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-5_1.PDB 4.32481 -13.99000 -2.27000 -3.14000 -11.71000 -3.84000 11.88000 -14.90000 3.35000 6.32000 3.80000 0.00000 0.00000 0.00000 0.27000 1.53000 0.00000 -1.08000 0.00000 -2.66000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_2.PDB 3.61110 -12.85000 -2.33000 -4.55000 -11.52000 -2.29000 11.12000 -15.47000 3.18000 7.72000 3.86000 0.00000 0.00000 0.00000 0.27000 1.40000 0.00000 -0.79000 0.00000 -2.05000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_3.PDB 3.80247 -12.67000 -2.36000 -3.12000 -10.92000 -3.06000 10.96000 -14.17000 3.47000 6.34000 3.47000 0.00000 0.00000 0.00000 0.33000 1.32000 0.00000 -1.22000 0.00000 -2.38000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_4.PDB 3.76111 -13.48000 -2.32000 -3.18000 -11.60000 -3.61000 11.62000 -14.90000 4.34000 6.23000 3.76000 0.00000 0.00000 0.00000 0.32000 1.61000 0.00000 -1.42000 0.00000 -2.72000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_5.PDB 3.90856 -13.10000 -2.27000 -3.97000 -11.72000 -2.31000 10.69000 -16.03000 3.74000 7.28000 4.28000 0.00000 0.00000 0.00000 0.31000 1.56000 0.00000 -0.84000 0.00000 -2.25000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_6.PDB 3.68311 -12.54000 -1.49000 -2.09000 -10.83000 -2.21000 9.67000 -14.55000 3.40000 4.69000 3.15000 0.00000 0.00000 0.00000 0.31000 1.55000 0.00000 -0.60000 0.00000 -1.99000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_7.PDB 3.81917 -12.66000 -2.35000 -4.55000 -11.07000 -2.55000 11.11000 -14.43000 2.27000 7.86000 3.60000 0.00000 0.00000 0.00000 0.28000 1.46000 0.00000 -0.51000 0.00000 -2.33000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_8.PDB 4.50785 -13.91000 -2.28000 -3.05000 -12.00000 -3.50000 11.86000 -15.71000 3.26000 6.85000 4.14000 0.00000 0.00000 0.00000 0.36000 1.34000 0.00000 -1.37000 0.00000 -2.47000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_9.PDB 4.25585 -13.16000 -2.32000 -3.14000 -12.08000 -3.29000 11.92000 -15.67000 4.22000 6.31000 4.25000 0.00000 0.00000 0.00000 0.33000 1.53000 0.00000 -1.32000 0.00000 -2.37000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_10.PDB 3.62458 -12.07000 -1.48000 -2.32000 -11.72000 -2.54000 10.94000 -15.47000 4.07000 5.09000 3.58000 0.00000 0.00000 0.00000 0.28000 1.49000 0.00000 -0.56000 0.00000 -1.95000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_11.PDB 3.79440 -12.05000 -1.41000 -2.95000 -10.50000 -2.26000 9.77000 -14.13000 2.90000 5.88000 3.00000 0.00000 0.00000 0.00000 0.28000 1.40000 0.00000 -0.54000 0.00000 -2.08000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_12.PDB 3.97654 -13.61000 -2.35000 -3.21000 -11.71000 -3.57000 11.74000 -15.37000 3.70000 6.75000 4.11000 0.00000 0.00000 0.00000 0.40000 1.35000 0.00000 -1.39000 0.00000 -2.71000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_13.PDB 3.81629 -11.91000 -1.48000 -3.08000 -10.23000 -2.47000 9.52000 -13.90000 3.23000 6.00000 3.08000 0.00000 0.00000 0.00000 0.27000 1.50000 0.00000 -0.50000 0.00000 -2.34000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_14.PDB 4.61133 -13.73000 -2.34000 -3.17000 -11.59000 -3.87000 11.73000 -14.83000 3.89000 6.28000 3.85000 0.00000 0.00000 0.00000 0.37000 1.71000 0.00000 -1.03000 0.00000 -3.02000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_15.PDB 4.94816 -12.75000 -2.17000 -4.41000 -11.19000 -2.63000 11.08000 -14.68000 2.51000 7.99000 3.60000 0.00000 0.00000 0.00000 0.30000 1.50000 0.00000 -0.58000 0.00000 -2.55000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_16.PDB 3.62529 -11.66000 -1.52000 -2.29000 -10.95000 -2.29000 10.10000 -14.44000 4.03000 4.88000 2.94000 0.00000 0.00000 0.00000 0.30000 1.52000 0.00000 -0.55000 0.00000 -1.87000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_17.PDB 3.80461 -13.62000 -2.30000 -3.14000 -11.85000 -3.43000 11.74000 -15.49000 3.90000 6.39000 4.04000 0.00000 0.00000 0.00000 0.26000 1.54000 0.00000 -1.22000 0.00000 -2.51000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_18.PDB 3.97397 -13.00000 -2.31000 -3.15000 -11.37000 -3.66000 11.47000 -14.57000 4.21000 6.17000 3.58000 0.00000 0.00000 0.00000 0.34000 1.56000 0.00000 -0.97000 0.00000 -2.73000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_19.PDB 4.81081 -13.78000 -1.49000 -3.24000 -11.41000 -2.70000 10.89000 -15.29000 2.30000 5.94000 3.82000 0.00000 0.00000 0.00000 0.33000 1.61000 0.00000 -0.58000 0.00000 -2.35000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_20.PDB 4.82995 -13.34000 -1.49000 -1.47000 -11.80000 -3.64000 11.49000 -15.39000 3.34000 4.66000 3.81000 0.00000 0.00000 0.00000 0.34000 1.67000 0.00000 -0.84000 0.00000 -2.35000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_21.PDB 3.71873 -13.50000 -2.30000 -4.58000 -11.56000 -2.75000 11.59000 -15.36000 2.95000 7.93000 4.00000 0.00000 0.00000 0.00000 0.31000 1.56000 0.00000 -1.27000 0.00000 -2.44000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_22.PDB 4.90016 -14.71000 -2.29000 -3.04000 -11.86000 -3.44000 11.83000 -15.76000 2.32000 6.67000 4.35000 0.00000 0.00000 0.00000 0.29000 1.45000 0.00000 -1.22000 0.00000 -2.56000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_23.PDB 3.73153 -13.35000 -2.30000 -3.12000 -11.37000 -3.77000 11.54000 -14.57000 4.10000 6.14000 3.59000 0.00000 0.00000 0.00000 0.33000 1.64000 0.00000 -1.12000 0.00000 -2.79000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_24.PDB 4.12416 -13.80000 -2.42000 -3.05000 -11.19000 -3.23000 11.08000 -14.67000 3.23000 6.46000 3.61000 0.00000 0.00000 0.00000 0.30000 1.58000 0.00000 -1.30000 0.00000 -2.62000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_25.PDB 4.30009 -13.20000 -3.03000 -3.85000 -11.95000 -2.99000 12.27000 -15.48000 3.55000 7.28000 4.14000 0.00000 0.00000 0.00000 0.30000 1.42000 0.00000 -1.08000 0.00000 -2.35000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_26.PDB 3.64517 -11.76000 -2.26000 -3.81000 -10.91000 -2.18000 10.52000 -14.49000 2.80000 6.71000 3.94000 0.00000 0.00000 0.00000 0.26000 1.37000 0.00000 -0.41000 0.00000 -1.92000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_27.PDB 4.60057 -13.28000 -2.20000 -3.81000 -10.93000 -2.58000 10.50000 -14.93000 2.38000 7.03000 3.98000 0.00000 0.00000 0.00000 0.32000 1.51000 0.00000 -0.61000 0.00000 -2.42000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_28.PDB 4.41836 -12.52000 -2.34000 -3.16000 -11.36000 -3.01000 11.47000 -14.59000 4.15000 6.08000 3.52000 0.00000 0.00000 0.00000 0.31000 1.46000 0.00000 -1.28000 0.00000 -2.31000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_29.PDB 4.48567 -13.82000 -2.99000 -4.93000 -11.74000 -2.27000 11.84000 -15.44000 2.68000 7.90000 3.96000 0.00000 0.00000 0.00000 0.26000 1.54000 0.00000 -1.03000 0.00000 -2.04000 0.00000 2.38000 67.00000 NBP2_1GCQ-5_30.PDB 4.67065 -13.40000 -1.55000 -3.21000 -11.17000 -2.50000 10.39000 -15.29000 2.90000 6.06000 3.67000 0.00000 0.00000 0.00000 0.37000 1.24000 0.00000 -0.84000 0.00000 -2.22000 0.00000 2.38000 67.00000