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-9_1.PDB 6.28000 -40.86000 -16.78000 -68.53000 -2.34000 83.44000 -88.09000 10.58000 39.71000 90.26000 0.00000 0.00000 0.00000 2.83000 17.90000 0.00000 -2.84000 0.00000 -1.10000 0.00000 0.00000 65.00000 BUD14_1CKA-9_2.PDB 8.80000 -39.29000 -16.40000 -68.11000 -1.67000 81.00000 -87.58000 11.25000 39.63000 91.26000 0.00000 0.00000 0.00000 2.72000 17.65000 0.00000 -2.88000 0.00000 -1.14000 0.00000 0.00000 65.00000 BUD14_1CKA-9_3.PDB 7.29000 -39.31000 -16.60000 -67.64000 -2.36000 81.05000 -86.81000 10.51000 39.87000 90.28000 0.00000 0.00000 0.00000 2.84000 17.59000 0.00000 -3.10000 0.00000 -1.43000 0.00000 0.00000 65.00000 BUD14_1CKA-9_4.PDB 7.21000 -40.97000 -16.85000 -69.41000 -2.17000 83.70000 -89.44000 11.16000 40.10000 92.09000 0.00000 0.00000 0.00000 2.94000 17.93000 0.00000 -2.93000 0.00000 -1.02000 0.00000 0.00000 65.00000 BUD14_1CKA-9_5.PDB 5.81000 -41.08000 -17.31000 -67.98000 -2.05000 83.50000 -87.39000 8.71000 39.59000 90.24000 0.00000 0.00000 0.00000 3.67000 17.70000 0.00000 -3.09000 0.00000 -1.00000 0.00000 0.00000 65.00000 BUD14_1CKA-9_6.PDB 9.30000 -38.47000 -16.75000 -67.31000 -1.96000 80.43000 -86.77000 10.71000 39.25000 91.06000 0.00000 0.00000 0.00000 2.84000 17.41000 0.00000 -2.58000 0.00000 -1.14000 0.00000 0.00000 65.00000 BUD14_1CKA-9_7.PDB 6.54000 -39.34000 -15.28000 -67.75000 -2.23000 80.82000 -87.42000 8.45000 39.42000 91.44000 0.00000 0.00000 0.00000 2.68000 17.75000 0.00000 -2.92000 0.00000 -1.33000 0.00000 0.00000 65.00000 BUD14_1CKA-9_8.PDB 7.14000 -37.61000 -15.41000 -68.33000 -1.67000 79.54000 -89.05000 11.00000 38.50000 90.00000 0.00000 0.00000 0.00000 3.55000 17.69000 0.00000 -2.39000 0.00000 -0.99000 0.00000 0.00000 65.00000 BUD14_1CKA-9_9.PDB 6.69000 -41.05000 -17.88000 -68.19000 -1.42000 82.54000 -87.92000 10.52000 39.53000 90.48000 0.00000 0.00000 0.00000 3.13000 17.83000 0.00000 -2.66000 0.00000 -0.38000 0.00000 0.00000 65.00000 BUD14_1CKA-9_10.PDB 6.94000 -40.97000 -16.83000 -69.60000 -2.09000 84.07000 -89.47000 10.16000 40.32000 91.82000 0.00000 0.00000 0.00000 3.54000 17.88000 0.00000 -2.98000 0.00000 -1.02000 0.00000 0.00000 65.00000 BUD14_1CKA-9_11.PDB 10.03000 -37.61000 -14.41000 -68.13000 -1.75000 79.48000 -88.75000 12.42000 37.95000 90.99000 0.00000 0.00000 0.00000 3.43000 17.63000 0.00000 -2.50000 0.00000 -1.08000 0.00000 0.00000 65.00000 BUD14_1CKA-9_12.PDB 8.58000 -38.46000 -16.86000 -67.69000 -1.98000 80.32000 -87.43000 10.91000 39.52000 91.11000 0.00000 0.00000 0.00000 2.69000 17.56000 0.00000 -2.52000 0.00000 -1.05000 0.00000 0.00000 65.00000 BUD14_1CKA-9_13.PDB 8.35000 -39.29000 -17.18000 -67.11000 -1.65000 80.21000 -86.67000 10.84000 39.20000 90.79000 0.00000 0.00000 0.00000 2.63000 17.61000 0.00000 -2.53000 0.00000 -0.90000 0.00000 0.00000 65.00000 BUD14_1CKA-9_14.PDB 6.23000 -39.93000 -15.67000 -68.91000 -2.33000 81.97000 -89.14000 8.59000 40.85000 91.81000 0.00000 0.00000 0.00000 3.01000 17.86000 0.00000 -2.68000 0.00000 -1.34000 0.00000 0.00000 65.00000 BUD14_1CKA-9_15.PDB 7.42000 -39.59000 -18.72000 -67.42000 -2.37000 80.67000 -86.92000 10.85000 40.63000 91.17000 0.00000 0.00000 0.00000 2.60000 17.56000 0.00000 -2.76000 0.00000 -0.72000 0.00000 