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_1CKB-9_1.PDB 1.67000 -41.97000 -17.06000 -68.64000 -2.78000 83.46000 -88.50000 8.91000 40.12000 90.63000 0.00000 0.00000 0.00000 1.65000 19.24000 0.00000 -2.90000 0.00000 -1.25000 0.00000 0.00000 65.00000 BUD14_1CKB-9_2.PDB 2.32000 -40.19000 -18.03000 -69.43000 -3.11000 84.49000 -89.70000 10.14000 40.33000 89.69000 0.00000 0.00000 0.00000 1.93000 19.27000 0.00000 -2.53000 0.00000 -1.28000 0.00000 0.00000 65.00000 BUD14_1CKB-9_3.PDB 1.48000 -40.22000 -15.39000 -68.10000 -2.42000 81.32000 -88.95000 9.00000 38.12000 90.14000 0.00000 0.00000 0.00000 1.75000 19.20000 0.00000 -2.55000 0.00000 -1.22000 0.00000 0.00000 65.00000 BUD14_1CKB-9_4.PDB 3.70000 -40.93000 -15.31000 -68.23000 -2.48000 81.84000 -88.24000 10.36000 39.31000 89.53000 0.00000 0.00000 0.00000 1.69000 19.34000 0.00000 -2.69000 0.00000 -1.16000 0.00000 0.00000 65.00000 BUD14_1CKB-9_5.PDB 1.15000 -41.20000 -16.48000 -68.41000 -2.70000 82.18000 -88.26000 8.25000 40.54000 89.47000 0.00000 0.00000 0.00000 1.86000 19.37000 0.00000 -2.99000 0.00000 -1.12000 0.00000 0.00000 65.00000 BUD14_1CKB-9_6.PDB 1.38000 -41.80000 -17.37000 -68.49000 -2.36000 83.87000 -88.21000 7.97000 39.93000 88.98000 0.00000 0.00000 0.00000 2.32000 19.16000 0.00000 -2.33000 0.00000 -1.14000 0.00000 0.00000 65.00000 BUD14_1CKB-9_7.PDB 5.45000 -41.99000 -16.39000 -68.07000 -2.73000 82.49000 -88.33000 10.54000 39.83000 92.33000 0.00000 0.00000 0.00000 1.87000 19.35000 0.00000 -2.95000 0.00000 -1.15000 0.00000 0.00000 65.00000 BUD14_1CKB-9_8.PDB 4.67000 -42.06000 -16.36000 -67.75000 -2.77000 82.68000 -87.68000 9.72000 39.13000 91.99000 0.00000 0.00000 0.00000 1.79000 19.36000 0.00000 -2.82000 0.00000 -1.22000 0.00000 0.00000 65.00000 BUD14_1CKB-9_9.PDB 1.83000 -40.30000 -17.38000 -69.05000 -2.90000 84.04000 -89.35000 9.08000 39.16000 90.35000 0.00000 0.00000 0.00000 1.88000 19.23000 0.00000 -2.42000 0.00000 -1.28000 0.00000 0.00000 65.00000 BUD14_1CKB-9_10.PDB 2.85000 -39.55000 -14.79000 -68.42000 -2.39000 81.32000 -89.27000 10.38000 38.47000 89.19000 0.00000 0.00000 0.00000 1.69000 19.19000 0.00000 -2.60000 0.00000 -1.17000 0.00000 0.00000 65.00000 BUD14_1CKB-9_11.PDB 1.11000 -40.31000 -18.45000 -68.14000 -2.97000 83.32000 -88.08000 8.17000 40.18000 89.31000 0.00000 0.00000 0.00000 1.93000 19.31000 0.00000 -2.73000 0.00000 -1.12000 0.00000 0.00000 65.00000 BUD14_1CKB-9_12.PDB 1.99000 -41.25000 -17.30000 -68.82000 -2.33000 81.77000 -89.48000 11.04000 40.03000 90.64000 0.00000 0.00000 0.00000 1.61000 19.45000 0.00000 -2.86000 0.00000 -1.05000 0.00000 0.00000 65.00000 BUD14_1CKB-9_13.PDB 0.98000 -41.10000 -16.33000 -68.43000 -2.46000 81.52000 -89.22000 8.98000 39.46000 90.02000 0.00000 0.00000 0.00000 1.95000 19.15000 0.00000 -2.39000 0.00000 -1.02000 0.00000 0.00000 65.00000 BUD14_1CKB-9_14.PDB 3.12000 -39.52000 -14.72000 -67.31000 -2.52000 80.46000 -87.61000 8.86000 38.00000 89.36000 0.00000 0.00000 0.00000 1.71000 19.21000 0.00000 -2.43000 0.00000 -1.15000 0.00000 0.00000 65.00000 BUD14_1CKB-9_15.PDB 2.34000 -41.31000 -16.68000 -68.63000 -2.75000 82.52000 -88.28000 9.46000 40.45000 89.50000 0.00000 0.00000 0.00000 1.74000 19.46000 0.00000 -2.53000 0.00000 -1.14000 0.00000 