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-16_1.PDB 25.44000 -39.25000 -9.94000 -69.00000 -2.63000 84.70000 -90.21000 15.53000 36.28000 99.78000 0.00000 0.00000 0.00000 3.12000 17.96000 0.00000 -2.48000 0.00000 -0.46000 0.00000 0.00000 66.00000 BUD14_1SEM-16_2.PDB 25.96000 -39.24000 -9.96000 -68.74000 -2.59000 84.62000 -89.72000 15.92000 35.95000 100.46000 0.00000 0.00000 0.00000 2.48000 18.11000 0.00000 -2.76000 0.00000 -0.45000 0.00000 0.00000 66.00000 BUD14_1SEM-16_3.PDB 25.22000 -38.35000 -9.16000 -68.92000 -2.30000 83.54000 -90.39000 15.94000 35.29000 99.90000 0.00000 0.00000 0.00000 2.71000 18.13000 0.00000 -2.56000 0.00000 -0.49000 0.00000 0.00000 66.00000 BUD14_1SEM-16_4.PDB 27.06000 -37.50000 -8.44000 -67.84000 -2.10000 82.43000 -88.94000 16.19000 34.62000 99.15000 0.00000 0.00000 0.00000 2.29000 18.13000 0.00000 -2.47000 0.00000 -0.33000 0.00000 0.00000 66.00000 BUD14_1SEM-16_5.PDB 25.83000 -39.75000 -10.41000 -68.72000 -2.81000 85.53000 -89.21000 14.36000 36.20000 100.17000 0.00000 0.00000 0.00000 3.49000 18.02000 0.00000 -2.69000 0.00000 -0.34000 0.00000 0.00000 66.00000 BUD14_1SEM-16_6.PDB 26.29000 -39.96000 -10.74000 -68.47000 -2.71000 85.53000 -88.75000 15.12000 36.46000 100.02000 0.00000 0.00000 0.00000 2.90000 17.99000 0.00000 -2.64000 0.00000 -0.47000 0.00000 0.00000 66.00000 BUD14_1SEM-16_7.PDB 27.82000 -39.21000 -9.97000 -68.23000 -2.94000 84.73000 -88.47000 15.11000 35.85000 100.57000 0.00000 0.00000 0.00000 3.42000 18.06000 0.00000 -2.58000 0.00000 -0.48000 0.00000 0.00000 66.00000 BUD14_1SEM-16_8.PDB 26.91000 -37.52000 -9.00000 -68.48000 -2.32000 83.23000 -89.47000 16.03000 35.22000 99.44000 0.00000 0.00000 0.00000 2.51000 18.19000 0.00000 -2.44000 0.00000 -0.29000 0.00000 0.00000 66.00000 BUD14_1SEM-16_9.PDB 26.97000 -37.51000 -8.54000 -68.60000 -2.20000 83.30000 -89.64000 14.62000 35.16000 99.79000 0.00000 0.00000 0.00000 3.38000 18.15000 0.00000 -2.36000 0.00000 -0.44000 0.00000 0.00000 66.00000 BUD14_1SEM-16_10.PDB 26.06000 -39.01000 -9.76000 -68.13000 -2.51000 84.27000 -88.64000 14.82000 35.59000 99.26000 0.00000 0.00000 0.00000 3.59000 18.18000 0.00000 -2.57000 0.00000 -0.86000 0.00000 0.00000 66.00000 BUD14_1SEM-16_11.PDB 26.54000 -39.21000 -10.40000 -68.38000 -2.11000 84.42000 -89.01000 14.86000 36.66000 99.18000 0.00000 0.00000 0.00000 3.37000 18.08000 0.00000 -2.51000 0.00000 -0.33000 0.00000 0.00000 66.00000 BUD14_1SEM-16_12.PDB 27.64000 -40.00000 -10.66000 -68.35000 -2.36000 85.11000 -88.77000 16.61000 36.23000 100.64000 0.00000 0.00000 0.00000 2.34000 18.21000 0.00000 -2.77000 0.00000 -0.39000 0.00000 0.00000 66.00000 BUD14_1SEM-16_13.PDB 26.23000 -39.24000 -9.97000 -69.28000 -2.47000 84.79000 -90.48000 16.05000 36.31000 99.73000 0.00000 0.00000 0.00000 3.61000 18.09000 0.00000 -2.35000 0.00000 -0.46000 0.00000 0.00000 66.00000 BUD14_1SEM-16_14.PDB 25.00000 -39.93000 -10.63000 -68.78000 -2.67000 85.05000 -89.45000 14.65000 36.58000 100.14000 0.00000 0.00000 0.00000 3.16000 18.09000 0.00000 -2.64000 0.00000 -0.49000 0.00000 0.00000 66.00000 BUD14_1SEM-16_15.PDB 28.85000 -38.24000 -9.49000 -67.29000 -2.45000 83.73000 -87.32000 15.34000 35.04000 99.53000 0.00000 0.00000 0.00000 2.85000 18.03000 0.00000 -2.36000 0.00000 -0.50000 0.00000 