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-11_1.PDB 12.34000 -39.99000 -14.72000 -66.70000 -1.62000 80.57000 -86.12000 6.69000 37.62000 93.63000 0.00000 0.00000 0.00000 5.22000 19.58000 0.00000 -1.77000 0.00000 -0.46000 0.00000 0.00000 64.00000 BUD14_1CKA-11_2.PDB 10.82000 -40.17000 -15.00000 -64.94000 -1.52000 79.31000 -83.47000 6.82000 36.37000 92.01000 0.00000 0.00000 0.00000 3.48000 19.00000 0.00000 -1.89000 0.00000 -0.17000 0.00000 0.00000 64.00000 BUD14_1CKA-11_3.PDB 12.26000 -41.79000 -18.01000 -67.93000 -2.04000 84.31000 -87.01000 8.33000 39.92000 94.53000 0.00000 0.00000 0.00000 4.88000 19.81000 0.00000 -2.72000 0.00000 -0.20000 0.00000 0.00000 64.00000 BUD14_1CKA-11_4.PDB 12.14000 -40.90000 -15.66000 -66.55000 -1.56000 81.26000 -85.64000 6.71000 37.95000 93.60000 0.00000 0.00000 0.00000 5.71000 19.37000 0.00000 -2.31000 0.00000 -0.46000 0.00000 0.00000 64.00000 BUD14_1CKA-11_5.PDB 12.48000 -39.43000 -14.19000 -66.67000 -1.77000 80.24000 -86.39000 6.89000 37.46000 93.51000 0.00000 0.00000 0.00000 5.31000 19.47000 0.00000 -1.94000 0.00000 -0.52000 0.00000 0.00000 64.00000 BUD14_1CKA-11_6.PDB 13.52000 -41.84000 -16.62000 -67.35000 -1.93000 83.86000 -86.30000 9.10000 38.17000 94.24000 0.00000 0.00000 0.00000 4.96000 19.76000 0.00000 -2.53000 0.00000 -0.23000 0.00000 0.00000 64.00000 BUD14_1CKA-11_7.PDB 9.84000 -39.90000 -14.77000 -66.52000 -1.66000 80.66000 -85.42000 6.86000 37.33000 92.16000 0.00000 0.00000 0.00000 3.37000 19.36000 0.00000 -2.02000 0.00000 -0.26000 0.00000 0.00000 64.00000 BUD14_1CKA-11_8.PDB 9.59000 -40.29000 -16.13000 -64.97000 -1.51000 79.50000 -83.98000 6.65000 37.30000 91.77000 0.00000 0.00000 0.00000 3.43000 19.03000 0.00000 -2.02000 0.00000 -0.17000 0.00000 0.00000 64.00000 BUD14_1CKA-11_9.PDB 11.13000 -40.29000 -15.04000 -66.14000 -1.25000 80.24000 -85.14000 7.37000 37.14000 92.81000 0.00000 0.00000 0.00000 3.53000 19.37000 0.00000 -1.93000 0.00000 -0.16000 0.00000 0.00000 64.00000 BUD14_1CKA-11_10.PDB 9.80000 -39.93000 -14.76000 -66.09000 -1.79000 80.06000 -85.00000 6.69000 37.07000 92.40000 0.00000 0.00000 0.00000 3.31000 19.15000 0.00000 -1.90000 0.00000 -0.27000 0.00000 0.00000 64.00000 BUD14_1CKA-11_11.PDB 11.69000 -40.85000 -15.73000 -66.80000 -2.43000 82.68000 -86.32000 8.41000 37.03000 93.64000 0.00000 0.00000 0.00000 4.78000 19.57000 0.00000 -2.27000 0.00000 -0.45000 0.00000 0.00000 64.00000 BUD14_1CKA-11_12.PDB 8.27000 -39.14000 -15.27000 -65.61000 -2.20000 78.95000 -85.02000 6.93000 36.79000 91.92000 0.00000 0.00000 0.00000 3.51000 19.22000 0.00000 -1.91000 0.00000 -0.68000 0.00000 0.00000 64.00000 BUD14_1CKA-11_13.PDB 13.32000 -41.65000 -16.41000 -67.09000 -2.62000 84.30000 -85.18000 8.49000 38.48000 93.91000 0.00000 0.00000 0.00000 4.24000 19.62000 0.00000 -2.35000 0.00000 -0.79000 0.00000 0.00000 64.00000 BUD14_1CKA-11_14.PDB 10.13000 -39.09000 -15.48000 -66.76000 -1.99000 80.06000 -87.03000 6.70000 37.52000 93.27000 0.00000 0.00000 0.00000 5.19000 19.50000 0.00000 -1.73000 0.00000 -0.54000 0.00000 0.00000 64.00000 BUD14_1CKA-11_15.PDB 8.53000 -39.94000 -15.24000 -66.04000 -1.85000 79.71000 -85.57000 6.87000 37.39000 91.94000 0.00000 0.00000 0.00000 3.71000 19.11000 0.00000 -1.87000 0.00000 -0.58000 0.00000 