0.00000 65.00000 BUD14_1CKB-9_16.PDB 3.38000 -40.31000 -14.71000 -67.95000 -2.45000 81.28000 -88.18000 10.84000 38.61000 88.37000 0.00000 0.00000 0.00000 1.73000 19.37000 0.00000 -2.68000 0.00000 -1.16000 0.00000 0.00000 65.00000 BUD14_1CKB-9_17.PDB 1.21000 -42.49000 -20.30000 -69.05000 -2.82000 85.80000 -88.87000 10.10000 40.93000 90.17000 0.00000 0.00000 0.00000 1.71000 19.39000 0.00000 -2.77000 0.00000 -1.19000 0.00000 0.00000 65.00000 BUD14_1CKB-9_18.PDB 4.35000 -41.26000 -16.25000 -69.12000 -2.34000 82.79000 -90.19000 9.96000 39.42000 92.99000 0.00000 0.00000 0.00000 2.00000 19.24000 0.00000 -2.58000 0.00000 -1.06000 0.00000 0.00000 65.00000 BUD14_1CKB-9_19.PDB 2.81000 -42.51000 -16.90000 -68.44000 -2.51000 83.33000 -88.65000 9.00000 40.27000 91.73000 0.00000 0.00000 0.00000 1.84000 19.27000 0.00000 -3.19000 0.00000 -1.15000 0.00000 0.00000 65.00000 BUD14_1CKB-9_20.PDB 3.03000 -39.92000 -17.04000 -68.23000 -3.03000 83.58000 -88.70000 9.00000 39.30000 89.66000 0.00000 0.00000 0.00000 2.08000 19.40000 0.00000 -2.42000 0.00000 -1.25000 0.00000 0.00000 65.00000 BUD14_1CKB-9_21.PDB 3.18000 -41.07000 -16.30000 -69.41000 -2.60000 82.86000 -90.43000 10.49000 40.24000 90.62000 0.00000 0.00000 0.00000 2.38000 19.34000 0.00000 -2.45000 0.00000 -1.16000 0.00000 0.00000 65.00000 BUD14_1CKB-9_22.PDB 5.93000 -40.05000 -14.49000 -67.62000 -2.87000 81.99000 -87.30000 9.35000 38.65000 90.01000 0.00000 0.00000 0.00000 1.95000 19.33000 0.00000 -2.59000 0.00000 -1.12000 0.00000 0.00000 65.00000 BUD14_1CKB-9_23.PDB 3.94000 -41.05000 -18.33000 -67.84000 -3.22000 84.07000 -87.43000 8.97000 40.09000 90.76000 0.00000 0.00000 0.00000 1.84000 19.16000 0.00000 -2.65000 0.00000 -1.26000 0.00000 0.00000 65.00000 BUD14_1CKB-9_24.PDB 2.14000 -40.28000 -16.53000 -67.84000 -2.52000 81.30000 -88.60000 10.07000 38.48000 89.92000 0.00000 0.00000 0.00000 1.87000 19.25000 0.00000 -2.58000 0.00000 -1.13000 0.00000 0.00000 65.00000 BUD14_1CKB-9_25.PDB 2.24000 -39.56000 -15.74000 -67.97000 -2.60000 80.78000 -88.87000 9.62000 38.91000 89.61000 0.00000 0.00000 0.00000 1.78000 19.06000 0.00000 -2.60000 0.00000 -1.12000 0.00000 0.00000 65.00000 BUD14_1CKB-9_26.PDB 2.59000 -39.60000 -17.75000 -67.50000 -3.12000 82.69000 -87.40000 8.88000 39.22000 89.00000 0.00000 0.00000 0.00000 1.87000 19.21000 0.00000 -2.45000 0.00000 -1.26000 0.00000 0.00000 65.00000 BUD14_1CKB-9_27.PDB 1.50000 -41.02000 -17.68000 -67.79000 -2.55000 82.61000 -87.46000 9.11000 39.76000 88.20000 0.00000 0.00000 0.00000 1.76000 19.23000 0.00000 -2.44000 0.00000 -1.01000 0.00000 0.00000 65.00000 BUD14_1CKB-9_28.PDB 3.53000 -39.56000 -16.45000 -67.31000 -2.79000 80.69000 -87.52000 8.77000 39.12000 90.16000 0.00000 0.00000 0.00000 1.91000 19.25000 0.00000 -2.46000 0.00000 -1.03000 0.00000 0.00000 65.00000 BUD14_1CKB-9_29.PDB 2.87000 -40.31000 -16.36000 -67.94000 -2.82000 82.15000 -88.31000 8.72000 39.63000 89.88000 0.00000 0.00000 0.00000 1.90000 19.11000 0.00000 -2.47000 0.00000 -1.20000 0.00000 0.00000 65.00000 BUD14_1CKB-9_30.PDB 1.32000 -41.12000 -15.52000 -68.40000 -2.39000 81.29000 -89.28000 9.61000 38.91000 90.54000 0.00000 0.00000 0.00000 1.67000 19.36000 0.00000 -2.90000 0.00000 -1.08000 0.00000 0.00000 65.00000