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-23_1.PDB 2.77899 -15.60000 -4.03000 -7.19000 -8.88000 -3.76000 9.12000 -10.69000 0.82000 9.30000 3.40000 0.00000 0.00000 0.00000 0.17000 1.23000 0.00000 -0.61000 0.00000 -3.24000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_2.PDB 1.55229 -13.31000 -3.85000 -3.90000 -8.19000 -3.29000 8.36000 -10.16000 1.32000 6.77000 3.15000 0.00000 0.00000 0.00000 0.10000 1.15000 0.00000 -0.81000 0.00000 -2.81000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_3.PDB 1.86263 -14.04000 -3.30000 -6.67000 -8.62000 -3.28000 8.87000 -10.43000 0.30000 9.73000 3.05000 0.00000 0.00000 0.00000 0.10000 1.08000 0.00000 -0.86000 0.00000 -2.93000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_4.PDB 1.96485 -13.34000 -3.88000 -3.85000 -8.44000 -3.52000 8.40000 -10.23000 1.54000 7.27000 2.49000 0.00000 0.00000 0.00000 0.15000 1.20000 0.00000 -0.41000 0.00000 -2.87000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_5.PDB 2.96057 -14.14000 -3.90000 -4.17000 -8.44000 -4.16000 9.07000 -9.71000 0.72000 7.62000 3.28000 0.00000 0.00000 0.00000 0.12000 1.26000 0.00000 -1.02000 0.00000 -3.55000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_6.PDB 1.72392 -12.07000 -4.07000 -4.05000 -8.02000 -2.98000 8.24000 -9.57000 1.74000 6.84000 2.77000 0.00000 0.00000 0.00000 0.13000 1.20000 0.00000 -0.29000 0.00000 -2.81000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_7.PDB 2.27601 -13.72000 -4.08000 -4.09000 -8.62000 -3.58000 8.65000 -10.51000 1.42000 7.04000 3.31000 0.00000 0.00000 0.00000 0.09000 1.27000 0.00000 -0.82000 0.00000 -2.53000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_8.PDB 2.35451 -13.53000 -4.11000 -4.10000 -8.13000 -3.09000 8.43000 -9.82000 0.33000 6.95000 3.16000 0.00000 0.00000 0.00000 0.12000 1.14000 0.00000 -0.56000 0.00000 -2.70000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_9.PDB 2.55008 -13.97000 -3.92000 -3.98000 -8.02000 -3.05000 8.26000 -10.02000 0.36000 6.66000 2.96000 0.00000 0.00000 0.00000 0.10000 1.07000 0.00000 -0.87000 0.00000 -2.46000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_10.PDB 2.04115 -12.84000 -3.81000 -3.86000 -7.80000 -2.72000 7.72000 -9.87000 0.31000 6.64000 2.94000 0.00000 0.00000 0.00000 0.16000 1.02000 0.00000 -0.10000 0.00000 -2.47000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_11.PDB 1.18008 -13.09000 -3.93000 -3.97000 -7.93000 -3.90000 8.54000 -9.43000 1.38000 7.07000 3.20000 0.00000 0.00000 0.00000 0.07000 1.06000 0.00000 -0.71000 0.00000 -3.47000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_12.PDB 2.45074 -13.23000 -3.93000 -3.98000 -7.63000 -3.25000 8.22000 -9.19000 0.70000 6.50000 2.67000 0.00000 0.00000 0.00000 0.11000 1.13000 0.00000 -0.76000 0.00000 -2.70000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_13.PDB 1.63965 -13.27000 -3.92000 -3.96000 -8.48000 -2.84000 8.44000 -10.42000 0.81000 6.90000 3.30000 0.00000 0.00000 0.00000 0.09000 1.23000 0.00000 -0.73000 0.00000 -2.47000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_14.PDB 2.04205 -14.70000 -4.09000 -8.99000 -9.14000 -4.64000 10.74000 -10.26000 1.51000 11.17000 3.21000 0.00000 0.00000 0.00000 0.16000 1.13000 0.00000 -0.69000 0.00000 -3.67000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_15.PDB 2.09640 -12.64000 -3.88000 -3.90000 -7.89000 -2.53000 7.78000 -9.51000 0.57000 6.68000 2.58000 0.00000 0.00000 0.00000 0.12000 1.09000 0.00000 -0.36000 0.00000 -2.29000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_16.PDB 1.36432 -13.59000 -3.92000 -3.91000 -8.27000 -3.43000 8.28000 -9.96000 0.26000 7.21000 3.33000 0.00000 0.00000 0.00000 0.13000 1.10000 0.00000 -0.33000 0.00000 -2.99000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_17.PDB 2.02302 -12.16000 -3.89000 -3.91000 -7.75000 -2.55000 7.87000 -9.28000 0.44000 6.68000 2.58000 0.00000 0.00000 0.00000 0.13000 1.16000 0.00000 -0.05000 0.00000 -2.41000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_18.PDB 1.93293 -13.08000 -3.95000 -4.48000 -7.78000 -3.43000 8.49000 -8.76000 0.55000 7.41000 2.81000 0.00000 0.00000 0.00000 0.13000 1.15000 0.00000 -0.87000 0.00000 -3.20000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_19.PDB 1.68090 -11.99000 -3.23000 -3.22000 -7.79000 -2.44000 7.31000 -10.09000 0.14000 6.77000 3.09000 0.00000 0.00000 0.00000 0.11000 1.05000 0.00000 -0.23000 0.00000 -2.41000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_20.PDB 2.14602 -11.30000 -3.16000 -3.16000 -7.68000 -2.58000 7.59000 -9.74000 0.37000 6.88000 3.03000 0.00000 0.00000 0.00000 0.13000 1.10000 0.00000 -0.38000 0.00000 -2.60000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_21.PDB 2.64768 -14.39000 -4.00000 -4.02000 -8.56000 -3.44000 8.47000 -10.51000 0.57000 6.91000 3.12000 0.00000 0.00000 0.00000 0.12000 1.14000 0.00000 -0.79000 0.00000 -2.25000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_22.PDB 2.33321 -13.89000 -3.95000 -3.94000 -8.45000 -3.04000 8.38000 -10.32000 0.20000 6.93000 3.16000 0.00000 0.00000 0.00000 0.12000 1.27000 0.00000 -0.62000 0.00000 -2.36000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_23.PDB 2.76212 -13.26000 -3.94000 -3.94000 -8.16000 -3.29000 8.48000 -9.76000 0.70000 6.92000 2.87000 0.00000 0.00000 0.00000 0.12000 1.20000 0.00000 -0.82000 0.00000 -2.42000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_24.PDB 2.23832 -12.92000 -3.91000 -3.87000 -8.03000 -2.75000 8.00000 -9.80000 0.35000 6.74000 3.19000 0.00000 0.00000 0.00000 0.16000 1.11000 0.00000 -0.60000 0.00000 -2.41000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_25.PDB 1.73312 -14.04000 -3.91000 -3.92000 -8.31000 -3.74000 8.76000 -9.72000 0.41000 7.04000 3.20000 0.00000 0.00000 0.00000 0.12000 1.24000 0.00000 -0.96000 0.00000 -3.01000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_26.PDB 1.81738 -11.67000 -3.92000 -3.95000 -7.80000 -2.89000 7.98000 -9.35000 1.52000 6.66000 2.66000 0.00000 0.00000 0.00000 0.15000 1.15000 0.00000 -0.23000 0.00000 -2.50000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_27.PDB 2.68329 -14.15000 -4.03000 -4.88000 -8.59000 -5.04000 10.40000 -9.68000 0.49000 8.26000 2.94000 0.00000 0.00000 0.00000 0.15000 1.06000 0.00000 -0.60000 0.00000 -3.57000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_28.PDB 2.11960 -13.15000 -3.96000 -4.83000 -8.54000 -4.41000 10.18000 -9.49000 0.52000 8.34000 3.18000 0.00000 0.00000 0.00000 0.16000 1.12000 0.00000 -0.78000 0.00000 -3.50000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_29.PDB 1.82425 -12.55000 -3.84000 -3.90000 -7.78000 -2.59000 7.79000 -9.80000 0.26000 6.59000 3.18000 0.00000 0.00000 0.00000 0.11000 1.14000 0.00000 -0.12000 0.00000 -2.43000 0.00000 2.38000 64.00000 NBP2_1GCQ-23_30.PDB 2.79567 -11.81000 -3.16000 -3.15000 -7.48000 -2.85000 7.51000 -9.21000 0.47000 6.85000 1.87000 0.00000 0.00000 0.00000 0.13000 0.95000 0.00000 -0.26000 0.00000 -2.54000 0.00000 2.38000 64.00000