name total energy Backbone Hbon 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 4.36000 -44.77000 -15.99000 -63.67000 -2.26000 81.38000 -80.36000 7.53000 34.46000 91.55000 0.00000 0.00000 0.00000 2.62000 21.65000 0.00000 -2.87000 0.00000 -3.24000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_2.PDB 5.23000 -43.91000 -13.79000 -62.80000 -2.08000 79.82000 -79.69000 7.56000 32.39000 91.01000 0.00000 0.00000 0.00000 2.31000 21.56000 0.00000 -2.76000 0.00000 -2.81000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_3.PDB 6.55000 -42.56000 -14.02000 -62.97000 -1.83000 80.12000 -79.71000 6.43000 34.00000 90.35000 0.00000 0.00000 0.00000 2.32000 21.33000 0.00000 -2.65000 0.00000 -2.93000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_4.PDB 5.21000 -44.81000 -14.63000 -63.09000 -2.32000 80.30000 -79.95000 7.74000 33.61000 90.92000 0.00000 0.00000 0.00000 2.56000 21.51000 0.00000 -2.24000 0.00000 -2.87000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_5.PDB 6.46000 -44.89000 -14.91000 -63.15000 -2.65000 81.38000 -79.34000 7.85000 34.22000 91.69000 0.00000 0.00000 0.00000 2.58000 21.63000 0.00000 -2.79000 0.00000 -3.55000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_6.PDB 6.25000 -44.18000 -13.94000 -63.01000 -1.94000 79.92000 -79.73000 8.03000 33.11000 90.70000 0.00000 0.00000 0.00000 2.50000 21.65000 0.00000 -2.40000 0.00000 -2.81000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_7.PDB 4.98000 -44.19000 -14.06000 -63.46000 -2.41000 80.38000 -80.33000 8.06000 32.77000 91.32000 0.00000 0.00000 0.00000 2.17000 21.73000 0.00000 -2.74000 0.00000 -2.53000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_8.PDB 5.45000 -44.16000 -13.99000 -62.60000 -1.93000 79.50000 -79.36000 7.03000 32.70000 90.91000 0.00000 0.00000 0.00000 2.57000 21.52000 0.00000 -2.52000 0.00000 -2.70000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_9.PDB 4.92000 -43.16000 -11.32000 -62.11000 -2.13000 78.47000 -79.34000 6.93000 30.71000 89.93000 0.00000 0.00000 0.00000 2.39000 21.36000 0.00000 -2.98000 0.00000 -2.46000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_10.PDB 5.16000 -43.94000 -13.85000 -62.17000 -1.58000 78.60000 -79.37000 6.62000 32.16000 90.55000 0.00000 0.00000 0.00000 2.59000 21.43000 0.00000 -2.00000 0.00000 -2.47000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_11.PDB 5.35000 -43.99000 -13.90000 -62.57000 -2.51000 80.13000 -78.97000 7.52000 32.68000 91.05000 0.00000 0.00000 0.00000 2.31000 21.41000 0.00000 -2.94000 0.00000 -3.47000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_12.PDB 6.20000 -43.92000 -13.74000 -62.17000 -2.38000 79.60000 -78.77000 6.98000 32.54000 90.41000 0.00000 0.00000 0.00000 2.58000 21.54000 0.00000 -2.23000 0.00000 -2.70000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_13.PDB 4.70000 -44.90000 -14.79000 -63.27000 -1.74000 80.39000 -80.09000 7.25000 33.37000 91.42000 0.00000 0.00000 0.00000 2.14000 21.69000 0.00000 -2.61000 0.00000 -2.47000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_14.PDB 5.73000 -43.35000 -16.34000 -63.52000 -3.23000 81.79000 -79.56000 7.71000 35.45000 90.39000 0.00000 0.00000 0.00000 2.63000 21.47000 0.00000 -2.59000 0.00000 -3.67000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_15.PDB 6.52000 -43.82000 -11.90000 -61.78000 -1.86000 78.70000 -78.65000 7.11000 30.97000 89.69000 0.00000 0.00000 0.00000 2.53000 21.39000 0.00000 -2.19000 0.00000 -2.29000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_16.PDB 4.58000 -44.04000 -13.83000 -62.63000 -2.25000 79.25000 -79.43000 6.67000 32.67000 91.09000 0.00000 0.00000 0.00000 2.55000 21.54000 0.00000 -2.49000 0.00000 -2.99000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_17.PDB 6.06000 -44.06000 -13.88000 -62.13000 -1.69000 78.94000 -78.82000 6.82000 32.64000 90.23000 0.00000 0.00000 0.00000 2.52000 21.60000 0.00000 -2.10000 0.00000 -2.41000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_18.PDB 6.52000 -44.93000 -15.23000 -62.68000 -2.27000 80.86000 -78.79000 7.30000 34.50000 91.16000 0.00000 0.00000 0.00000 2.69000 21.55000 0.00000 -2.89000 0.00000 -3.20000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_19.PDB 6.14000 -43.34000 -13.19000 -62.70000 -1.19000 79.00000 -80.06000 6.41000 32.62000 90.91000 0.00000 0.00000 0.00000 2.34000 21.44000 0.00000 -2.26000 0.00000 -2.41000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_20.PDB 7.05000 -43.29000 -13.16000 -62.41000 -1.41000 78.86000 -79.58000 6.75000 32.79000 90.80000 0.00000 0.00000 0.00000 2.69000 21.60000 0.00000 -2.38000 0.00000 -2.60000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_21.PDB 5.55000 -43.25000 -11.37000 -62.26000 -2.52000 78.60000 -79.20000 7.33000 30.80000 90.09000 0.00000 0.00000 0.00000 2.39000 21.44000 0.00000 -2.79000 0.00000 -2.25000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_22.PDB 4.58000 -44.03000 -13.89000 -62.65000 -1.99000 79.25000 -79.53000 6.60000 32.43000 90.86000 0.00000 0.00000 0.00000 2.32000 21.65000 0.00000 -2.42000 0.00000 -2.36000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_23.PDB 5.90000 -43.17000 -11.29000 -62.24000 -2.44000 78.52000 -79.16000 7.15000 31.13000 89.81000 0.00000 0.00000 0.00000 2.67000 21.49000 0.00000 -2.65000 0.00000 -2.42000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_24.PDB 5.99000 -44.08000 -12.14000 -62.21000 -1.86000 78.35000 -79.19000 6.67000 31.83000 90.88000 0.00000 0.00000 0.00000 2.76000 21.47000 0.00000 -2.60000 0.00000 -2.41000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_25.PDB 4.51000 -43.95000 -13.80000 -63.07000 -2.54000 80.26000 -79.49000 6.62000 32.68000 91.19000 0.00000 0.00000 0.00000 2.52000 21.67000 0.00000 -2.91000 0.00000 -3.01000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_26.PDB 6.70000 -43.96000 -13.84000 -62.61000 -1.99000 79.56000 -79.33000 7.82000 32.65000 90.64000 0.00000 0.00000 0.00000 2.58000 21.53000 0.00000 -2.30000 0.00000 -2.50000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_27.PDB 5.00000 -43.26000 -13.62000 -62.56000 -3.75000 80.90000 -78.66000 6.71000 32.85000 89.88000 0.00000 0.00000 0.00000 2.78000 21.34000 0.00000 -2.69000 0.00000 -3.57000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_28.PDB 5.71000 -44.01000 -14.38000 -63.10000 -3.20000 81.24000 -79.11000 6.73000 34.09000 90.95000 0.00000 0.00000 0.00000 2.86000 21.58000 0.00000 -2.87000 0.00000 -3.50000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_29.PDB 5.03000 -44.83000 -14.74000 -62.57000 -1.54000 79.58000 -79.54000 6.70000 33.12000 91.13000 0.00000 0.00000 0.00000 2.32000 21.58000 0.00000 -2.17000 0.00000 -2.43000 0.00000 0.00000 64.00000 NBP2_1GCQ-23_30.PDB 7.93000 -44.05000 -12.08000 -61.61000 -1.98000 79.26000 -78.52000 7.58000 31.94000 89.81000 0.00000 0.00000 0.00000 2.51000 21.24000 0.00000 -2.39000 0.00000 -2.54000 0.00000 0.00000 64.00000