0.00000 0.00000 0.00000 0.04000 1.07000 0.00000 -0.83000 0.00000 -3.25000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_10.PDB 2.76613 -12.48000 -2.04000 -4.33000 -10.19000 -4.24000 12.30000 -12.22000 0.35000 7.94000 3.40000 0.00000 0.00000 0.00000 0.19000 0.94000 0.00000 -0.57000 0.00000 -3.06000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_11.PDB 2.43060 -13.31000 -2.96000 -6.65000 -10.29000 -5.18000 13.90000 -11.50000 1.18000 8.47000 3.86000 0.00000 0.00000 0.00000 0.12000 1.39000 0.00000 -0.66000 0.00000 -3.61000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_12.PDB 2.22732 -12.67000 -1.74000 -3.49000 -9.35000 -4.36000 10.77000 -11.50000 1.32000 6.15000 2.89000 0.00000 0.00000 0.00000 0.05000 1.17000 0.00000 -0.37000 0.00000 -3.03000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_13.PDB 1.98805 -12.35000 -2.08000 -3.81000 -9.71000 -4.70000 12.47000 -11.36000 0.29000 7.34000 3.51000 0.00000 0.00000 0.00000 0.09000 1.32000 0.00000 -0.91000 0.00000 -3.49000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_14.PDB 2.48965 -9.81000 -2.08000 -3.76000 -8.15000 -3.74000 11.09000 -9.81000 1.00000 6.09000 2.87000 0.00000 0.00000 0.00000 0.04000 0.81000 0.00000 -0.46000 0.00000 -2.91000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_15.PDB 2.42478 -11.60000 -2.78000 -4.54000 -9.67000 -4.47000 12.65000 -11.36000 1.29000 7.73000 3.34000 0.00000 0.00000 0.00000 0.13000 0.69000 0.00000 -0.52000 0.00000 -3.40000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_16.PDB 3.01099 -13.83000 -2.51000 -4.31000 -10.27000 -4.75000 12.13000 -12.38000 1.35000 7.69000 3.06000 0.00000 0.00000 0.00000 0.17000 1.03000 0.00000 -0.60000 0.00000 -3.41000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_17.PDB 2.91313 -11.54000 -3.06000 -4.76000 -10.43000 -5.90000 14.20000 -11.70000 3.49000 7.40000 3.57000 0.00000 0.00000 0.00000 0.19000 1.06000 0.00000 -0.62000 0.00000 -3.93000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_18.PDB 2.93482 -13.99000 -2.78000 -4.30000 -10.07000 -5.02000 12.66000 -11.96000 0.48000 8.05000 2.67000 0.00000 0.00000 0.00000 0.15000 0.71000 0.00000 -0.31000 0.00000 -3.57000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_19.PDB 3.02246 -10.96000 -2.10000 -3.79000 -8.79000 -3.40000 10.71000 -10.95000 1.01000 6.38000 2.79000 0.00000 0.00000 0.00000 0.03000 1.03000 0.00000 -0.26000 0.00000 -2.58000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_20.PDB 3.65965 -11.95000 -2.09000 -3.04000 -8.52000 -3.33000 9.71000 -10.74000 1.22000 5.48000 2.30000 0.00000 0.00000 0.00000 0.06000 0.89000 0.00000 -0.62000 0.00000 -2.37000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_21.PDB 2.09175 -14.46000 -4.20000 -5.98000 -10.72000 -6.28000 15.21000 -11.43000 2.08000 8.91000 3.10000 0.00000 0.00000 0.00000 0.16000 0.98000 0.00000 -0.52000 0.00000 -4.79000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_22.PDB 2.47541 -11.51000 -2.84000 -4.38000 -9.86000 -4.35000 12.98000 -11.55000 1.25000 7.44000 3.46000 0.00000 0.00000 0.00000 0.12000 0.95000 0.00000 -0.55000 0.00000 -3.24000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_23.PDB 1.87188 -12.86000 -2.36000 -4.08000 -9.56000 -5.13000 12.52000 -10.86000 0.25000 7.40000 3.26000 0.00000 0.00000 0.00000 0.14000 1.00000 0.00000 -0.38000 0.00000 -4.06000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_24.PDB 1.94904 -12.01000 -2.00000 -4.34000 -10.36000 -5.23000 13.02000 -12.25000 2.41000 7.96000 3.01000 0.00000 0.00000 0.00000 0.11000 0.94000 0.00000 -0.33000 0.00000 -4.02000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_25.PDB 2.75763 -11.96000 -2.67000 -4.39000 -9.91000 -4.48000 12.53000 -11.62000 1.63000 7.36000 3.39000 0.00000 0.00000 0.00000 0.12000 0.88000 0.00000 -0.67000 0.00000 -3.22000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_26.PDB 2.54709 -10.49000 -1.91000 -3.55000 -9.82000 -3.85000 11.71000 -12.03000 2.46000 6.35000 2.90000 0.00000 0.00000 0.00000 0.13000 0.98000 0.00000 -0.24000 0.00000 -2.64000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_27.PDB 1.53608 -14.84000 -2.60000 -4.41000 -10.08000 -5.08000 12.88000 -11.39000 0.27000 7.09000 2.94000 0.00000 0.00000 0.00000 0.07000 1.19000 0.00000 -0.53000 0.00000 -3.99000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_28.PDB 1.92604 -12.17000 -1.27000 -3.61000 -9.75000 -4.49000 11.79000 -11.77000 0.29000 7.14000 2.92000 0.00000 0.00000 0.00000 0.10000 1.31000 0.00000 -0.49000 0.00000 -3.04000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_29.PDB 4.11676 -12.80000 -2.68000 -4.62000 -9.70000 -5.92000 13.78000 -10.65000 0.90000 7.72000 2.76000 0.00000 0.00000 0.00000 0.28000 1.05000 0.00000 -0.89000 0.00000 -3.76000 0.00000 2.38000 66.00000 NBP2_1GCQ-14_30.PDB 2.71197 -12.93000 -2.93000 -4.57000 -9.01000 -4.90000 11.97000 -10.23000 1.26000 6.94000 3.46000 0.00000 0.00000 0.00000 0.05000 1.09000 0.00000 -0.83000 0.00000 -4.12000 0.00000 2.38000 66.00000