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_1SEM-12_1.PDB 2.51048 -8.03000 -0.32000 -1.97000 -6.12000 -0.62000 3.45000 -9.12000 0.40000 4.83000 2.39000 0.00000 0.00000 0.00000 0.07000 0.58000 0.00000 -0.28000 0.00000 -0.73000 0.00000 2.38000 65.00000 NBP2_1SEM-12_2.PDB 3.48076 -7.78000 -0.29000 -0.37000 -6.31000 -0.44000 3.77000 -9.27000 0.16000 3.19000 2.51000 0.00000 0.00000 0.00000 0.09000 0.60000 0.00000 -0.21000 0.00000 -0.60000 0.00000 2.38000 65.00000 NBP2_1SEM-12_3.PDB 2.36932 -7.89000 -0.34000 -0.42000 -6.15000 -0.70000 3.39000 -9.20000 0.37000 3.79000 2.41000 0.00000 0.00000 0.00000 0.09000 0.55000 0.00000 -0.20000 0.00000 -0.95000 0.00000 2.38000 65.00000 NBP2_1SEM-12_4.PDB 1.95876 -7.93000 -0.31000 -1.94000 -6.14000 -0.66000 3.58000 -9.06000 0.15000 4.70000 2.68000 0.00000 0.00000 0.00000 0.08000 0.59000 0.00000 -0.26000 0.00000 -0.74000 0.00000 2.38000 65.00000 NBP2_1SEM-12_5.PDB 2.27034 -7.44000 -0.36000 -2.00000 -6.17000 -0.46000 3.62000 -9.13000 0.44000 4.76000 2.62000 0.00000 0.00000 0.00000 0.08000 0.56000 0.00000 -0.28000 0.00000 -0.55000 0.00000 2.38000 65.00000 NBP2_1SEM-12_6.PDB 1.93803 -7.16000 -0.33000 -2.00000 -5.93000 -0.38000 3.43000 -8.78000 0.15000 4.53000 2.81000 0.00000 0.00000 0.00000 0.08000 0.44000 0.00000 -0.30000 0.00000 -0.44000 0.00000 2.38000 65.00000 NBP2_1SEM-12_7.PDB 3.03583 -7.16000 -0.33000 -0.36000 -5.84000 -0.64000 3.62000 -8.59000 0.39000 3.23000 2.43000 0.00000 0.00000 0.00000 0.06000 0.56000 0.00000 -0.24000 0.00000 -0.88000 0.00000 2.38000 65.00000 NBP2_1SEM-12_8.PDB 2.14380 -7.86000 -0.33000 -0.42000 -6.07000 -0.61000 3.39000 -9.06000 0.15000 3.53000 2.49000 0.00000 0.00000 0.00000 0.09000 0.57000 0.00000 -0.24000 0.00000 -0.79000 0.00000 2.38000 65.00000 NBP2_1SEM-12_9.PDB 2.20207 -7.56000 -0.35000 -0.40000 -6.15000 -0.38000 3.37000 -9.21000 0.24000 3.55000 2.44000 0.00000 0.00000 0.00000 0.11000 0.52000 0.00000 -0.25000 0.00000 -0.54000 0.00000 2.38000 65.00000 NBP2_1SEM-12_10.PDB 3.95732 -7.28000 -0.21000 -0.28000 -6.51000 -0.39000 3.92000 -9.55000 0.46000 3.11000 2.52000 0.00000 0.00000 0.00000 0.40000 0.65000 0.00000 -0.19000 0.00000 -0.56000 0.00000 2.38000 65.00000 NBP2_1SEM-12_11.PDB 3.19586 -7.39000 -0.35000 -0.44000 -5.73000 -0.44000 3.56000 -8.35000 0.08000 2.85000 2.31000 0.00000 0.00000 0.00000 0.07000 0.64000 0.00000 -0.29000 0.00000 -0.67000 0.00000 2.38000 65.00000 NBP2_1SEM-12_12.PDB 1.76345 -7.30000 -0.23000 -1.93000 -5.95000 -0.41000 3.51000 -8.79000 0.09000 4.53000 2.59000 0.00000 0.00000 0.00000 0.05000 0.40000 0.00000 -0.35000 0.00000 -0.43000 0.00000 2.38000 65.00000 NBP2_1SEM-12_13.PDB 3.44401 -7.84000 -0.29000 -0.37000 -6.40000 -0.53000 3.84000 -9.40000 0.27000 3.12000 2.59000 0.00000 0.00000 0.00000 0.30000 0.63000 0.00000 -0.21000 0.00000 -0.76000 0.00000 2.38000 65.00000 NBP2_1SEM-12_14.PDB 1.72124 -7.33000 -0.30000 -2.05000 -6.08000 -0.43000 3.59000 -8.95000 0.13000 4.62000 2.85000 0.00000 0.00000 0.00000 0.08000 0.53000 0.00000 -0.31000 0.00000 -0.49000 0.00000 2.38000 65.00000 NBP2_1SEM-12_15.PDB 1.97791 -7.15000 -0.29000 -0.36000 -6.08000 -0.27000 3.59000 -8.97000 0.15000 3.26000 2.43000 0.00000 0.00000 0.00000 0.08000 0.59000 0.00000 -0.28000 0.00000 -0.41000 0.00000 