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-29_1.PDB 17.07000 -37.41000 -8.34000 -66.09000 -1.98000 78.65000 -86.83000 10.41000 34.30000 94.10000 0.00000 0.00000 0.00000 2.82000 18.23000 0.00000 -2.51000 0.00000 -0.04000 0.00000 0.00000 67.00000 BUD14_1SEM-29_2.PDB 16.09000 -37.73000 -8.92000 -70.02000 -3.40000 82.45000 -91.51000 11.98000 36.78000 94.93000 0.00000 0.00000 0.00000 4.59000 18.41000 0.00000 -2.76000 0.00000 -0.31000 0.00000 0.00000 67.00000 BUD14_1SEM-29_3.PDB 15.35000 -39.74000 -11.48000 -69.35000 -3.21000 83.65000 -90.73000 11.83000 37.86000 95.44000 0.00000 0.00000 0.00000 4.15000 18.30000 0.00000 -3.05000 0.00000 -0.01000 0.00000 0.00000 67.00000 BUD14_1SEM-29_4.PDB 17.13000 -38.24000 -9.20000 -66.51000 -1.66000 78.41000 -87.58000 11.58000 35.16000 94.47000 0.00000 0.00000 0.00000 3.17000 18.14000 0.00000 -2.38000 0.00000 -0.11000 0.00000 0.00000 67.00000 BUD14_1SEM-29_5.PDB 15.94000 -38.38000 -9.33000 -66.84000 -3.08000 80.39000 -87.78000 11.06000 35.62000 94.26000 0.00000 0.00000 0.00000 2.84000 18.22000 0.00000 -2.72000 0.00000 -0.09000 0.00000 0.00000 67.00000 BUD14_1SEM-29_6.PDB 18.19000 -37.47000 -8.35000 -66.05000 -1.62000 78.45000 -87.05000 10.95000 34.19000 94.26000 0.00000 0.00000 0.00000 3.24000 17.97000 0.00000 -2.32000 0.00000 -0.04000 0.00000 0.00000 67.00000 BUD14_1SEM-29_7.PDB 17.57000 -37.33000 -8.17000 -66.06000 -2.10000 78.81000 -86.80000 10.91000 34.11000 94.03000 0.00000 0.00000 0.00000 2.78000 18.14000 0.00000 -2.58000 0.00000 -0.03000 0.00000 0.00000 67.00000 BUD14_1SEM-29_8.PDB 15.90000 -37.38000 -9.01000 -70.06000 -3.18000 82.39000 -91.94000 12.02000 36.45000 95.18000 0.00000 0.00000 0.00000 4.57000 18.49000 0.00000 -2.87000 0.00000 -0.28000 0.00000 0.00000 67.00000 BUD14_1SEM-29_9.PDB 17.43000 -37.27000 -8.20000 -67.40000 -3.05000 80.83000 -88.54000 11.93000 35.03000 94.32000 0.00000 0.00000 0.00000 2.89000 18.35000 0.00000 -2.91000 0.00000 -0.20000 0.00000 0.00000 67.00000 BUD14_1SEM-29_10.PDB 17.37000 -37.55000 -8.46000 -66.22000 -2.15000 79.11000 -87.11000 11.13000 34.53000 94.04000 0.00000 0.00000 0.00000 2.64000 18.25000 0.00000 -2.52000 0.00000 -0.05000 0.00000 0.00000 67.00000 BUD14_1SEM-29_11.PDB 16.27000 -37.19000 -8.14000 -66.86000 -2.95000 79.36000 -88.00000 10.88000 34.56000 94.12000 0.00000 0.00000 0.00000 3.20000 18.15000 0.00000 -2.67000 0.00000 -0.04000 0.00000 0.00000 67.00000 BUD14_1SEM-29_12.PDB 17.98000 -37.59000 -8.48000 -66.36000 -1.59000 78.32000 -87.56000 11.37000 34.51000 94.47000 0.00000 0.00000 0.00000 3.18000 17.86000 0.00000 -2.25000 0.00000 -0.04000 0.00000 0.00000 67.00000 BUD14_1SEM-29_13.PDB 16.29000 -38.18000 -9.11000 -67.73000 -1.73000 79.61000 -89.54000 10.20000 35.37000 94.85000 0.00000 0.00000 0.00000 5.03000 18.17000 0.00000 -2.36000 0.00000 -0.11000 0.00000 0.00000 67.00000 BUD14_1SEM-29_14.PDB 16.13000 -38.25000 -9.16000 -67.23000 -2.76000 80.70000 -88.55000 10.42000 35.70000 94.79000 0.00000 0.00000 0.00000 3.24000 18.22000 0.00000 -2.69000 0.00000 -0.09000 0.00000 0.00000 67.00000 BUD14_1SEM-29_15.PDB 15.41000 -38.38000 -9.96000 -68.24000 -2.84000 81.45000 -89.87000 10.79000 36.74000 95.48000 0.00000 0.00000 0.00000 3.24000 18.35000 0.00000 -2.90000 0.00000 -0.11000 0.00000 