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-20_1.PDB 2.18406 -10.18000 -1.72000 -3.30000 -9.61000 -4.45000 11.33000 -11.26000 0.96000 8.84000 4.53000 0.00000 0.00000 0.00000 0.10000 0.55000 0.00000 -1.35000 0.00000 -4.27000 0.00000 2.38000 66.00000 NBP2_1SEM-20_2.PDB 1.82981 -8.86000 -1.77000 -3.26000 -9.83000 -3.77000 12.23000 -11.88000 0.80000 8.51000 4.88000 0.00000 0.00000 0.00000 0.06000 0.58000 0.00000 -1.30000 0.00000 -3.52000 0.00000 2.38000 66.00000 NBP2_1SEM-20_3.PDB 3.08446 -14.62000 -2.43000 -6.65000 -10.84000 -4.99000 13.77000 -12.52000 1.34000 8.92000 4.36000 0.00000 0.00000 0.00000 0.12000 0.70000 0.00000 -1.06000 0.00000 -4.63000 0.00000 2.38000 66.00000 NBP2_1SEM-20_4.PDB 2.69041 -8.26000 -1.75000 -2.61000 -8.29000 -2.88000 9.38000 -9.98000 0.30000 6.99000 4.40000 0.00000 0.00000 0.00000 0.09000 0.29000 0.00000 -0.82000 0.00000 -3.09000 0.00000 2.38000 66.00000 NBP2_1SEM-20_5.PDB 2.22760 -8.70000 -1.64000 -2.64000 -9.32000 -3.56000 10.66000 -10.87000 0.71000 7.67000 4.68000 0.00000 0.00000 0.00000 0.07000 0.57000 0.00000 -0.98000 0.00000 -3.48000 0.00000 2.38000 66.00000 NBP2_1SEM-20_6.PDB 1.69979 -11.33000 -2.31000 -4.05000 -10.68000 -3.94000 12.40000 -12.49000 0.69000 9.05000 5.19000 0.00000 0.00000 0.00000 0.04000 0.64000 0.00000 -1.47000 0.00000 -3.75000 0.00000 2.38000 66.00000 NBP2_1SEM-20_7.PDB 2.31181 -9.44000 -1.64000 -2.60000 -8.87000 -2.90000 9.44000 -11.02000 0.45000 7.27000 4.18000 0.00000 0.00000 0.00000 0.07000 0.47000 0.00000 -0.82000 0.00000 -3.02000 0.00000 2.38000 66.00000 NBP2_1SEM-20_8.PDB 2.26822 -10.80000 -2.18000 -4.41000 -10.62000 -3.17000 12.23000 -12.85000 0.60000 9.28000 4.62000 0.00000 0.00000 0.00000 0.06000 0.49000 0.00000 -1.05000 0.00000 -3.30000 0.00000 2.38000 66.00000 NBP2_1SEM-20_9.PDB 2.61326 -8.45000 -1.75000 -2.67000 -8.82000 -3.29000 10.24000 -10.08000 0.59000 7.23000 4.31000 0.00000 0.00000 0.00000 0.07000 0.39000 0.00000 -1.02000 0.00000 -3.27000 0.00000 2.38000 66.00000 NBP2_1SEM-20_10.PDB 2.34317 -8.91000 -2.31000 -2.34000 -9.33000 -2.54000 10.34000 -11.75000 0.41000 7.69000 5.07000 0.00000 0.00000 0.00000 0.03000 0.49000 0.00000 -1.34000 0.00000 -2.83000 0.00000 2.38000 66.00000 NBP2_1SEM-20_11.PDB 2.10739 -8.03000 -2.27000 -2.31000 -9.27000 -2.32000 10.02000 -11.32000 0.57000 7.41000 5.08000 0.00000 0.00000 0.00000 0.07000 0.49000 0.00000 -1.00000 0.00000 -2.70000 0.00000 2.38000 66.00000 NBP2_1SEM-20_12.PDB 2.12562 -7.51000 -1.76000 -2.66000 -9.00000 -2.89000 10.64000 -10.72000 0.57000 7.68000 4.30000 0.00000 0.00000 0.00000 0.05000 0.28000 0.00000 -0.68000 0.00000 -3.04000 0.00000 2.38000 66.00000 NBP2_1SEM-20_13.PDB 2.06054 -8.85000 -1.68000 -2.66000 -9.00000 -3.52000 10.37000 -10.42000 0.67000 7.26000 4.62000 0.00000 0.00000 0.00000 0.07000 0.51000 0.00000 -1.10000 0.00000 -3.47000 0.00000 2.38000 66.00000 NBP2_1SEM-20_14.PDB 3.43040 -13.68000 -2.30000 -5.38000 -9.76000 -3.29000 11.66000 -12.33000 0.51000 7.12000 4.15000 0.00000 0.00000 0.00000 0.10000 0.48000 0.00000 -0.78000 0.00000 -3.38000 0.00000 2.38000 66.00000 NBP2_1SEM-20_15.PDB 2.13342 -12.22000 -2.25000 -3.02000 -10.31000 -2.66000 10.42000 -13.07000 0.47000 7.63000 3.94000 0.00000 0.00000 0.00000 0.05000 0.49000 0.00000 -0.62000 0.00000 -2.79000 0.00000 