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 BUD14_1SEM-19_1.PDB 22.82000 -36.69000 -10.00000 -69.02000 -2.94000 82.71000 -90.30000 12.27000 37.26000 99.05000 0.00000 0.00000 0.00000 3.78000 18.19000 0.00000 -2.41000 0.00000 -0.87000 0.00000 0.00000 66.00000 BUD14_1SEM-19_2.PDB 21.94000 -36.75000 -10.01000 -68.32000 -2.85000 82.08000 -89.49000 11.78000 36.62000 98.90000 0.00000 0.00000 0.00000 2.79000 17.96000 0.00000 -1.94000 0.00000 -0.87000 0.00000 0.00000 66.00000 BUD14_1SEM-19_3.PDB 21.94000 -36.80000 -9.09000 -68.11000 -2.68000 81.48000 -89.38000 11.71000 35.96000 98.95000 0.00000 0.00000 0.00000 2.96000 18.11000 0.00000 -2.29000 0.00000 -0.76000 0.00000 0.00000 66.00000 BUD14_1SEM-19_4.PDB 21.85000 -36.79000 -10.71000 -69.36000 -2.97000 82.55000 -90.87000 14.49000 37.60000 98.38000 0.00000 0.00000 0.00000 2.69000 18.34000 0.00000 -2.28000 0.00000 -0.87000 0.00000 0.00000 66.00000 BUD14_1SEM-19_5.PDB 23.73000 -36.54000 -8.87000 -69.46000 -2.74000 82.56000 -91.10000 11.58000 36.46000 99.34000 0.00000 0.00000 0.00000 5.30000 18.20000 0.00000 -2.22000 0.00000 -0.60000 0.00000 0.00000 66.00000 BUD14_1SEM-19_6.PDB 21.58000 -36.71000 -9.85000 -69.19000 -2.90000 82.61000 -90.84000 11.59000 37.14000 99.25000 0.00000 0.00000 0.00000 3.18000 18.01000 0.00000 -1.99000 0.00000 -0.72000 0.00000 0.00000 66.00000 BUD14_1SEM-19_7.PDB 22.64000 -36.70000 -9.01000 -68.76000 -2.94000 81.98000 -90.16000 12.09000 36.73000 99.05000 0.00000 0.00000 0.00000 3.28000 18.18000 0.00000 -2.14000 0.00000 -0.77000 0.00000 0.00000 66.00000 BUD14_1SEM-19_8.PDB 21.67000 -36.69000 -9.63000 -68.63000 -3.11000 82.14000 -90.04000 12.03000 36.89000 98.84000 0.00000 0.00000 0.00000 2.82000 17.99000 0.00000 -2.03000 0.00000 -0.93000 0.00000 0.00000 66.00000 BUD14_1SEM-19_9.PDB 22.02000 -36.65000 -8.96000 -68.25000 -2.66000 81.43000 -89.71000 11.83000 35.94000 98.89000 0.00000 0.00000 0.00000 2.91000 17.96000 0.00000 -1.97000 0.00000 -0.78000 0.00000 0.00000 66.00000 BUD14_1SEM-19_10.PDB 22.92000 -36.72000 -9.40000 -68.46000 -3.02000 82.03000 -89.69000 11.74000 36.75000 99.36000 0.00000 0.00000 0.00000 3.62000 18.12000 0.00000 -2.35000 0.00000 -0.94000 0.00000 0.00000 66.00000 BUD14_1SEM-19_11.PDB 22.56000 -36.71000 -9.74000 -68.44000 -2.35000 82.16000 -89.79000 12.83000 36.62000 98.00000 0.00000 0.00000 0.00000 2.80000 17.97000 0.00000 -1.92000 0.00000 -0.88000 0.00000 0.00000 66.00000 BUD14_1SEM-19_12.PDB 23.36000 -36.74000 -9.79000 -68.60000 -2.43000 81.94000 -89.93000 15.32000 36.75000 98.33000 0.00000 0.00000 0.00000 1.96000 18.16000 0.00000 -2.49000 0.00000 -0.96000 0.00000 0.00000 66.00000 BUD14_1SEM-19_13.PDB 22.40000 -36.78000 -9.14000 -68.31000 -2.38000 81.68000 -89.89000 12.79000 36.24000 98.26000 0.00000 0.00000 0.00000 2.64000 18.00000 0.00000 -1.94000 0.00000 -0.77000 0.00000 0.00000 66.00000 BUD14_1SEM-19_14.PDB 23.27000 -36.72000 -9.03000 -68.75000 -2.16000 81.60000 -90.37000 14.07000 36.28000 98.14000 0.00000 0.00000 0.00000 3.08000 18.20000 0.00000 -2.07000 0.00000 -0.80000 0.00000 0.00000 66.00000 BUD14_1SEM-19_15.PDB 22.41000 -36.53000 -8.87000 -68.55000 -2.05000 81.82000 -90.11000 13.00000 35.58000 98.23000 0.00000 0.00000 0.00000 2.82000 18.15000 0.00000 -2.32000 0.00000 -0.60000 