0.00000 64.00000 BUD14_1CKA-11_16.PDB 12.81000 -41.47000 -16.27000 -66.49000 -2.13000 83.39000 -85.79000 8.55000 37.64000 93.85000 0.00000 0.00000 0.00000 4.53000 19.62000 0.00000 -2.79000 0.00000 -0.20000 0.00000 0.00000 64.00000 BUD14_1CKA-11_17.PDB 12.12000 -41.18000 -15.97000 -67.54000 -2.02000 83.17000 -87.27000 8.35000 37.70000 94.49000 0.00000 0.00000 0.00000 4.90000 19.71000 0.00000 -2.33000 0.00000 -0.18000 0.00000 0.00000 64.00000 BUD14_1CKA-11_18.PDB 12.27000 -38.54000 -13.91000 -66.71000 -1.76000 80.12000 -86.93000 7.01000 36.75000 93.15000 0.00000 0.00000 0.00000 5.39000 19.42000 0.00000 -1.87000 0.00000 -0.43000 0.00000 0.00000 64.00000 BUD14_1CKA-11_19.PDB 10.39000 -39.82000 -14.58000 -66.29000 -1.64000 81.14000 -85.25000 7.06000 36.83000 91.69000 0.00000 0.00000 0.00000 3.22000 19.45000 0.00000 -1.80000 0.00000 -0.18000 0.00000 0.00000 64.00000 BUD14_1CKA-11_20.PDB 12.42000 -41.16000 -16.01000 -67.11000 -2.02000 83.09000 -86.61000 8.67000 37.45000 94.22000 0.00000 0.00000 0.00000 4.89000 19.61000 0.00000 -2.79000 0.00000 -0.19000 0.00000 0.00000 64.00000 BUD14_1CKA-11_21.PDB 12.81000 -41.51000 -16.37000 -66.36000 -2.12000 83.71000 -85.69000 8.46000 37.54000 93.43000 0.00000 0.00000 0.00000 4.66000 19.40000 0.00000 -2.67000 0.00000 -0.26000 0.00000 0.00000 64.00000 BUD14_1CKA-11_22.PDB 9.87000 -39.37000 -14.13000 -66.37000 -1.53000 79.90000 -85.70000 6.98000 36.40000 92.25000 0.00000 0.00000 0.00000 3.45000 19.35000 0.00000 -1.86000 0.00000 -0.16000 0.00000 0.00000 64.00000 BUD14_1CKA-11_23.PDB 10.44000 -39.51000 -14.35000 -64.98000 -1.94000 79.45000 -84.01000 6.84000 35.94000 91.65000 0.00000 0.00000 0.00000 3.50000 19.00000 0.00000 -1.95000 0.00000 -0.20000 0.00000 0.00000 64.00000 BUD14_1CKA-11_24.PDB 9.95000 -39.29000 -14.10000 -66.11000 -1.50000 79.91000 -85.65000 7.07000 36.25000 91.95000 0.00000 0.00000 0.00000 3.53000 19.26000 0.00000 -1.92000 0.00000 -0.20000 0.00000 0.00000 64.00000 BUD14_1CKA-11_25.PDB 9.93000 -39.40000 -14.14000 -66.08000 -1.73000 79.62000 -85.36000 6.95000 36.49000 92.15000 0.00000 0.00000 0.00000 3.64000 19.31000 0.00000 -1.93000 0.00000 -0.30000 0.00000 0.00000 64.00000 BUD14_1CKA-11_26.PDB 11.09000 -39.15000 -13.94000 -66.99000 -2.29000 80.42000 -87.01000 6.81000 37.26000 93.22000 0.00000 0.00000 0.00000 5.25000 19.47000 0.00000 -1.84000 0.00000 -0.66000 0.00000 0.00000 64.00000 BUD14_1CKA-11_27.PDB 13.20000 -40.77000 -15.53000 -66.80000 -2.18000 82.43000 -86.48000 10.34000 36.90000 93.69000 0.00000 0.00000 0.00000 4.14000 19.51000 0.00000 -2.21000 0.00000 -0.31000 0.00000 0.00000 64.00000 BUD14_1CKA-11_28.PDB 12.91000 -40.48000 -15.41000 -67.25000 -2.61000 83.02000 -87.09000 10.25000 37.08000 93.77000 0.00000 0.00000 0.00000 4.16000 19.46000 0.00000 -2.05000 0.00000 -0.50000 0.00000 0.00000 64.00000 BUD14_1CKA-11_29.PDB 10.61000 -39.31000 -15.45000 -66.54000 -1.87000 80.24000 -86.50000 6.74000 37.59000 92.86000 0.00000 0.00000 0.00000 5.23000 19.39000 0.00000 -1.86000 0.00000 -0.51000 0.00000 0.00000 64.00000 BUD14_1CKA-11_30.PDB 7.85000 -39.11000 -15.44000 -66.19000 -2.11000 79.70000 -85.65000 6.76000 37.18000 91.69000 0.00000 0.00000 0.00000 3.44000 19.24000 0.00000 -1.91000 0.00000 -0.51000 0.00000 0.00000 64.00000