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-14_1.PDB 17.81000 -36.29000 -7.53000 -69.89000 -1.77000 82.32000 -92.46000 9.55000 34.98000 97.00000 0.00000 0.00000 0.00000 3.32000 20.69000 0.00000 -1.82000 0.00000 0.39000 0.00000 0.00000 66.00000 BUD14_1SEM-14_2.PDB 17.91000 -36.43000 -7.66000 -71.19000 -1.72000 83.41000 -94.29000 9.81000 35.84000 98.51000 0.00000 0.00000 0.00000 3.45000 20.64000 0.00000 -2.21000 0.00000 0.39000 0.00000 0.00000 66.00000 BUD14_1SEM-14_3.PDB 17.71000 -36.30000 -7.53000 -70.09000 -1.82000 82.64000 -92.56000 9.79000 35.33000 96.35000 0.00000 0.00000 0.00000 3.41000 20.34000 0.00000 -1.86000 0.00000 0.36000 0.00000 0.00000 66.00000 BUD14_1SEM-14_4.PDB 18.12000 -35.79000 -7.08000 -70.16000 -2.01000 81.64000 -93.33000 9.65000 35.66000 97.22000 0.00000 0.00000 0.00000 3.85000 20.35000 0.00000 -1.91000 0.00000 0.39000 0.00000 0.00000 66.00000 BUD14_1SEM-14_5.PDB 18.29000 -36.19000 -7.47000 -69.61000 -1.76000 82.12000 -91.98000 9.60000 35.14000 96.26000 0.00000 0.00000 0.00000 3.73000 20.05000 0.00000 -1.94000 0.00000 0.38000 0.00000 0.00000 66.00000 BUD14_1SEM-14_6.PDB 18.66000 -36.28000 -7.56000 -70.45000 -1.66000 83.05000 -93.06000 9.69000 35.35000 97.56000 0.00000 0.00000 0.00000 3.58000 20.23000 0.00000 -1.95000 0.00000 0.39000 0.00000 0.00000 66.00000 BUD14_1SEM-14_7.PDB 17.42000 -36.25000 -7.52000 -71.85000 -1.74000 83.51000 -95.11000 10.09000 36.49000 97.29000 0.00000 0.00000 0.00000 4.01000 20.08000 0.00000 -1.87000 0.00000 0.38000 0.00000 0.00000 66.00000 BUD14_1SEM-14_8.PDB 19.31000 -36.22000 -7.50000 -70.56000 -1.82000 83.23000 -93.22000 10.44000 35.83000 97.35000 0.00000 0.00000 0.00000 3.49000 20.00000 0.00000 -2.05000 0.00000 0.35000 0.00000 0.00000 66.00000 BUD14_1SEM-14_9.PDB 18.82000 -35.81000 -7.09000 -70.33000 -2.04000 82.12000 -93.33000 9.75000 35.81000 97.49000 0.00000 0.00000 0.00000 3.76000 20.71000 0.00000 -1.90000 0.00000 0.38000 0.00000 0.00000 66.00000 BUD14_1SEM-14_10.PDB 18.03000 -36.40000 -7.65000 -71.00000 -1.67000 83.00000 -93.91000 10.62000 35.31000 96.98000 0.00000 0.00000 0.00000 4.23000 20.19000 0.00000 -1.87000 0.00000 0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-14_11.PDB 20.52000 -35.75000 -7.16000 -71.44000 -1.83000 83.55000 -95.09000 11.89000 36.20000 97.56000 0.00000 0.00000 0.00000 4.10000 20.61000 0.00000 -1.90000 0.00000 0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-14_12.PDB 19.16000 -35.71000 -7.06000 -69.56000 -1.80000 81.55000 -92.51000 10.53000 35.17000 96.56000 0.00000 0.00000 0.00000 3.39000 20.23000 0.00000 -1.82000 0.00000 0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-14_13.PDB 18.76000 -36.27000 -7.53000 -70.16000 -1.74000 82.57000 -92.72000 9.64000 35.41000 97.54000 0.00000 0.00000 0.00000 3.62000 20.26000 0.00000 -1.97000 0.00000 0.38000 0.00000 0.00000 66.00000 BUD14_1SEM-14_14.PDB 18.09000 -36.25000 -7.51000 -69.66000 -1.69000 82.02000 -92.07000 9.66000 34.87000 96.66000 0.00000 0.00000 0.00000 3.46000 20.29000 0.00000 -1.82000 0.00000 0.42000 0.00000 0.00000 66.00000 BUD14_1SEM-14_15.PDB 19.10000 -35.81000 -7.09000 -69.54000 -1.97000 81.66000 -92.13000 9.74000 35.03000 97.14000 0.00000 0.00000 0.00000 3.60000 20.29000 0.00000 -1.93000 0.00000 0.41000 0.00000 