0.00000 0.00000 66.00000 BUD14_1SEM-19_16.PDB 22.02000 -36.73000 -9.25000 -69.23000 -2.51000 82.09000 -90.89000 13.06000 37.08000 98.45000 0.00000 0.00000 0.00000 2.83000 18.03000 0.00000 -1.90000 0.00000 -0.96000 0.00000 0.00000 66.00000 BUD14_1SEM-19_17.PDB 22.03000 -36.75000 -9.07000 -68.48000 -2.20000 81.55000 -89.88000 12.16000 36.05000 98.05000 0.00000 0.00000 0.00000 3.34000 17.95000 0.00000 -1.98000 0.00000 -0.77000 0.00000 0.00000 66.00000 BUD14_1SEM-19_18.PDB 22.50000 -36.68000 -9.02000 -67.93000 -2.23000 81.21000 -89.36000 13.00000 35.69000 97.85000 0.00000 0.00000 0.00000 2.75000 17.95000 0.00000 -1.99000 0.00000 -0.79000 0.00000 0.00000 66.00000 BUD14_1SEM-19_19.PDB 21.51000 -36.64000 -9.12000 -68.14000 -2.12000 81.23000 -89.62000 11.75000 35.93000 98.06000 0.00000 0.00000 0.00000 2.90000 17.96000 0.00000 -1.94000 0.00000 -0.79000 0.00000 0.00000 66.00000 BUD14_1SEM-19_20.PDB 25.32000 -36.76000 -9.99000 -68.57000 -2.47000 82.29000 -89.68000 12.60000 36.84000 99.05000 0.00000 0.00000 0.00000 5.24000 18.20000 0.00000 -2.33000 0.00000 -0.90000 0.00000 0.00000 66.00000 BUD14_1SEM-19_21.PDB 22.23000 -36.74000 -9.80000 -67.87000 -2.44000 81.30000 -89.21000 12.73000 36.50000 98.18000 0.00000 0.00000 0.00000 2.53000 17.93000 0.00000 -1.98000 0.00000 -0.96000 0.00000 0.00000 66.00000 BUD14_1SEM-19_22.PDB 24.58000 -36.74000 -10.58000 -68.32000 -2.26000 81.68000 -89.62000 16.08000 37.02000 98.61000 0.00000 0.00000 0.00000 1.96000 18.19000 0.00000 -2.37000 0.00000 -0.87000 0.00000 0.00000 66.00000 BUD14_1SEM-19_23.PDB 21.59000 -36.71000 -9.02000 -67.94000 -2.35000 81.05000 -89.28000 11.83000 36.13000 98.11000 0.00000 0.00000 0.00000 2.64000 17.89000 0.00000 -1.95000 0.00000 -0.92000 0.00000 0.00000 66.00000 BUD14_1SEM-19_24.PDB 21.59000 -36.45000 -8.77000 -68.44000 -2.23000 81.47000 -89.99000 12.10000 35.95000 98.04000 0.00000 0.00000 0.00000 2.87000 17.96000 0.00000 -2.22000 0.00000 -0.75000 0.00000 0.00000 66.00000 BUD14_1SEM-19_25.PDB 21.36000 -36.71000 -10.69000 -68.88000 -2.42000 81.75000 -90.34000 12.81000 37.59000 98.27000 0.00000 0.00000 0.00000 2.98000 18.05000 0.00000 -2.07000 0.00000 -0.93000 0.00000 0.00000 66.00000 BUD14_1SEM-19_26.PDB 20.81000 -36.68000 -9.03000 -69.72000 -2.37000 82.43000 -91.38000 11.47000 37.04000 98.59000 0.00000 0.00000 0.00000 3.26000 18.21000 0.00000 -2.00000 0.00000 -0.80000 0.00000 0.00000 66.00000 BUD14_1SEM-19_27.PDB 20.77000 -36.70000 -10.27000 -69.30000 -2.90000 82.77000 -90.86000 11.58000 37.21000 99.11000 0.00000 0.00000 0.00000 3.07000 18.12000 0.00000 -2.04000 0.00000 -0.91000 0.00000 0.00000 66.00000 BUD14_1SEM-19_28.PDB 21.98000 -36.63000 -8.95000 -68.50000 -2.72000 82.08000 -90.01000 11.56000 35.85000 98.88000 0.00000 0.00000 0.00000 3.15000 18.03000 0.00000 -1.95000 0.00000 -0.77000 0.00000 0.00000 66.00000 BUD14_1SEM-19_29.PDB 22.28000 -36.74000 -9.87000 -68.02000 -2.81000 81.71000 -89.07000 11.91000 36.34000 98.78000 0.00000 0.00000 0.00000 3.07000 18.01000 0.00000 -2.14000 0.00000 -0.90000 0.00000 0.00000 66.00000 BUD14_1SEM-19_30.PDB 21.91000 -36.71000 -9.02000 -68.38000 -2.36000 81.24000 -89.63000 12.69000 36.30000 98.76000 0.00000 0.00000 0.00000 2.10000 18.06000 0.00000 -2.28000 0.00000 -0.82000 0.00000 0.00000 66.00000