0.00000 66.00000 BUD14_1SEM-16_16.PDB 26.23000 -37.52000 -8.88000 -67.93000 -2.20000 82.56000 -89.13000 15.24000 35.19000 98.45000 0.00000 0.00000 0.00000 3.20000 17.99000 0.00000 -2.39000 0.00000 -0.34000 0.00000 0.00000 66.00000 BUD14_1SEM-16_17.PDB 27.87000 -40.03000 -10.79000 -67.54000 -2.35000 84.90000 -87.58000 15.87000 35.60000 100.22000 0.00000 0.00000 0.00000 2.68000 18.16000 0.00000 -2.64000 0.00000 -0.47000 0.00000 0.00000 66.00000 BUD14_1SEM-16_18.PDB 26.74000 -38.33000 -8.86000 -67.71000 -2.49000 83.11000 -88.72000 16.04000 34.81000 100.25000 0.00000 0.00000 0.00000 2.30000 18.04000 0.00000 -2.64000 0.00000 -1.01000 0.00000 0.00000 66.00000 BUD14_1SEM-16_19.PDB 26.44000 -40.94000 -11.75000 -68.19000 -2.62000 85.44000 -88.21000 15.69000 37.06000 100.66000 0.00000 0.00000 0.00000 2.69000 18.14000 0.00000 -2.99000 0.00000 -0.40000 0.00000 0.00000 66.00000 BUD14_1SEM-16_20.PDB 25.18000 -41.66000 -11.85000 -68.77000 -2.41000 85.38000 -89.36000 16.32000 37.79000 100.54000 0.00000 0.00000 0.00000 2.36000 18.10000 0.00000 -2.73000 0.00000 -0.43000 0.00000 0.00000 66.00000 BUD14_1SEM-16_21.PDB 26.78000 -41.81000 -12.54000 -68.71000 -2.53000 86.90000 -88.77000 15.14000 38.04000 101.06000 0.00000 0.00000 0.00000 3.10000 17.96000 0.00000 -2.60000 0.00000 -0.51000 0.00000 0.00000 66.00000 BUD14_1SEM-16_22.PDB 25.63000 -37.53000 -8.61000 -68.00000 -2.35000 82.63000 -88.91000 15.62000 34.80000 98.56000 0.00000 0.00000 0.00000 2.63000 18.18000 0.00000 -2.46000 0.00000 -0.76000 0.00000 0.00000 66.00000 BUD14_1SEM-16_23.PDB 26.97000 -40.89000 -11.78000 -68.21000 -2.72000 86.06000 -88.13000 14.70000 37.16000 100.31000 0.00000 0.00000 0.00000 3.27000 17.96000 0.00000 -2.47000 0.00000 -0.33000 0.00000 0.00000 66.00000 BUD14_1SEM-16_24.PDB 28.36000 -37.51000 -9.05000 -67.99000 -1.65000 83.00000 -89.02000 16.54000 35.04000 99.35000 0.00000 0.00000 0.00000 2.30000 18.20000 0.00000 -2.41000 0.00000 -0.25000 0.00000 0.00000 66.00000 BUD14_1SEM-16_25.PDB 24.72000 -40.12000 -10.78000 -69.21000 -2.92000 85.90000 -89.58000 14.56000 37.06000 100.29000 0.00000 0.00000 0.00000 3.35000 18.20000 0.00000 -2.82000 0.00000 -1.01000 0.00000 0.00000 66.00000 BUD14_1SEM-16_26.PDB 27.00000 -37.52000 -8.88000 -67.80000 -2.21000 83.11000 -88.60000 15.64000 34.76000 99.33000 0.00000 0.00000 0.00000 2.44000 18.00000 0.00000 -2.37000 0.00000 -0.89000 0.00000 0.00000 66.00000 BUD14_1SEM-16_27.PDB 25.57000 -38.01000 -9.41000 -67.91000 -2.00000 83.31000 -88.50000 15.04000 34.97000 98.82000 0.00000 0.00000 0.00000 2.24000 17.96000 0.00000 -2.68000 0.00000 -0.31000 0.00000 0.00000 66.00000 BUD14_1SEM-16_28.PDB 27.41000 -40.42000 -11.24000 -68.86000 -2.61000 86.18000 -88.87000 16.15000 36.32000 100.87000 0.00000 0.00000 0.00000 2.71000 18.24000 0.00000 -2.45000 0.00000 -0.37000 0.00000 0.00000 66.00000 BUD14_1SEM-16_29.PDB 27.31000 -37.51000 -8.92000 -68.32000 -1.96000 83.01000 -89.48000 16.74000 35.36000 98.72000 0.00000 0.00000 0.00000 2.43000 18.12000 0.00000 -2.42000 0.00000 -0.34000 0.00000 0.00000 66.00000 BUD14_1SEM-16_30.PDB 27.83000 -38.30000 -9.04000 -68.92000 -2.49000 84.36000 -90.23000 16.37000 35.28000 100.64000 0.00000 0.00000 0.00000 3.26000 18.11000 0.00000 -2.55000 0.00000 -0.55000 0.00000 0.00000 66.00000