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-19_1.PDB 2.95146 -6.32000 -1.46000 -3.96000 -8.34000 -1.44000 9.65000 -10.92000 1.35000 5.91000 4.64000 0.00000 0.00000 0.00000 0.09000 0.24000 0.00000 0.05000 0.00000 -1.89000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_2.PDB 2.83958 -7.64000 -1.76000 -2.42000 -9.49000 -1.91000 9.93000 -12.99000 1.34000 7.00000 4.83000 0.00000 0.00000 0.00000 0.09000 0.46000 0.00000 -0.27000 0.00000 -1.98000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_3.PDB 2.82998 -8.09000 -1.25000 -2.54000 -9.34000 -2.54000 10.16000 -12.18000 1.37000 7.30000 4.06000 0.00000 0.00000 0.00000 0.11000 0.47000 0.00000 -0.32000 0.00000 -2.93000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_4.PDB 4.07181 -9.96000 -1.69000 -4.94000 -9.10000 -2.26000 10.04000 -11.62000 0.71000 6.96000 4.81000 0.00000 0.00000 0.00000 0.12000 0.50000 0.00000 -0.81000 0.00000 -2.19000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_5.PDB 3.51360 -9.24000 -1.26000 -3.80000 -9.88000 -2.08000 10.11000 -13.25000 1.30000 7.39000 4.74000 0.00000 0.00000 0.00000 0.21000 0.55000 0.00000 -0.56000 0.00000 -2.17000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_6.PDB 2.77481 -8.87000 -1.26000 -2.10000 -8.93000 -2.25000 9.03000 -12.06000 1.29000 6.30000 4.17000 0.00000 0.00000 0.00000 0.09000 0.41000 0.00000 -0.64000 0.00000 -2.51000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_7.PDB 3.18145 -6.95000 -0.43000 -1.22000 -9.05000 -1.81000 9.58000 -11.50000 1.31000 4.54000 3.96000 0.00000 0.00000 0.00000 0.15000 0.17000 0.00000 -0.36000 0.00000 -2.11000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_8.PDB 4.10768 -8.99000 -1.09000 -1.85000 -8.73000 -2.28000 8.86000 -11.12000 0.87000 5.69000 3.83000 0.00000 0.00000 0.00000 0.04000 0.30000 0.00000 -0.52000 0.00000 -2.69000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_9.PDB 2.08699 -6.81000 -1.11000 -1.78000 -8.24000 -2.32000 9.16000 -10.44000 1.21000 6.01000 4.02000 0.00000 0.00000 0.00000 0.07000 0.27000 0.00000 -0.62000 0.00000 -2.76000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_10.PDB 4.49593 -14.64000 -2.64000 -3.97000 -12.03000 -4.91000 13.86000 -14.55000 1.10000 8.71000 4.22000 0.00000 0.00000 0.00000 0.11000 0.87000 0.00000 -0.70000 0.00000 -3.83000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_11.PDB 3.92429 -7.57000 -1.31000 -1.94000 -9.01000 -1.62000 9.61000 -12.12000 1.21000 6.08000 3.98000 0.00000 0.00000 0.00000 0.23000 0.55000 0.00000 -0.71000 0.00000 -1.96000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_12.PDB 3.78586 -11.84000 -1.69000 -2.45000 -10.00000 -3.97000 10.93000 -12.39000 0.87000 6.80000 4.21000 0.00000 0.00000 0.00000 0.04000 0.60000 0.00000 -0.79000 0.00000 -3.41000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_13.PDB 2.74888 -8.60000 -1.34000 -1.44000 -8.98000 -2.18000 9.16000 -11.82000 1.23000 5.72000 3.77000 0.00000 0.00000 0.00000 0.19000 0.68000 0.00000 -0.67000 0.00000 -2.24000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_14.PDB 3.28809 -5.18000 -0.47000 -0.86000 -9.10000 -1.39000 8.72000 -12.62000 2.95000 5.23000 4.09000 0.00000 0.00000 0.00000 0.09000 0.20000 0.00000 -0.28000 0.00000 -1.55000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_15.PDB 4.31541 -7.98000 -0.43000 -1.06000 -8.96000 -1.94000 8.51000 -12.35000 1.65000 5.30000 3.55000 0.00000 0.00000 0.00000 0.20000 0.35000 0.00000 -0.21000 0.00000 -2.24000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_16.PDB 3.16543 -8.75000 -2.40000 -2.49000 -10.59000 -1.73000 11.12000 -14.12000 1.59000 7.29000 4.66000 0.00000 0.00000 0.00000 0.15000 0.72000 0.00000 -0.44000 0.00000 -1.79000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_17.PDB 2.98063 -9.54000 -1.34000 -2.30000 -9.58000 -1.60000 8.84000 -13.38000 1.77000 6.10000 4.09000 0.00000 0.00000 0.00000 0.13000 0.62000 0.00000 -0.62000 0.00000 -1.65000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_18.PDB 2.81623 -7.72000 -1.68000 -3.72000 -9.13000 -1.75000 9.74000 -12.26000 1.58000 7.14000 4.81000 0.00000 0.00000 0.00000 0.12000 0.34000 0.00000 -0.42000 0.00000 -2.15000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_19.PDB 2.38239 -6.74000 -1.26000 -2.34000 -8.11000 -1.68000 8.79000 -10.81000 1.34000 5.56000 4.17000 0.00000 0.00000 0.00000 0.08000 0.25000 0.00000 -0.51000 0.00000 -1.97000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_20.PDB 2.62475 -7.05000 -1.86000 -2.52000 -9.16000 -2.07000 10.62000 -12.34000 1.54000 6.27000 4.66000 0.00000 0.00000 0.00000 0.10000 0.57000 0.00000 -0.48000 0.00000 -1.82000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_21.PDB 3.19818 -8.53000 -0.99000 -3.33000 -8.55000 -2.11000 9.34000 -11.09000 0.66000 5.89000 4.35000 0.00000 0.00000 0.00000 0.05000 0.32000 0.00000 -0.24000 0.00000 -2.52000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_22.PDB 3.41699 -5.98000 -0.97000 -3.44000 -10.11000 -1.26000 11.31000 -13.54000 1.66000 6.87000 4.93000 0.00000 0.00000 0.00000 0.12000 0.59000 0.00000 0.02000 0.00000 -1.57000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_23.PDB 3.03765 -11.10000 -1.20000 -2.02000 -10.72000 -2.97000 11.08000 -13.54000 0.73000 6.25000 4.21000 0.00000 0.00000 0.00000 0.05000 0.94000 0.00000 -0.26000 0.00000 -2.71000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_24.PDB 3.67584 -8.51000 -1.28000 -1.85000 -8.43000 -1.72000 8.58000 -11.20000 0.50000 5.46000 4.39000 0.00000 0.00000 0.00000 0.02000 0.29000 0.00000 -0.79000 0.00000 -2.19000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_25.PDB 3.88816 -8.36000 -1.70000 -4.81000 -10.52000 -1.82000 11.92000 -13.84000 1.10000 8.67000 4.86000 0.00000 0.00000 0.00000 0.07000 0.64000 0.00000 -0.16000 0.00000 -2.13000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_26.PDB 2.51484 -6.30000 -1.15000 -1.95000 -9.25000 -1.76000 10.13000 -12.28000 1.40000 6.57000 4.52000 0.00000 0.00000 0.00000 0.11000 0.40000 0.00000 -0.53000 0.00000 -2.10000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_27.PDB 4.00012 -7.67000 -1.50000 -2.17000 -9.82000 -2.15000 11.04000 -12.71000 0.71000 6.75000 4.70000 0.00000 0.00000 0.00000 0.09000 0.91000 0.00000 -0.13000 0.00000 -2.48000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_28.PDB 2.37687 -9.97000 -1.25000 -5.47000 -9.14000 -3.13000 10.89000 -11.71000 1.30000 8.21000 4.20000 0.00000 0.00000 0.00000 0.08000 0.42000 0.00000 -0.80000 0.00000 -3.13000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_29.PDB 3.62139 -8.86000 -1.37000 -1.41000 -9.09000 -2.54000 9.38000 -11.82000 0.97000 5.85000 3.75000 0.00000 0.00000 0.00000 0.24000 0.63000 0.00000 -0.36000 0.00000 -2.44000 0.00000 2.38000 66.00000 NBP2_1GCQ-19_30.PDB 2.28998 -7.96000 -1.26000 -3.58000 -9.44000 -1.98000 10.05000 -12.55000 1.67000 7.49000 4.47000 0.00000 0.00000 0.00000 0.08000 0.45000 0.00000 -0.49000 0.00000 -2.42000 0.00000 2.38000 66.00000