0.00000 66.00000 BUD14_1SEM-14_16.PDB 17.49000 -35.79000 -7.10000 -69.61000 -2.07000 81.74000 -92.75000 9.92000 35.05000 95.94000 0.00000 0.00000 0.00000 3.71000 20.28000 0.00000 -1.92000 0.00000 0.36000 0.00000 0.00000 66.00000 BUD14_1SEM-14_17.PDB 16.95000 -35.77000 -7.12000 -70.61000 -2.08000 82.27000 -94.17000 9.79000 35.97000 96.59000 0.00000 0.00000 0.00000 3.59000 19.82000 0.00000 -1.88000 0.00000 0.37000 0.00000 0.00000 66.00000 BUD14_1SEM-14_18.PDB 18.99000 -36.35000 -7.60000 -70.54000 -1.81000 83.24000 -93.15000 10.21000 35.62000 97.36000 0.00000 0.00000 0.00000 3.55000 20.16000 0.00000 -1.88000 0.00000 0.35000 0.00000 0.00000 66.00000 BUD14_1SEM-14_19.PDB 18.51000 -35.96000 -7.23000 -71.75000 -2.04000 83.23000 -95.45000 11.55000 36.70000 97.79000 0.00000 0.00000 0.00000 3.78000 20.59000 0.00000 -2.48000 0.00000 0.38000 0.00000 0.00000 66.00000 BUD14_1SEM-14_20.PDB 18.37000 -36.24000 -7.45000 -70.67000 -1.68000 83.14000 -93.42000 9.65000 35.48000 97.65000 0.00000 0.00000 0.00000 3.50000 20.34000 0.00000 -1.99000 0.00000 0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-14_21.PDB 20.32000 -35.77000 -7.12000 -68.65000 -1.92000 81.97000 -90.61000 9.73000 34.42000 96.07000 0.00000 0.00000 0.00000 3.62000 20.22000 0.00000 -1.82000 0.00000 0.41000 0.00000 0.00000 66.00000 BUD14_1SEM-14_22.PDB 19.32000 -35.75000 -7.12000 -69.23000 -1.98000 81.78000 -91.68000 9.62000 34.90000 96.69000 0.00000 0.00000 0.00000 3.68000 20.02000 0.00000 -2.00000 0.00000 0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-14_23.PDB 18.09000 -35.78000 -7.12000 -70.23000 -2.10000 82.25000 -93.63000 10.06000 35.63000 97.05000 0.00000 0.00000 0.00000 3.49000 20.14000 0.00000 -1.87000 0.00000 0.35000 0.00000 0.00000 66.00000 BUD14_1SEM-14_24.PDB 18.87000 -36.68000 -7.93000 -71.44000 -2.54000 84.08000 -94.35000 13.19000 36.57000 96.88000 0.00000 0.00000 0.00000 3.08000 20.70000 0.00000 -1.96000 0.00000 -0.03000 0.00000 0.00000 66.00000 BUD14_1SEM-14_25.PDB 17.58000 -35.76000 -7.09000 -69.90000 -2.08000 81.87000 -93.17000 9.95000 35.40000 96.72000 0.00000 0.00000 0.00000 3.16000 20.09000 0.00000 -1.93000 0.00000 0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-14_26.PDB 17.16000 -36.98000 -8.19000 -71.10000 -2.12000 83.84000 -93.87000 9.77000 36.30000 98.14000 0.00000 0.00000 0.00000 3.50000 20.56000 0.00000 -2.01000 0.00000 -0.11000 0.00000 0.00000 66.00000 BUD14_1SEM-14_27.PDB 18.99000 -35.71000 -7.10000 -69.32000 -2.00000 82.00000 -92.05000 9.99000 34.80000 95.98000 0.00000 0.00000 0.00000 3.78000 20.07000 0.00000 -1.80000 0.00000 0.41000 0.00000 0.00000 66.00000 BUD14_1SEM-14_28.PDB 16.44000 -37.10000 -8.33000 -70.11000 -2.26000 83.16000 -92.62000 9.62000 35.68000 96.99000 0.00000 0.00000 0.00000 3.49000 20.39000 0.00000 -1.93000 0.00000 -0.15000 0.00000 0.00000 66.00000 BUD14_1SEM-14_29.PDB 20.48000 -35.83000 -7.06000 -70.29000 -1.75000 83.42000 -92.79000 10.35000 35.39000 97.33000 0.00000 0.00000 0.00000 3.14000 20.11000 0.00000 -1.82000 0.00000 0.39000 0.00000 0.00000 66.00000 BUD14_1SEM-14_30.PDB 18.16000 -36.78000 -8.02000 -71.51000 -2.49000 84.66000 -94.42000 10.62000 36.14000 98.67000 0.00000 0.00000 0.00000 3.59000 21.02000 0.00000 -2.37000 0.00000 0.08000 0.00000 0.00000 66.00000