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-16_1.PDB 4.18404 -6.57000 -0.61000 -3.08000 -7.98000 -1.29000 8.23000 -10.34000 0.78000 6.23000 3.28000 0.00000 0.00000 0.00000 0.03000 0.73000 0.00000 -0.23000 0.00000 -1.58000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_2.PDB 3.55712 -8.89000 -0.90000 -3.14000 -8.26000 -1.30000 6.97000 -11.24000 0.77000 6.53000 3.45000 0.00000 0.00000 0.00000 0.09000 0.86000 0.00000 -0.31000 0.00000 -1.55000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_3.PDB 3.04664 -6.80000 -0.49000 -3.00000 -8.01000 -1.13000 7.63000 -10.76000 0.91000 6.42000 3.33000 0.00000 0.00000 0.00000 0.04000 0.68000 0.00000 -0.36000 0.00000 -1.36000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_4.PDB 3.50210 -5.89000 -0.05000 -0.80000 -7.15000 -1.82000 7.30000 -9.65000 0.32000 5.17000 3.17000 0.00000 0.00000 0.00000 0.03000 0.60000 0.00000 -0.17000 0.00000 -2.24000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_5.PDB 4.47435 -6.26000 -0.05000 -1.00000 -7.72000 -1.15000 7.08000 -10.59000 0.53000 4.99000 3.35000 0.00000 0.00000 0.00000 0.04000 0.68000 0.00000 -0.31000 0.00000 -1.43000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_6.PDB 4.08889 -6.71000 -1.26000 -6.13000 -8.32000 -2.21000 10.73000 -10.21000 2.11000 7.99000 3.30000 0.00000 0.00000 0.00000 0.13000 0.67000 0.00000 -0.37000 0.00000 -2.48000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_7.PDB 2.77976 -6.33000 -0.83000 -1.69000 -7.28000 -1.45000 6.71000 -9.84000 0.81000 5.73000 3.81000 0.00000 0.00000 0.00000 0.05000 0.55000 0.00000 -0.50000 0.00000 -1.85000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_8.PDB 3.44760 -5.41000 -0.05000 -2.64000 -7.55000 -0.64000 7.28000 -10.31000 0.51000 5.47000 3.72000 0.00000 0.00000 0.00000 0.02000 0.61000 0.00000 -0.32000 0.00000 -0.90000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_9.PDB 3.68487 -5.57000 -0.04000 -1.03000 -7.71000 -0.75000 7.14000 -10.57000 0.62000 4.59000 3.35000 0.00000 0.00000 0.00000 0.06000 0.64000 0.00000 -0.27000 0.00000 -0.98000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_10.PDB 4.04308 -5.45000 -0.04000 -0.97000 -7.00000 -1.46000 6.96000 -9.51000 0.80000 4.79000 3.11000 0.00000 0.00000 0.00000 0.02000 0.59000 0.00000 -0.29000 0.00000 -1.86000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_11.PDB 3.76785 -8.00000 -1.39000 -3.89000 -8.12000 -1.42000 8.59000 -10.40000 0.49000 6.61000 3.66000 0.00000 0.00000 0.00000 0.10000 0.77000 0.00000 -0.57000 0.00000 -1.66000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_12.PDB 3.54409 -6.88000 -0.89000 -3.43000 -7.51000 -1.22000 7.82000 -9.82000 0.42000 6.25000 3.47000 0.00000 0.00000 0.00000 0.03000 0.71000 0.00000 -0.43000 0.00000 -1.57000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_13.PDB 3.83677 -7.55000 -0.05000 -2.55000 -8.20000 -1.12000 7.55000 -11.09000 0.70000 5.56000 3.37000 0.00000 0.00000 0.00000 0.05000 0.83000 0.00000 -0.31000 0.00000 -1.44000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_14.PDB 3.43394 -5.75000 -0.04000 -2.76000 -8.20000 -0.84000 8.18000 -10.71000 0.78000 6.00000 3.45000 0.00000 0.00000 0.00000 0.04000 0.74000 0.00000 -0.44000 0.00000 -1.21000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_15.PDB 3.49267 -6.00000 -0.04000 -3.38000 -7.87000 -1.15000 7.94000 -10.32000 0.78000 6.44000 3.36000 0.00000 0.00000 0.00000 0.02000 0.67000 0.00000 -0.44000 0.00000 -1.36000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_16.PDB 1.17106 -7.00000 -0.58000 -3.07000 -8.22000 -1.40000 8.36000 -10.77000 0.88000 6.46000 3.26000 0.00000 0.00000 0.00000 0.03000 0.73000 0.00000 -0.32000 0.00000 -1.63000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_17.PDB 3.62873 -9.51000 -0.89000 -3.44000 -8.52000 -1.54000 8.58000 -11.15000 1.51000 5.66000 2.53000 0.00000 0.00000 0.00000 0.05000 0.97000 0.00000 -0.46000 0.00000 -1.83000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_18.PDB 2.80313 -4.70000 -0.04000 -0.91000 -7.90000 -0.94000 7.92000 -10.59000 0.56000 5.07000 4.04000 0.00000 0.00000 0.00000 0.02000 0.69000 0.00000 -0.67000 0.00000 -1.26000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_19.PDB 3.86263 -5.58000 -0.04000 -1.67000 -7.66000 -1.55000 7.62000 -10.37000 0.94000 5.75000 3.48000 0.00000 0.00000 0.00000 0.05000 0.59000 0.00000 -0.37000 0.00000 -1.74000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_20.PDB 3.27339 -5.49000 -0.57000 -2.10000 -8.00000 -0.86000 7.73000 -10.62000 1.61000 5.45000 3.18000 0.00000 0.00000 0.00000 0.07000 0.67000 0.00000 -0.30000 0.00000 -1.08000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_21.PDB 2.76083 -8.39000 -0.60000 -2.77000 -8.06000 -1.40000 7.88000 -10.83000 0.84000 5.77000 2.71000 0.00000 0.00000 0.00000 0.03000 0.79000 0.00000 -0.32000 0.00000 -1.65000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_22.PDB 2.32749 -6.50000 -0.04000 -0.97000 -7.58000 -1.25000 6.91000 -10.46000 0.43000 4.87000 3.26000 0.00000 0.00000 0.00000 0.04000 0.60000 0.00000 -0.17000 0.00000 -1.55000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_23.PDB 3.43322 -5.04000 -0.04000 -2.68000 -7.90000 -0.83000 8.02000 -10.51000 0.70000 5.93000 3.72000 0.00000 0.00000 0.00000 0.03000 0.67000 0.00000 -0.39000 0.00000 -1.11000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_24.PDB 3.03450 -6.76000 -0.87000 -1.79000 -7.40000 -1.65000 7.47000 -9.80000 0.43000 5.78000 3.49000 0.00000 0.00000 0.00000 0.02000 0.72000 0.00000 -0.31000 0.00000 -2.13000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_25.PDB 3.15005 -5.56000 -0.05000 -0.89000 -7.61000 -1.32000 7.90000 -10.33000 0.11000 5.33000 3.16000 0.00000 0.00000 0.00000 0.04000 0.65000 0.00000 -0.33000 0.00000 -1.56000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_26.PDB 2.24941 -6.20000 -0.04000 -1.04000 -7.89000 -1.26000 7.56000 -10.78000 0.44000 5.16000 3.17000 0.00000 0.00000 0.00000 0.06000 0.60000 0.00000 -0.15000 0.00000 -1.44000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_27.PDB 3.04809 -6.17000 -0.49000 -2.10000 -8.08000 -0.69000 7.58000 -10.88000 1.40000 4.85000 3.29000 0.00000 0.00000 0.00000 0.10000 0.64000 0.00000 -0.40000 0.00000 -0.75000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_28.PDB 2.85705 -6.81000 -1.44000 -2.34000 -8.24000 -2.58000 8.76000 -10.36000 1.81000 7.61000 3.32000 0.00000 0.00000 0.00000 0.03000 0.78000 0.00000 -0.45000 0.00000 -2.93000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_29.PDB 4.59778 -8.51000 -1.54000 -3.92000 -8.44000 -2.16000 9.52000 -10.62000 0.57000 7.87000 3.09000 0.00000 0.00000 0.00000 0.05000 0.73000 0.00000 -0.38000 0.00000 -2.56000 0.00000 2.38000 66.00000 NBP2_1GCQ-16_30.PDB 2.26326 -7.20000 -0.05000 -2.70000 -7.64000 -1.41000 7.50000 -10.09000 0.73000 5.50000 2.92000 0.00000 0.00000 0.00000 0.07000 0.78000 0.00000 -0.20000 0.00000 -1.83000 0.00000 2.38000 66.00000