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-13_1.PDB 3.60267 -10.15000 -1.77000 -2.61000 -7.41000 -1.12000 6.00000 -10.38000 1.33000 4.96000 2.35000 0.00000 0.00000 0.00000 0.04000 0.69000 0.00000 -0.32000 0.00000 -1.22000 0.00000 2.38000 65.00000 BUD14_1CKB-13_2.PDB 2.97682 -10.92000 -1.69000 -3.16000 -7.89000 -0.66000 6.07000 -11.28000 1.29000 4.81000 2.40000 0.00000 0.00000 0.00000 0.11000 0.52000 0.00000 -0.44000 0.00000 -0.47000 0.00000 2.38000 65.00000 BUD14_1CKB-13_3.PDB 3.65872 -9.46000 -1.71000 -2.51000 -6.95000 -0.89000 5.56000 -9.80000 1.37000 4.79000 2.02000 0.00000 0.00000 0.00000 0.03000 0.61000 0.00000 -0.32000 0.00000 -1.05000 0.00000 2.38000 65.00000 BUD14_1CKB-13_4.PDB 3.23899 -8.81000 -0.91000 -3.29000 -6.67000 -0.71000 5.17000 -9.66000 1.45000 4.23000 2.51000 0.00000 0.00000 0.00000 0.03000 0.49000 0.00000 -0.36000 0.00000 -0.60000 0.00000 2.38000 65.00000 BUD14_1CKB-13_5.PDB 3.78438 -9.40000 -1.79000 -1.67000 -7.29000 -1.44000 6.21000 -10.07000 1.55000 4.77000 2.30000 0.00000 0.00000 0.00000 0.02000 0.71000 0.00000 -0.65000 0.00000 -1.36000 0.00000 2.38000 65.00000 BUD14_1CKB-13_6.PDB 3.68116 -9.37000 -1.69000 -3.14000 -6.85000 -0.37000 5.10000 -9.82000 1.24000 4.70000 1.96000 0.00000 0.00000 0.00000 0.04000 0.56000 0.00000 -0.28000 0.00000 -0.26000 0.00000 2.38000 65.00000 BUD14_1CKB-13_7.PDB 4.47009 -11.36000 -1.80000 -2.65000 -8.12000 -1.17000 6.46000 -11.21000 1.22000 5.29000 2.22000 0.00000 0.00000 0.00000 0.07000 0.64000 0.00000 -0.49000 0.00000 -1.18000 0.00000 2.38000 65.00000 BUD14_1CKB-13_8.PDB 4.62349 -11.59000 -1.82000 -3.22000 -8.22000 -0.92000 6.45000 -11.39000 1.48000 5.05000 2.20000 0.00000 0.00000 0.00000 0.06000 0.66000 0.00000 -0.63000 0.00000 -0.62000 0.00000 2.38000 65.00000 BUD14_1CKB-13_9.PDB 4.14713 -10.11000 -0.86000 -2.51000 -7.12000 -0.91000 5.24000 -10.15000 1.48000 4.22000 1.71000 0.00000 0.00000 0.00000 0.05000 0.61000 0.00000 -0.20000 0.00000 -1.07000 0.00000 2.38000 65.00000 BUD14_1CKB-13_10.PDB 3.61092 -9.24000 -0.88000 -2.53000 -7.30000 -1.09000 6.19000 -10.27000 1.14000 4.58000 2.22000 0.00000 0.00000 0.00000 0.09000 0.45000 0.00000 -0.24000 0.00000 -1.16000 0.00000 2.38000 65.00000 BUD14_1CKB-13_11.PDB 3.64587 -9.68000 -1.73000 -2.57000 -7.61000 -0.95000 6.32000 -10.63000 1.30000 5.06000 2.38000 0.00000 0.00000 0.00000 0.05000 0.52000 0.00000 -0.25000 0.00000 -1.05000 0.00000 2.38000 65.00000 BUD14_1CKB-13_12.PDB 3.42909 -11.35000 -1.77000 -2.53000 -8.00000 -1.24000 6.48000 -11.15000 1.31000 5.10000 2.00000 0.00000 0.00000 0.00000 0.05000 0.68000 0.00000 -0.42000 0.00000 -1.19000 0.00000 