2.38000 66.00000 NBP2_1SEM-20_16.PDB 2.28149 -8.94000 -1.85000 -2.93000 -9.89000 -4.05000 11.75000 -11.34000 1.21000 8.60000 4.50000 0.00000 0.00000 0.00000 0.11000 0.48000 0.00000 -1.28000 0.00000 -3.78000 0.00000 2.38000 66.00000 NBP2_1SEM-20_17.PDB 2.83978 -8.17000 -1.73000 -2.72000 -9.74000 -3.31000 11.36000 -11.17000 0.65000 7.80000 4.71000 0.00000 0.00000 0.00000 0.11000 0.46000 0.00000 -0.85000 0.00000 -3.27000 0.00000 2.38000 66.00000 NBP2_1SEM-20_18.PDB 2.32892 -9.34000 -1.88000 -1.90000 -9.67000 -4.09000 12.62000 -11.76000 0.52000 7.94000 3.67000 0.00000 0.00000 0.00000 0.08000 0.62000 0.00000 -1.46000 0.00000 -3.40000 0.00000 2.38000 66.00000 NBP2_1SEM-20_19.PDB 2.15341 -11.28000 -2.23000 -3.13000 -9.84000 -2.55000 10.06000 -12.30000 0.39000 7.58000 3.97000 0.00000 0.00000 0.00000 0.06000 0.50000 0.00000 -0.66000 0.00000 -2.65000 0.00000 2.38000 66.00000 NBP2_1SEM-20_20.PDB 2.23978 -9.49000 -2.31000 -2.35000 -9.75000 -2.44000 10.69000 -12.30000 0.48000 7.22000 4.85000 0.00000 0.00000 0.00000 0.05000 0.46000 0.00000 -0.91000 0.00000 -2.73000 0.00000 2.38000 66.00000 NBP2_1SEM-20_21.PDB 1.77020 -11.24000 -2.33000 -4.85000 -10.84000 -2.75000 11.63000 -13.32000 0.51000 9.27000 5.07000 0.00000 0.00000 0.00000 0.10000 0.51000 0.00000 -0.90000 0.00000 -2.83000 0.00000 2.38000 66.00000 NBP2_1SEM-20_22.PDB 1.54926 -9.62000 -1.67000 -2.39000 -9.61000 -2.61000 10.24000 -11.92000 1.08000 7.46000 3.71000 0.00000 0.00000 0.00000 0.05000 0.46000 0.00000 -1.34000 0.00000 -2.63000 0.00000 2.38000 66.00000 NBP2_1SEM-20_23.PDB 2.29834 -9.90000 -2.31000 -3.17000 -9.72000 -1.75000 9.27000 -12.49000 0.60000 7.63000 4.64000 0.00000 0.00000 0.00000 0.08000 0.52000 0.00000 -0.70000 0.00000 -1.98000 0.00000 2.38000 66.00000 NBP2_1SEM-20_24.PDB 2.44306 -10.39000 -1.75000 -3.44000 -9.17000 -3.84000 10.44000 -10.84000 0.59000 8.31000 4.40000 0.00000 0.00000 0.00000 0.05000 0.57000 0.00000 -1.33000 0.00000 -3.80000 0.00000 2.38000 66.00000 NBP2_1SEM-20_25.PDB 1.71732 -9.14000 -1.78000 -2.66000 -9.06000 -3.05000 10.01000 -11.13000 0.80000 7.39000 4.16000 0.00000 0.00000 0.00000 0.06000 0.45000 0.00000 -0.71000 0.00000 -3.16000 0.00000 2.38000 66.00000 NBP2_1SEM-20_26.PDB 2.20367 -8.13000 -1.78000 -2.65000 -9.26000 -2.70000 10.42000 -11.12000 0.47000 7.46000 4.77000 0.00000 0.00000 0.00000 0.07000 0.30000 0.00000 -1.15000 0.00000 -2.66000 0.00000 2.38000 66.00000 NBP2_1SEM-20_27.PDB 2.35959 -7.59000 -1.64000 -4.31000 -8.32000 -3.31000 10.05000 -9.77000 1.65000 8.29000 4.12000 0.00000 0.00000 0.00000 0.06000 0.29000 0.00000 -0.98000 0.00000 -3.44000 0.00000 2.38000 66.00000 NBP2_1SEM-20_28.PDB 2.73307 -10.56000 -1.73000 -2.59000 -9.23000 -3.74000 10.16000 -11.00000 0.54000 7.57000 4.30000 0.00000 0.00000 0.00000 0.08000 0.54000 0.00000 -1.30000 0.00000 -3.62000 0.00000 2.38000 66.00000 NBP2_1SEM-20_29.PDB 2.36953 -8.81000 -1.74000 -3.01000 -8.34000 -3.35000 10.84000 -9.99000 0.40000 6.59000 3.62000 0.00000 0.00000 0.00000 0.07000 0.24000 0.00000 -0.63000 0.00000 -3.27000 0.00000 2.38000 66.00000 NBP2_1SEM-20_30.PDB 2.26092 -9.10000 -1.71000 -2.94000 -9.31000 -4.14000 10.67000 -10.87000 1.04000 7.90000 5.09000 0.00000 0.00000 0.00000 0.10000 0.48000 0.00000 -0.69000 0.00000 -4.24000 0.00000 2.38000 66.00000