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_1CKA-15_1.PDB 9.52000 -37.65000 -14.37000 -72.05000 -2.55000 86.99000 -93.83000 6.86000 39.51000 96.12000 0.00000 0.00000 0.00000 3.09000 20.39000 0.00000 -1.86000 0.00000 -0.76000 0.00000 0.00000 66.00000 BUD14_1CKA-15_2.PDB 9.48000 -37.66000 -13.59000 -71.86000 -3.13000 86.56000 -93.63000 6.93000 39.35000 95.95000 0.00000 0.00000 0.00000 2.94000 20.12000 0.00000 -1.83000 0.00000 -0.55000 0.00000 0.00000 66.00000 BUD14_1CKA-15_3.PDB 9.13000 -37.63000 -12.13000 -70.53000 -2.67000 85.01000 -92.15000 6.92000 37.65000 94.53000 0.00000 0.00000 0.00000 2.90000 20.49000 0.00000 -1.91000 0.00000 -0.87000 0.00000 0.00000 66.00000 BUD14_1CKA-15_4.PDB 9.42000 -37.63000 -15.24000 -72.20000 -2.56000 87.04000 -93.96000 7.05000 40.63000 95.91000 0.00000 0.00000 0.00000 3.08000 20.22000 0.00000 -1.87000 0.00000 -0.83000 0.00000 0.00000 66.00000 BUD14_1CKA-15_5.PDB 9.26000 -38.10000 -15.00000 -72.41000 -2.51000 87.39000 -94.37000 7.27000 39.70000 96.77000 0.00000 0.00000 0.00000 3.14000 20.33000 0.00000 -1.90000 0.00000 -0.73000 0.00000 0.00000 66.00000 BUD14_1CKA-15_6.PDB 9.10000 -37.64000 -13.92000 -72.44000 -2.42000 86.98000 -94.49000 7.09000 39.55000 96.02000 0.00000 0.00000 0.00000 2.99000 20.29000 0.00000 -1.95000 0.00000 -0.66000 0.00000 0.00000 66.00000 BUD14_1CKA-15_7.PDB 9.33000 -38.09000 -15.09000 -71.23000 -3.19000 86.23000 -92.98000 7.44000 39.30000 96.49000 0.00000 0.00000 0.00000 2.98000 20.34000 0.00000 -1.96000 0.00000 -0.58000 0.00000 0.00000 66.00000 BUD14_1CKA-15_8.PDB 9.26000 -37.62000 -13.81000 -71.76000 -2.43000 86.36000 -93.51000 7.37000 39.09000 95.16000 0.00000 0.00000 0.00000 3.01000 20.57000 0.00000 -1.88000 0.00000 -0.71000 0.00000 0.00000 66.00000 BUD14_1CKA-15_9.PDB 8.49000 -38.97000 -14.33000 -70.36000 -3.12000 85.45000 -92.03000 7.06000 39.00000 95.40000 0.00000 0.00000 0.00000 3.06000 20.22000 0.00000 -2.15000 0.00000 -0.52000 0.00000 0.00000 66.00000 BUD14_1CKA-15_10.PDB 8.85000 -38.13000 -15.00000 -72.37000 -2.45000 87.14000 -94.51000 7.39000 39.60000 96.74000 0.00000 0.00000 0.00000 3.03000 20.47000 0.00000 -1.86000 0.00000 -0.74000 0.00000 0.00000 66.00000 BUD14_1CKA-15_11.PDB 9.07000 -37.65000 -14.41000 -71.08000 -2.12000 85.42000 -93.04000 7.05000 38.59000 95.96000 0.00000 0.00000 0.00000 3.00000 20.11000 0.00000 -2.12000 0.00000 -0.54000 0.00000 0.00000 66.00000 BUD14_1CKA-15_12.PDB 10.51000 -37.51000 -13.80000 -69.96000 -3.67000 84.97000 -90.79000 6.86000 38.63000 95.15000 0.00000 0.00000 0.00000 3.10000 19.95000 0.00000 -1.77000 0.00000 -0.71000 0.00000 0.00000 66.00000 BUD14_1CKA-15_13.PDB 9.92000 -38.13000 -14.40000 -71.62000 -3.41000 87.35000 -92.85000 7.14000 39.27000 96.39000 0.00000 0.00000 0.00000 2.96000 20.20000 0.00000 -2.22000 0.00000 -0.57000 0.00000 0.00000 66.00000 BUD14_1CKA-15_14.PDB 9.15000 -38.15000 -15.11000 -71.98000 -2.85000 86.63000 -94.01000 7.40000 39.91000 96.24000 0.00000 0.00000 0.00000 3.80000 20.44000 0.00000 -1.92000 0.00000 -0.81000 0.00000 0.00000 66.00000 BUD14_1CKA-15_15.PDB 8.85000 -37.64000 -12.19000 -70.40000 -2.67000 84.83000 -92.17000 6.81000 37.51000 94.49000 0.00000 0.00000 0.00000 2.92000 20.53000 0.00000 -1.77000 0.00000 -0.88000 0.00000 