name Intraclash total energy Backbone Hbond 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-20_1.PDB 4.23001 -10.78000 -2.10000 -3.50000 -9.97000 -0.53000 8.49000 -13.39000 0.68000 6.45000 4.01000 0.00000 0.00000 0.00000 0.01000 0.63000 0.00000 -0.42000 0.00000 -0.49000 0.00000 2.38000 66.00000 BUD14_1CKB-20_2.PDB 4.26917 -11.46000 -2.11000 -3.50000 -10.11000 -0.70000 8.56000 -13.57000 0.52000 6.51000 4.02000 0.00000 0.00000 0.00000 0.02000 0.70000 0.00000 -0.54000 0.00000 -0.58000 0.00000 2.38000 66.00000 BUD14_1CKB-20_3.PDB 4.33324 -12.06000 -2.11000 -3.54000 -10.22000 -1.14000 8.74000 -13.76000 0.85000 6.76000 3.83000 0.00000 0.00000 0.00000 0.01000 0.70000 0.00000 -0.51000 0.00000 -0.97000 0.00000 2.38000 66.00000 BUD14_1CKB-20_4.PDB 4.07925 -10.39000 -2.12000 -3.53000 -9.30000 -0.74000 8.53000 -12.27000 0.65000 5.87000 3.63000 0.00000 0.00000 0.00000 0.01000 0.69000 0.00000 -0.52000 0.00000 -0.59000 0.00000 2.38000 66.00000 BUD14_1CKB-20_5.PDB 4.31341 -10.49000 -2.06000 -2.06000 -9.95000 -0.93000 8.24000 -13.53000 0.69000 6.26000 4.11000 0.00000 0.00000 0.00000 0.02000 0.64000 0.00000 -0.40000 0.00000 -0.87000 0.00000 2.38000 66.00000 BUD14_1CKB-20_6.PDB 4.64701 -10.14000 -2.56000 -2.56000 -9.78000 -1.33000 8.93000 -12.96000 1.50000 6.29000 3.78000 0.00000 0.00000 0.00000 0.18000 0.68000 0.00000 -0.54000 0.00000 -1.08000 0.00000 2.38000 66.00000 BUD14_1CKB-20_7.PDB 4.17230 -11.52000 -2.11000 -3.53000 -10.22000 -0.53000 8.48000 -13.92000 0.82000 6.51000 4.06000 0.00000 0.00000 0.00000 0.01000 0.71000 0.00000 -0.58000 0.00000 -0.49000 0.00000 2.38000 66.00000 BUD14_1CKB-20_8.PDB 4.64633 -10.38000 -1.94000 -1.99000 -9.89000 -0.92000 8.12000 -13.47000 0.63000 6.36000 4.07000 0.00000 0.00000 0.00000 0.03000 0.68000 0.00000 -0.51000 0.00000 -0.86000 0.00000 2.38000 66.00000 BUD14_1CKB-20_9.PDB 4.28597 -11.97000 -1.51000 -2.96000 -10.20000 -0.84000 8.45000 -14.12000 0.58000 6.11000 3.65000 0.00000 0.00000 0.00000 0.04000 0.56000 0.00000 -0.56000 0.00000 -0.59000 0.00000 2.38000 66.00000 BUD14_1CKB-20_10.PDB 4.41873 -10.21000 -1.23000 -3.52000 -9.09000 -0.48000 7.77000 -12.33000 0.68000 5.14000 3.45000 0.00000 0.00000 0.00000 0.01000 0.53000 0.00000 -0.19000 0.00000 -0.42000 0.00000 2.38000 66.00000 BUD14_1CKB-20_11.PDB 4.30075 -10.59000 -2.12000 -4.36000 -10.25000 -0.59000 9.79000 -13.60000 0.84000 6.44000 3.91000 0.00000 0.00000 0.00000 0.01000 0.96000 0.00000 -0.16000 0.00000 -0.51000 0.00000 2.38000 66.00000 BUD14_1CKB-20_12.PDB 4.66356 -11.61000 -1.84000 -3.27000 -10.13000 -0.96000 8.44000 -13.89000 0.79000 6.94000 3.65000 0.00000 0.00000 0.00000 0.05000 0.70000 0.00000 -0.58000 0.00000 -0.81000 0.00000 2.38000 66.00000 BUD14_1CKB-20_13.PDB 4.31774 -9.59000 -1.97000 -2.02000 -9.01000 -0.84000 7.67000 -12.22000 0.71000 5.60000 3.71000 0.00000 0.00000 0.00000 0.02000 0.58000 0.00000 -0.46000 0.00000 -0.79000 0.00000 2.38000 66.00000 BUD14_1CKB-20_14.PDB 4.20375 -10.93000 -1.31000 -2.77000 -9.62000 -0.74000 7.80000 -13.36000 0.63000 6.07000 3.40000 0.00000 0.00000 0.00000 0.02000 0.58000 0.00000 -0.52000 0.00000 -0.54000 0.00000 2.38000 66.00000 BUD14_1CKB-20_15.PDB 4.23217 -10.73000 -2.01000 -3.46000 -10.19000 -0.82000 8.38000 -13.87000 1.56000 6.78000 3.84000 0.00000 0.00000 0.00000 0.02000 0.68000 0.00000 -0.21000 0.00000 -0.74000 0.00000 2.38000 66.00000 BUD14_1CKB-20_16.PDB 4.38081 -11.00000 -1.24000 -2.70000 -9.48000 -0.78000 7.68000 -13.10000 0.42000 5.91000 3.35000 0.00000 0.00000 0.00000 0.03000 0.58000 0.00000 -0.53000 0.00000 -0.55000 0.00000 2.38000 66.00000 BUD14_1CKB-20_17.PDB 4.10103 -11.10000 -1.82000 -3.23000 -9.69000 -0.87000 8.07000 -13.37000 1.03000 6.70000 3.42000 0.00000 0.00000 0.00000 0.01000 0.68000 0.00000 -0.62000 0.00000 -0.73000 0.00000 2.38000 66.00000 BUD14_1CKB-20_18.PDB 4.66743 -10.85000 -2.10000 -2.13000 -10.30000 -0.84000 8.48000 -14.34000 0.89000 6.51000 4.12000 0.00000 0.00000 0.00000 0.02000 0.60000 0.00000 -0.41000 0.00000 -0.76000 0.00000 2.38000 66.00000 BUD14_1CKB-20_19.PDB 4.17860 -12.11000 -1.50000 -2.94000 -10.77000 -0.48000 8.68000 -14.73000 0.64000 6.48000 3.64000 0.00000 0.00000 0.00000 0.01000 0.73000 0.00000 -0.57000 0.00000 -0.59000 0.00000 2.38000 66.00000 BUD14_1CKB-20_20.PDB 4.55676 -11.13000 -1.92000 -1.90000 -10.59000 -0.50000 8.35000 -14.57000 0.67000 6.02000 4.37000 0.00000 0.00000 0.00000 0.01000 0.52000 0.00000 -0.49000 0.00000 -0.57000 0.00000 2.38000 66.00000 BUD14_1CKB-20_21.PDB 3.82042 -11.78000 -1.93000 -3.28000 -10.26000 -0.28000 8.45000 -14.07000 0.63000 6.13000 3.79000 0.00000 0.00000 0.00000 0.01000 0.67000 0.00000 -0.54000 0.00000 -0.42000 0.00000 2.38000 66.00000 BUD14_1CKB-20_22.PDB 5.77606 -12.14000 -2.05000 -3.84000 -10.23000 -1.20000 8.90000 -13.65000 0.61000 7.02000 3.98000 0.00000 0.00000 0.00000 0.01000 0.73000 0.00000 -0.61000 0.00000 -1.10000 0.00000 2.38000 66.00000 BUD14_1CKB-20_23.PDB 4.25162 -11.70000 -2.09000 -4.37000 -10.16000 -1.61000 9.48000 -13.08000 0.80000 7.31000 3.82000 0.00000 0.00000 0.00000 0.00000 0.92000 0.00000 -0.45000 0.00000 -1.34000 0.00000 2.38000 66.00000 BUD14_1CKB-20_24.PDB 5.93213 -11.76000 -2.03000 -3.97000 -10.13000 -0.92000 8.77000 -13.49000 0.61000 6.97000 3.96000 0.00000 0.00000 0.00000 0.02000 0.66000 0.00000 -0.64000 0.00000 -0.91000 0.00000 2.38000 66.00000 BUD14_1CKB-20_25.PDB 5.26485 -12.81000 -2.10000 -4.02000 -10.23000 -1.59000 9.00000 -13.58000 0.72000 7.23000 3.83000 0.00000 0.00000 0.00000 0.01000 0.78000 0.00000 -0.60000 0.00000 -1.47000 0.00000 2.38000 66.00000 BUD14_1CKB-20_26.PDB 6.11797 -12.32000 -1.34000 -3.58000 -10.24000 -1.30000 8.75000 -13.68000 0.56000 6.68000 3.69000 0.00000 0.00000 0.00000 0.00000 0.64000 0.00000 -0.72000 0.00000 -1.14000 0.00000 2.38000 66.00000 BUD14_1CKB-20_27.PDB 5.95007 -12.73000 -1.99000 -4.21000 -10.13000 -1.80000 9.26000 -13.31000 0.62000 7.26000 3.88000 0.00000 0.00000 0.00000 0.02000 0.79000 0.00000 -0.86000 0.00000 -1.49000 0.00000 2.38000 66.00000 BUD14_1CKB-20_28.PDB 4.61533 -11.51000 -2.02000 -4.33000 -10.08000 -1.79000 9.73000 -12.80000 0.69000 7.29000 3.68000 0.00000 0.00000 0.00000 0.01000 0.97000 0.00000 -0.51000 0.00000 -1.38000 0.00000 2.38000 66.00000 BUD14_1CKB-20_29.PDB 4.15202 -8.99000 -2.07000 -3.43000 -10.44000 -0.69000 9.40000 -13.75000 2.05000 6.82000 4.15000 0.00000 0.00000 0.00000 0.02000 0.65000 0.00000 -0.45000 0.00000 -0.59000 0.00000 2.38000 66.00000 BUD14_1CKB-20_30.PDB 4.33273 -11.42000 -1.93000 -4.07000 -9.83000 -1.67000 9.37000 -12.60000 0.64000 7.28000 3.54000 0.00000 0.00000 0.00000 0.01000 0.84000 0.00000 -0.68000 0.00000 -1.48000 0.00000 2.38000 66.00000