2.38000 65.00000 NBP2_1SEM-12_16.PDB 1.88893 -7.01000 -0.33000 -1.91000 -5.11000 -0.62000 2.92000 -7.54000 0.05000 4.20000 2.31000 0.00000 0.00000 0.00000 0.06000 0.41000 0.00000 -0.30000 0.00000 -0.74000 0.00000 2.38000 65.00000 NBP2_1SEM-12_17.PDB 3.27168 -8.18000 -0.20000 -0.26000 -6.55000 -0.29000 3.70000 -9.70000 0.15000 3.00000 2.38000 0.00000 0.00000 0.00000 0.17000 0.63000 0.00000 -0.19000 0.00000 -0.39000 0.00000 2.38000 65.00000 NBP2_1SEM-12_18.PDB 2.29580 -7.53000 -0.33000 -1.87000 -5.35000 -0.61000 3.05000 -8.03000 0.11000 4.29000 2.12000 0.00000 0.00000 0.00000 0.05000 0.24000 0.00000 -0.21000 0.00000 -0.75000 0.00000 2.38000 65.00000 NBP2_1SEM-12_19.PDB 4.46888 -7.43000 -0.33000 -0.40000 -5.58000 -0.56000 3.22000 -8.34000 0.38000 2.75000 2.18000 0.00000 0.00000 0.00000 0.23000 0.38000 0.00000 -0.21000 0.00000 -0.78000 0.00000 2.38000 65.00000 NBP2_1SEM-12_20.PDB 2.18809 -7.54000 -0.33000 -0.41000 -6.10000 -0.54000 3.57000 -9.04000 0.19000 3.58000 2.35000 0.00000 0.00000 0.00000 0.11000 0.61000 0.00000 -0.19000 0.00000 -0.72000 0.00000 2.38000 65.00000 NBP2_1SEM-12_21.PDB 3.07650 -7.52000 -0.35000 -0.41000 -5.99000 -0.34000 3.61000 -8.74000 0.16000 2.69000 2.46000 0.00000 0.00000 0.00000 0.22000 0.71000 0.00000 -0.32000 0.00000 -0.50000 0.00000 2.38000 65.00000 NBP2_1SEM-12_22.PDB 4.65437 -6.75000 -0.31000 -1.65000 -6.48000 -0.35000 4.28000 -9.39000 0.68000 3.85000 2.78000 0.00000 0.00000 0.00000 0.47000 0.68000 0.00000 -0.21000 0.00000 -0.43000 0.00000 2.38000 65.00000 NBP2_1SEM-12_23.PDB 3.91967 -6.55000 -0.34000 -1.74000 -5.77000 -0.61000 3.84000 -8.41000 0.39000 3.91000 2.61000 0.00000 0.00000 0.00000 0.33000 0.62000 0.00000 -0.26000 0.00000 -0.49000 0.00000 2.38000 65.00000 NBP2_1SEM-12_24.PDB 3.00533 -7.15000 -0.23000 -0.25000 -5.53000 -0.39000 3.17000 -8.11000 0.32000 2.57000 1.96000 0.00000 0.00000 0.00000 0.08000 0.46000 0.00000 -0.16000 0.00000 -0.58000 0.00000 2.38000 65.00000 NBP2_1SEM-12_25.PDB 1.92939 -7.82000 -0.25000 -0.28000 -6.34000 -0.42000 3.50000 -9.46000 0.08000 3.58000 2.54000 0.00000 0.00000 0.00000 0.11000 0.56000 0.00000 -0.25000 0.00000 -0.63000 0.00000 2.38000 65.00000 NBP2_1SEM-12_26.PDB 1.61213 -7.03000 -0.35000 -1.98000 -5.26000 -0.62000 3.01000 -7.73000 0.16000 4.19000 2.49000 0.00000 0.00000 0.00000 0.07000 0.41000 0.00000 -0.25000 0.00000 -0.75000 0.00000 2.38000 65.00000 NBP2_1SEM-12_27.PDB 2.10332 -7.67000 -0.33000 -2.10000 -6.28000 -0.49000 3.79000 -9.26000 0.25000 4.85000 2.68000 0.00000 0.00000 0.00000 0.08000 0.59000 0.00000 -0.36000 0.00000 -0.54000 0.00000 2.38000 65.00000 NBP2_1SEM-12_28.PDB 1.83118 -7.16000 -0.30000 -1.77000 -5.41000 -0.45000 3.08000 -8.10000 0.09000 4.17000 2.28000 0.00000 0.00000 0.00000 0.05000 0.19000 0.00000 -0.26000 0.00000 -0.54000 0.00000 2.38000 65.00000 NBP2_1SEM-12_29.PDB 4.23015 -7.25000 -0.34000 -0.44000 -6.35000 -0.34000 3.86000 -9.33000 0.60000 3.02000 2.47000 0.00000 0.00000 0.00000 0.34000 0.66000 0.00000 -0.26000 0.00000 -0.48000 0.00000 2.38000 65.00000 NBP2_1SEM-12_30.PDB 1.77178 -7.70000 -0.30000 -1.82000 -6.07000 -0.60000 3.62000 -8.92000 0.04000 4.65000 2.57000 0.00000 0.00000 0.00000 0.07000 0.57000 0.00000 -0.26000 0.00000 -0.70000 0.00000 2.38000 65.00000