0.00000 66.00000 BUD14_1CKA-15_16.PDB 8.63000 -37.63000 -14.34000 -71.50000 -2.92000 85.98000 -93.49000 6.98000 39.44000 95.71000 0.00000 0.00000 0.00000 3.06000 20.17000 0.00000 -1.82000 0.00000 -0.83000 0.00000 0.00000 66.00000 BUD14_1CKA-15_17.PDB 11.59000 -38.17000 -13.16000 -70.91000 -2.56000 86.81000 -91.99000 7.04000 38.06000 96.21000 0.00000 0.00000 0.00000 3.05000 20.41000 0.00000 -2.02000 0.00000 -0.78000 0.00000 0.00000 66.00000 BUD14_1CKA-15_18.PDB 11.21000 -38.18000 -14.87000 -72.12000 -2.49000 88.19000 -93.34000 7.22000 39.68000 96.89000 0.00000 0.00000 0.00000 2.88000 20.40000 0.00000 -1.97000 0.00000 -0.69000 0.00000 0.00000 66.00000 BUD14_1CKA-15_19.PDB 8.05000 -37.62000 -14.34000 -70.65000 -2.36000 84.72000 -92.60000 7.13000 38.49000 94.81000 0.00000 0.00000 0.00000 3.08000 20.13000 0.00000 -2.03000 0.00000 -0.58000 0.00000 0.00000 66.00000 BUD14_1CKA-15_20.PDB 9.54000 -37.66000 -13.77000 -71.37000 -2.41000 85.62000 -93.27000 6.93000 38.97000 95.84000 0.00000 0.00000 0.00000 3.11000 20.05000 0.00000 -1.75000 0.00000 -0.71000 0.00000 0.00000 66.00000 BUD14_1CKA-15_21.PDB 9.32000 -37.61000 -14.65000 -71.87000 -3.48000 87.19000 -93.60000 6.99000 39.67000 96.20000 0.00000 0.00000 0.00000 3.09000 20.25000 0.00000 -1.90000 0.00000 -0.71000 0.00000 0.00000 66.00000 BUD14_1CKA-15_22.PDB 9.51000 -37.58000 -14.24000 -70.04000 -3.36000 84.94000 -91.09000 7.00000 38.51000 94.81000 0.00000 0.00000 0.00000 2.96000 19.99000 0.00000 -1.81000 0.00000 -0.60000 0.00000 0.00000 66.00000 BUD14_1CKA-15_23.PDB 9.06000 -37.63000 -14.32000 -72.15000 -2.50000 86.63000 -94.27000 7.29000 39.48000 96.03000 0.00000 0.00000 0.00000 3.08000 20.51000 0.00000 -1.83000 0.00000 -0.74000 0.00000 0.00000 66.00000 BUD14_1CKA-15_24.PDB 10.66000 -38.09000 -14.47000 -71.42000 -2.33000 87.24000 -92.50000 7.21000 39.07000 95.69000 0.00000 0.00000 0.00000 2.88000 20.39000 0.00000 -1.97000 0.00000 -0.65000 0.00000 0.00000 66.00000 BUD14_1CKA-15_25.PDB 8.50000 -37.95000 -15.00000 -71.52000 -3.13000 86.04000 -93.65000 7.46000 39.48000 96.19000 0.00000 0.00000 0.00000 3.03000 20.24000 0.00000 -1.89000 0.00000 -0.56000 0.00000 0.00000 66.00000 BUD14_1CKA-15_26.PDB 10.41000 -37.62000 -14.37000 -71.13000 -2.48000 85.99000 -92.46000 7.04000 38.94000 96.00000 0.00000 0.00000 0.00000 3.03000 20.13000 0.00000 -1.87000 0.00000 -0.67000 0.00000 0.00000 66.00000 BUD14_1CKA-15_27.PDB 10.76000 -38.16000 -14.82000 -71.81000 -3.30000 87.90000 -92.72000 7.43000 39.38000 96.47000 0.00000 0.00000 0.00000 3.24000 20.37000 0.00000 -2.03000 0.00000 -0.83000 0.00000 0.00000 66.00000 BUD14_1CKA-15_28.PDB 12.23000 -37.64000 -14.06000 -69.89000 -2.92000 85.82000 -90.24000 6.80000 38.30000 95.76000 0.00000 0.00000 0.00000 2.95000 20.66000 0.00000 -1.86000 0.00000 -0.77000 0.00000 0.00000 66.00000 BUD14_1CKA-15_29.PDB 8.41000 -37.63000 -14.45000 -70.42000 -2.12000 84.67000 -92.26000 6.86000 38.35000 94.92000 0.00000 0.00000 0.00000 3.05000 20.18000 0.00000 -1.95000 0.00000 -0.61000 0.00000 0.00000 66.00000 BUD14_1CKA-15_30.PDB 12.04000 -37.64000 -14.27000 -68.88000 -2.41000 84.49000 -89.37000 6.64000 37.56000 95.69000 0.00000 0.00000 0.00000 2.90000 20.35000 0.00000 -2.06000 0.00000 -0.60000 0.00000 0.00000 66.00000