0.00000 65.00000 BUD14_1CKA-9_16.PDB 9.48000 -38.47000 -16.58000 -67.49000 -1.85000 80.10000 -87.24000 10.75000 39.20000 91.90000 0.00000 0.00000 0.00000 2.71000 17.64000 0.00000 -2.52000 0.00000 -1.03000 0.00000 0.00000 65.00000 BUD14_1CKA-9_17.PDB 9.48000 -39.26000 -17.12000 -67.16000 -1.75000 80.45000 -86.72000 10.89000 39.20000 91.75000 0.00000 0.00000 0.00000 2.70000 17.62000 0.00000 -2.47000 0.00000 -1.02000 0.00000 0.00000 65.00000 BUD14_1CKA-9_18.PDB 7.44000 -38.41000 -16.14000 -68.36000 -2.43000 81.16000 -88.22000 11.37000 39.35000 90.39000 0.00000 0.00000 0.00000 2.96000 17.62000 0.00000 -2.80000 0.00000 -1.44000 0.00000 0.00000 65.00000 BUD14_1CKA-9_19.PDB 8.86000 -38.46000 -16.46000 -66.83000 -1.18000 79.04000 -86.46000 10.74000 38.57000 90.29000 0.00000 0.00000 0.00000 2.47000 17.59000 0.00000 -2.36000 0.00000 -0.50000 0.00000 0.00000 65.00000 BUD14_1CKA-9_20.PDB 7.63000 -37.60000 -15.39000 -68.53000 -1.73000 80.23000 -89.20000 11.52000 38.40000 91.16000 0.00000 0.00000 0.00000 2.49000 17.70000 0.00000 -2.68000 0.00000 -1.03000 0.00000 0.00000 65.00000 BUD14_1CKA-9_21.PDB 8.82000 -38.36000 -17.86000 -66.89000 -1.16000 79.96000 -86.21000 11.14000 38.99000 89.54000 0.00000 0.00000 0.00000 2.68000 17.50000 0.00000 -2.55000 0.00000 -0.46000 0.00000 0.00000 65.00000 BUD14_1CKA-9_22.PDB 8.44000 -37.60000 -15.53000 -67.33000 -2.07000 79.53000 -87.62000 11.88000 38.21000 90.26000 0.00000 0.00000 0.00000 2.40000 17.72000 0.00000 -2.44000 0.00000 -1.26000 0.00000 0.00000 65.00000 BUD14_1CKA-9_23.PDB 8.89000 -37.58000 -16.19000 -67.03000 -2.12000 79.47000 -86.93000 10.70000 38.51000 91.24000 0.00000 0.00000 0.00000 2.60000 17.63000 0.00000 -2.53000 0.00000 -1.26000 0.00000 0.00000 65.00000 BUD14_1CKA-9_24.PDB 9.32000 -39.27000 -17.62000 -67.11000 -2.12000 81.14000 -86.26000 10.47000 39.94000 91.07000 0.00000 0.00000 0.00000 2.81000 17.59000 0.00000 -2.52000 0.00000 -1.23000 0.00000 0.00000 65.00000 BUD14_1CKA-9_25.PDB 8.03000 -40.08000 -15.94000 -68.11000 -2.23000 82.97000 -87.81000 10.91000 38.46000 90.73000 0.00000 0.00000 0.00000 2.96000 17.84000 0.00000 -2.69000 0.00000 -1.14000 0.00000 0.00000 65.00000 BUD14_1CKA-9_26.PDB 8.48000 -41.67000 -16.32000 -67.83000 -2.18000 83.84000 -87.01000 9.58000 39.48000 90.83000 0.00000 0.00000 0.00000 3.33000 17.69000 0.00000 -2.55000 0.00000 -1.01000 0.00000 0.00000 65.00000 BUD14_1CKA-9_27.PDB 7.83000 -40.99000 -16.61000 -69.12000 -1.39000 82.97000 -89.24000 11.12000 39.55000 91.87000 0.00000 0.00000 0.00000 2.87000 17.85000 0.00000 -2.83000 0.00000 -0.37000 0.00000 0.00000 65.00000 BUD14_1CKA-9_28.PDB 9.52000 -38.46000 -17.85000 -67.00000 -1.26000 79.76000 -86.50000 10.89000 39.21000 90.81000 0.00000 0.00000 0.00000 3.00000 17.53000 0.00000 -2.52000 0.00000 -0.56000 0.00000 0.00000 65.00000 BUD14_1CKA-9_29.PDB 7.15000 -41.02000 -16.42000 -67.76000 -1.31000 82.28000 -87.45000 9.12000 38.79000 90.85000 0.00000 0.00000 0.00000 3.25000 17.72000 0.00000 -2.81000 0.00000 -0.36000 0.00000 0.00000 65.00000 BUD14_1CKA-9_30.PDB 9.78000 -38.49000 -16.33000 -66.92000 -1.20000 79.16000 -86.57000 10.86000 38.54000 91.24000 0.00000 0.00000 0.00000 2.60000 17.61000 0.00000 -2.58000 0.00000 -0.52000 0.00000 0.00000 65.00000