0.00000 67.00000 BUD14_1SEM-29_16.PDB 15.81000 -38.18000 -9.16000 -68.43000 -3.47000 81.37000 -89.93000 11.65000 36.39000 94.34000 0.00000 0.00000 0.00000 4.43000 18.29000 0.00000 -2.93000 0.00000 -0.26000 0.00000 0.00000 67.00000 BUD14_1SEM-29_17.PDB 16.58000 -36.63000 -7.48000 -67.68000 -1.95000 78.38000 -89.56000 12.09000 34.10000 94.25000 0.00000 0.00000 0.00000 3.64000 18.20000 0.00000 -2.51000 0.00000 -0.06000 0.00000 0.00000 67.00000 BUD14_1SEM-29_18.PDB 16.89000 -37.40000 -8.30000 -68.57000 -3.00000 81.01000 -90.61000 12.02000 35.23000 94.74000 0.00000 0.00000 0.00000 4.63000 18.15000 0.00000 -2.62000 0.00000 -0.24000 0.00000 0.00000 67.00000 BUD14_1SEM-29_19.PDB 17.12000 -37.51000 -8.44000 -68.75000 -2.90000 81.48000 -90.71000 11.69000 35.78000 94.91000 0.00000 0.00000 0.00000 4.60000 18.24000 0.00000 -2.85000 0.00000 -0.18000 0.00000 0.00000 67.00000 BUD14_1SEM-29_20.PDB 17.16000 -37.52000 -8.36000 -66.02000 -1.69000 78.21000 -87.14000 10.28000 34.29000 94.58000 0.00000 0.00000 0.00000 3.11000 18.09000 0.00000 -2.49000 0.00000 -0.10000 0.00000 0.00000 67.00000 BUD14_1SEM-29_21.PDB 18.69000 -37.36000 -8.25000 -65.48000 -1.86000 78.36000 -86.27000 11.39000 33.66000 93.89000 0.00000 0.00000 0.00000 3.24000 18.20000 0.00000 -2.53000 0.00000 -0.08000 0.00000 0.00000 67.00000 BUD14_1SEM-29_22.PDB 17.02000 -38.36000 -9.27000 -66.16000 -2.85000 79.51000 -87.21000 10.64000 35.35000 94.30000 0.00000 0.00000 0.00000 3.51000 18.01000 0.00000 -2.35000 0.00000 -0.08000 0.00000 0.00000 67.00000 BUD14_1SEM-29_23.PDB 18.59000 -37.49000 -8.39000 -65.96000 -1.96000 78.31000 -87.04000 11.07000 34.52000 94.13000 0.00000 0.00000 0.00000 3.77000 17.99000 0.00000 -2.31000 0.00000 -0.07000 0.00000 0.00000 67.00000 BUD14_1SEM-29_24.PDB 18.07000 -37.32000 -8.20000 -65.88000 -1.84000 78.44000 -87.05000 11.23000 34.08000 94.25000 0.00000 0.00000 0.00000 2.96000 18.12000 0.00000 -2.49000 0.00000 -0.08000 0.00000 0.00000 67.00000 BUD14_1SEM-29_25.PDB 15.50000 -38.31000 -9.29000 -68.17000 -1.98000 80.01000 -89.92000 11.06000 35.90000 94.60000 0.00000 0.00000 0.00000 4.25000 18.16000 0.00000 -2.52000 0.00000 -0.11000 0.00000 0.00000 67.00000 BUD14_1SEM-29_26.PDB 16.80000 -37.40000 -8.38000 -67.31000 -1.96000 78.78000 -88.93000 11.26000 34.83000 94.18000 0.00000 0.00000 0.00000 4.36000 18.09000 0.00000 -2.54000 0.00000 -0.09000 0.00000 0.00000 67.00000 BUD14_1SEM-29_27.PDB 14.55000 -38.03000 -8.99000 -68.15000 -2.87000 80.26000 -89.60000 11.44000 35.78000 93.33000 0.00000 0.00000 0.00000 4.28000 18.24000 0.00000 -2.82000 0.00000 -0.08000 0.00000 0.00000 67.00000 BUD14_1SEM-29_28.PDB 17.50000 -37.37000 -8.29000 -67.11000 -2.17000 78.68000 -88.70000 11.97000 34.87000 94.03000 0.00000 0.00000 0.00000 4.20000 18.06000 0.00000 -2.51000 0.00000 -0.10000 0.00000 0.00000 67.00000 BUD14_1SEM-29_29.PDB 15.98000 -38.24000 -9.15000 -67.68000 -2.10000 79.95000 -89.41000 11.17000 35.65000 94.15000 0.00000 0.00000 0.00000 4.28000 18.17000 0.00000 -2.53000 0.00000 -0.10000 0.00000 0.00000 67.00000 BUD14_1SEM-29_30.PDB 19.22000 -38.13000 -9.07000 -67.74000 -1.68000 79.30000 -89.36000 14.80000 35.41000 93.55000 0.00000 0.00000 0.00000 4.32000 18.31000 0.00000 -2.09000 0.00000 -0.09000 0.00000 0.00000 67.00000