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-28_1.PDB 3.91177 -12.42000 -2.25000 -3.04000 -10.84000 -2.38000 10.76000 -14.14000 2.54000 6.68000 3.07000 0.00000 0.00000 0.00000 0.27000 1.18000 0.00000 -1.28000 0.00000 -1.81000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_2.PDB 2.89371 -14.83000 -3.66000 -3.84000 -11.99000 -2.99000 13.15000 -15.00000 2.09000 8.23000 2.47000 0.00000 0.00000 0.00000 0.17000 1.51000 0.00000 -1.05000 0.00000 -2.41000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_3.PDB 3.57189 -11.20000 -2.30000 -4.14000 -10.56000 -1.83000 11.20000 -13.44000 2.37000 7.21000 2.93000 0.00000 0.00000 0.00000 0.29000 1.35000 0.00000 -1.28000 0.00000 -1.65000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_4.PDB 2.42278 -14.50000 -3.05000 -4.84000 -10.80000 -2.69000 11.19000 -13.55000 1.42000 8.48000 2.44000 0.00000 0.00000 0.00000 0.22000 1.45000 0.00000 -1.07000 0.00000 -2.26000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_5.PDB 4.14927 -11.54000 -2.92000 -4.70000 -9.69000 -1.73000 10.73000 -12.09000 1.70000 6.76000 3.07000 0.00000 0.00000 0.00000 0.20000 1.04000 0.00000 -1.26000 0.00000 -1.62000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_6.PDB 2.72086 -11.02000 -2.15000 -3.97000 -9.02000 -1.75000 10.24000 -11.08000 1.54000 5.77000 1.93000 0.00000 0.00000 0.00000 0.16000 1.21000 0.00000 -1.01000 0.00000 -1.68000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_7.PDB 3.46381 -12.02000 -2.19000 -2.32000 -10.29000 -1.44000 9.97000 -13.65000 2.11000 5.62000 2.57000 0.00000 0.00000 0.00000 0.29000 1.10000 0.00000 -1.06000 0.00000 -1.62000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_8.PDB 2.76184 -11.82000 -1.37000 -1.51000 -10.38000 -1.72000 9.08000 -13.80000 1.33000 6.56000 2.38000 0.00000 0.00000 0.00000 0.19000 1.13000 0.00000 -0.77000 0.00000 -1.81000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_9.PDB 2.44302 -10.66000 -1.40000 -3.18000 -9.10000 -1.63000 9.22000 -11.56000 2.48000 5.49000 1.71000 0.00000 0.00000 0.00000 0.17000 1.14000 0.00000 -1.21000 0.00000 -1.64000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_10.PDB 2.91843 -15.76000 -4.30000 -6.87000 -10.53000 -3.71000 12.62000 -12.25000 1.93000 7.50000 3.32000 0.00000 0.00000 0.00000 0.16000 1.26000 0.00000 -1.34000 0.00000 -2.30000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_11.PDB 3.94503 -10.99000 -2.20000 -2.25000 -8.81000 -1.53000 9.07000 -11.34000 1.69000 4.73000 2.16000 0.00000 0.00000 0.00000 0.20000 1.11000 0.00000 -1.19000 0.00000 -1.52000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_12.PDB 3.91782 -12.20000 -3.04000 -3.08000 -11.54000 -1.67000 11.35000 -14.81000 1.64000 8.02000 2.96000 0.00000 0.00000 0.00000 0.19000 1.33000 0.00000 -0.85000 0.00000 -1.37000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_13.PDB 2.96174 -12.54000 -1.42000 -3.15000 -10.35000 -2.26000 9.53000 -13.70000 1.74000 7.50000 2.49000 0.00000 0.00000 0.00000 0.18000 1.02000 0.00000 -0.89000 0.00000 -2.22000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_14.PDB 2.87053 -14.94000 -2.58000 -6.47000 -10.61000 -3.26000 11.85000 -12.74000 1.79000 7.34000 2.82000 0.00000 0.00000 0.00000 0.24000 1.45000 0.00000 -1.34000 0.00000 -1.98000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_15.PDB 2.91149 -10.74000 -2.30000 -2.44000 -10.38000 -2.57000 10.65000 -13.44000 3.42000 6.00000 2.48000 0.00000 0.00000 0.00000 0.38000 1.44000 0.00000 -0.92000 0.00000 -1.62000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_16.PDB 2.90830 -12.57000 -2.31000 -2.39000 -9.88000 -2.44000 10.30000 -12.73000 1.49000 5.70000 2.32000 0.00000 0.00000 0.00000 0.30000 1.33000 0.00000 -1.34000 0.00000 -1.59000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_17.PDB 2.89436 -10.30000 -1.41000 -2.39000 -10.95000 -1.75000 10.45000 -14.10000 2.40000 7.32000 2.82000 0.00000 0.00000 0.00000 0.19000 1.25000 0.00000 -0.88000 0.00000 -2.00000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_18.PDB 3.79997 -10.23000 -2.09000 -3.88000 -9.76000 -1.54000 10.03000 -12.54000 1.60000 7.50000 2.13000 0.00000 0.00000 0.00000 0.28000 1.29000 0.00000 -0.66000 0.00000 -1.30000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_19.PDB 3.72260 -13.51000 -3.85000 -3.86000 -11.42000 -2.22000 12.02000 -14.70000 2.71000 7.16000 3.79000 0.00000 0.00000 0.00000 0.14000 1.28000 0.00000 -1.60000 0.00000 -1.68000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_20.PDB 3.34040 -9.21000 -1.40000 -1.50000 -9.19000 -1.74000 8.41000 -11.92000 2.63000 5.71000 2.12000 0.00000 0.00000 0.00000 0.10000 0.96000 0.00000 -0.60000 0.00000 -1.84000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_21.PDB 2.43033 -11.45000 -1.54000 -3.86000 -10.44000 -2.13000 10.03000 -13.45000 1.90000 8.19000 2.43000 0.00000 0.00000 0.00000 0.17000 1.53000 0.00000 -0.72000 0.00000 -2.02000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_22.PDB 3.06231 -10.55000 -1.34000 -3.14000 -9.05000 -1.76000 9.47000 -11.43000 1.94000 5.47000 1.75000 0.00000 0.00000 0.00000 0.22000 1.19000 0.00000 -0.95000 0.00000 -1.75000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_23.PDB 4.26693 -11.03000 -1.50000 -3.31000 -9.64000 -1.06000 9.39000 -12.19000 1.94000 5.70000 1.86000 0.00000 0.00000 0.00000 0.11000 0.89000 0.00000 -0.98000 0.00000 -1.37000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_24.PDB 3.74683 -12.45000 -2.27000 -2.33000 -10.19000 -1.41000 9.77000 -13.44000 1.78000 5.74000 2.60000 0.00000 0.00000 0.00000 0.23000 1.18000 0.00000 -1.27000 0.00000 -1.66000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_25.PDB 2.74259 -10.79000 -2.24000 -2.26000 -10.06000 -2.36000 10.29000 -13.04000 2.89000 5.73000 2.55000 0.00000 0.00000 0.00000 0.29000 1.40000 0.00000 -1.11000 0.00000 -1.46000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_26.PDB 3.26972 -12.04000 -2.12000 -4.80000 -11.06000 -1.72000 10.93000 -14.45000 2.41000 8.61000 2.50000 0.00000 0.00000 0.00000 0.19000 1.38000 0.00000 -0.64000 0.00000 -1.88000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_27.PDB 4.28813 -11.07000 -1.40000 -3.25000 -8.94000 -1.66000 9.36000 -11.37000 1.46000 5.60000 1.89000 0.00000 0.00000 0.00000 0.34000 1.28000 0.00000 -1.45000 0.00000 -1.64000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_28.PDB 2.71380 -11.35000 -1.50000 -4.14000 -9.80000 -1.68000 10.15000 -12.33000 2.03000 6.58000 1.85000 0.00000 0.00000 0.00000 0.28000 1.21000 0.00000 -1.16000 0.00000 -1.63000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_29.PDB 2.53232 -10.78000 -2.08000 -2.13000 -10.21000 -1.96000 10.29000 -13.25000 1.39000 6.88000 2.20000 0.00000 0.00000 0.00000 0.22000 1.58000 0.00000 -0.60000 0.00000 -1.53000 0.00000 2.38000 67.00000 NBP2_1GCQ-28_30.PDB 2.53813 -12.01000 -1.52000 -3.93000 -11.13000 -1.79000 9.93000 -14.69000 2.37000 8.25000 2.67000 0.00000 0.00000 0.00000 0.28000 1.39000 0.00000 -0.44000 0.00000 -2.01000 0.00000 2.38000 67.00000