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-17_1.PDB 3.51614 -9.07000 -2.12000 -3.24000 -8.93000 -1.51000 8.91000 -11.96000 2.01000 6.03000 3.50000 0.00000 0.00000 0.00000 0.09000 0.58000 0.00000 -0.39000 0.00000 -1.47000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_2.PDB 3.43742 -6.86000 -0.42000 -0.53000 -7.87000 -0.90000 6.87000 -10.97000 1.15000 4.03000 3.02000 0.00000 0.00000 0.00000 0.12000 0.34000 0.00000 -0.30000 0.00000 -1.08000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_3.PDB 3.14038 -8.41000 -1.19000 -1.38000 -8.79000 -1.72000 8.22000 -11.82000 1.99000 5.51000 2.71000 0.00000 0.00000 0.00000 0.10000 0.60000 0.00000 -0.30000 0.00000 -1.74000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_4.PDB 3.49919 -6.90000 -1.29000 -1.43000 -7.95000 -0.97000 7.15000 -10.93000 1.41000 5.02000 3.30000 0.00000 0.00000 0.00000 0.13000 0.33000 0.00000 -0.20000 0.00000 -1.15000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_5.PDB 3.20032 -7.07000 -0.46000 -1.38000 -8.85000 -0.56000 7.71000 -12.37000 2.00000 4.44000 3.16000 0.00000 0.00000 0.00000 0.12000 0.67000 0.00000 -0.37000 0.00000 -0.50000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_6.PDB 3.64795 -9.20000 -1.28000 -3.72000 -8.77000 -1.79000 8.44000 -11.61000 1.08000 6.87000 3.52000 0.00000 0.00000 0.00000 0.17000 0.47000 0.00000 -0.40000 0.00000 -1.70000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_7.PDB 4.10540 -7.10000 -1.30000 -2.25000 -7.94000 -1.04000 7.51000 -10.63000 1.47000 5.25000 3.36000 0.00000 0.00000 0.00000 0.07000 0.41000 0.00000 -0.40000 0.00000 -1.19000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_8.PDB 3.86373 -6.28000 -0.44000 -1.25000 -8.31000 -0.58000 7.56000 -11.44000 1.73000 4.17000 3.04000 0.00000 0.00000 0.00000 0.10000 0.57000 0.00000 -0.37000 0.00000 -0.50000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_9.PDB 3.10956 -8.28000 -0.51000 -1.71000 -7.90000 -1.52000 7.24000 -10.62000 0.75000 4.94000 3.03000 0.00000 0.00000 0.00000 0.12000 0.53000 0.00000 -0.30000 0.00000 -1.79000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_10.PDB 4.22256 -9.32000 -2.19000 -2.99000 -10.16000 -1.16000 9.86000 -13.89000 2.15000 6.65000 3.78000 0.00000 0.00000 0.00000 0.16000 0.58000 0.00000 -0.43000 0.00000 -1.11000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_11.PDB 3.04172 -8.92000 -1.36000 -3.99000 -8.53000 -1.65000 7.92000 -11.23000 0.79000 7.70000 3.23000 0.00000 0.00000 0.00000 0.10000 0.38000 0.00000 -0.30000 0.00000 -1.58000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_12.PDB 3.00389 -7.86000 -0.44000 -2.03000 -7.39000 -1.49000 6.40000 -9.99000 0.43000 5.34000 3.29000 0.00000 0.00000 0.00000 0.08000 0.22000 0.00000 -0.43000 0.00000 -1.63000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_13.PDB 3.61936 -9.45000 -1.27000 -2.17000 -9.62000 -1.64000 9.00000 -12.97000 2.00000 6.25000 3.13000 0.00000 0.00000 0.00000 0.10000 0.51000 0.00000 -0.55000 0.00000 -1.72000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_14.PDB 3.12553 -7.01000 -1.27000 -1.71000 -8.37000 -1.45000 7.78000 -11.26000 2.22000 5.52000 3.27000 0.00000 0.00000 0.00000 0.10000 0.52000 0.00000 -0.30000 0.00000 -1.55000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_15.PDB 1.97561 -9.21000 -1.40000 -2.29000 -9.62000 -1.77000 8.84000 -12.81000 2.30000 6.48000 3.08000 0.00000 0.00000 0.00000 0.11000 0.55000 0.00000 -0.49000 0.00000 -1.64000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_16.PDB 3.16857 -6.97000 -0.42000 -1.27000 -8.35000 -0.55000 7.67000 -11.52000 1.19000 4.21000 3.00000 0.00000 0.00000 0.00000 0.14000 0.45000 0.00000 -0.56000 0.00000 -0.51000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_17.PDB 3.09498 -7.22000 -0.48000 -1.47000 -8.78000 -0.56000 7.48000 -12.35000 1.81000 4.71000 3.15000 0.00000 0.00000 0.00000 0.10000 0.63000 0.00000 -0.31000 0.00000 -0.52000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_18.PDB 3.83351 -8.88000 -1.94000 -2.40000 -8.96000 -1.74000 8.72000 -12.32000 1.93000 6.21000 3.63000 0.00000 0.00000 0.00000 0.18000 0.67000 0.00000 -0.40000 0.00000 -1.80000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_19.PDB 2.88686 -7.87000 -1.34000 -2.16000 -8.20000 -1.11000 7.68000 -10.91000 0.63000 4.74000 4.23000 0.00000 0.00000 0.00000 0.12000 0.34000 0.00000 -0.40000 0.00000 -1.16000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_20.PDB 3.03969 -7.86000 -0.46000 -1.43000 -8.57000 -0.54000 7.36000 -11.79000 0.65000 4.75000 3.09000 0.00000 0.00000 0.00000 0.09000 0.50000 0.00000 -0.49000 0.00000 -0.51000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_21.PDB 3.14373 -5.41000 -0.47000 -1.28000 -8.39000 -0.64000 7.78000 -11.54000 2.46000 4.25000 3.18000 0.00000 0.00000 0.00000 0.12000 0.40000 0.00000 -0.39000 0.00000 -0.49000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_22.PDB 3.22569 -11.83000 -2.18000 -5.17000 -8.76000 -2.70000 10.56000 -10.90000 0.75000 7.09000 2.96000 0.00000 0.00000 0.00000 0.09000 0.41000 0.00000 -0.96000 0.00000 -2.61000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_23.PDB 3.52296 -10.20000 -2.15000 -3.86000 -8.44000 -1.92000 8.39000 -10.97000 0.44000 6.95000 3.18000 0.00000 0.00000 0.00000 0.15000 0.32000 0.00000 -0.37000 0.00000 -1.61000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_24.PDB 3.62479 -7.29000 -0.45000 -0.55000 -7.83000 -1.03000 6.92000 -10.91000 1.13000 3.93000 2.90000 0.00000 0.00000 0.00000 0.12000 0.33000 0.00000 -0.24000 0.00000 -1.28000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_25.PDB 3.14625 -7.20000 -0.40000 -0.40000 -7.23000 -1.37000 6.79000 -9.68000 0.43000 3.64000 3.09000 0.00000 0.00000 0.00000 0.08000 0.21000 0.00000 -0.46000 0.00000 -1.70000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_26.PDB 2.96925 -8.27000 -0.52000 -1.24000 -8.50000 -1.12000 7.85000 -11.32000 0.72000 3.66000 3.56000 0.00000 0.00000 0.00000 0.11000 0.53000 0.00000 -0.37000 0.00000 -1.09000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_27.PDB 4.09496 -9.93000 -2.04000 -2.33000 -9.61000 -1.62000 9.62000 -12.99000 1.73000 6.11000 3.07000 0.00000 0.00000 0.00000 0.16000 0.43000 0.00000 -0.46000 0.00000 -1.57000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_28.PDB 3.13590 -7.33000 -0.40000 -3.02000 -8.43000 -0.90000 7.79000 -11.35000 0.63000 5.10000 4.03000 0.00000 0.00000 0.00000 0.10000 0.47000 0.00000 -0.33000 0.00000 -0.53000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_29.PDB 4.57096 -8.45000 -1.16000 -1.92000 -9.63000 -1.14000 8.45000 -13.51000 1.64000 6.07000 4.21000 0.00000 0.00000 0.00000 0.20000 0.57000 0.00000 -0.46000 0.00000 -1.20000 0.00000 2.38000 66.00000 NBP2_1GCQ-17_30.PDB 3.77589 -7.11000 -0.43000 -1.92000 -9.76000 -0.62000 8.56000 -13.78000 2.74000 5.15000 3.51000 0.00000 0.00000 0.00000 0.16000 0.55000 0.00000 -0.21000 0.00000 -0.51000 0.00000 2.38000 66.00000