2.38000 65.00000 BUD14_1CKB-13_13.PDB 3.29186 -10.99000 -1.79000 -3.26000 -7.66000 -0.82000 5.93000 -10.69000 1.23000 5.02000 2.20000 0.00000 0.00000 0.00000 0.04000 0.67000 0.00000 -0.53000 0.00000 -0.66000 0.00000 2.38000 65.00000 BUD14_1CKB-13_14.PDB 3.66297 -10.34000 -0.95000 -1.82000 -7.93000 -1.15000 5.54000 -11.55000 1.33000 5.48000 2.11000 0.00000 0.00000 0.00000 0.10000 0.62000 0.00000 -0.30000 0.00000 -1.20000 0.00000 2.38000 65.00000 BUD14_1CKB-13_15.PDB 3.38789 -11.06000 -1.79000 -3.26000 -8.08000 -0.79000 6.46000 -11.45000 1.65000 4.74000 2.47000 0.00000 0.00000 0.00000 0.04000 0.67000 0.00000 -0.49000 0.00000 -0.57000 0.00000 2.38000 65.00000 BUD14_1CKB-13_16.PDB 4.18009 -9.97000 -1.76000 -3.19000 -7.49000 -0.83000 6.19000 -10.57000 1.31000 5.03000 2.33000 0.00000 0.00000 0.00000 0.06000 0.67000 0.00000 -0.45000 0.00000 -0.61000 0.00000 2.38000 65.00000 BUD14_1CKB-13_17.PDB 2.81359 -12.51000 -1.76000 -3.41000 -8.33000 -1.06000 6.85000 -11.63000 1.36000 4.87000 1.94000 0.00000 0.00000 0.00000 0.05000 0.66000 0.00000 -0.75000 0.00000 -0.64000 0.00000 2.38000 65.00000 BUD14_1CKB-13_18.PDB 3.71344 -10.11000 -0.89000 -2.47000 -7.35000 -0.92000 5.54000 -10.25000 1.22000 4.42000 1.85000 0.00000 0.00000 0.00000 0.06000 0.52000 0.00000 -0.27000 0.00000 -1.07000 0.00000 2.38000 65.00000 BUD14_1CKB-13_19.PDB 3.38339 -11.20000 -1.01000 -2.47000 -8.21000 -0.87000 5.55000 -12.00000 1.38000 5.35000 2.09000 0.00000 0.00000 0.00000 0.07000 0.66000 0.00000 -0.46000 0.00000 -0.64000 0.00000 2.38000 65.00000 BUD14_1CKB-13_20.PDB 3.97127 -8.68000 -0.89000 -2.57000 -6.67000 -1.06000 5.47000 -9.47000 1.69000 4.09000 2.17000 0.00000 0.00000 0.00000 0.02000 0.56000 0.00000 -0.30000 0.00000 -1.17000 0.00000 2.38000 65.00000 BUD14_1CKB-13_21.PDB 3.72884 -8.99000 -0.87000 -2.60000 -6.99000 -1.12000 5.74000 -9.95000 1.56000 4.37000 2.26000 0.00000 0.00000 0.00000 0.03000 0.52000 0.00000 -0.22000 0.00000 -1.20000 0.00000 2.38000 65.00000 BUD14_1CKB-13_22.PDB 3.60711 -10.66000 -1.77000 -2.57000 -7.44000 -1.08000 6.04000 -10.29000 1.29000 5.01000 1.75000 0.00000 0.00000 0.00000 0.03000 0.60000 0.00000 -0.57000 0.00000 -1.06000 0.00000 2.38000 65.00000 BUD14_1CKB-13_23.PDB 3.47092 -9.68000 -0.89000 -3.16000 -6.89000 -0.78000 5.06000 -9.87000 1.34000 4.44000 1.90000 0.00000 0.00000 0.00000 0.07000 0.58000 0.00000 -0.26000 0.00000 -0.63000 0.00000 2.38000 65.00000 BUD14_1CKB-13_24.PDB 3.42887 -9.86000 -1.00000 -1.83000 -7.28000 -1.09000 5.11000 -10.55000 1.29000 5.48000 1.64000 0.00000 0.00000 0.00000 0.05000 0.71000 0.00000 -0.48000 0.00000 -1.19000 0.00000 2.38000 65.00000 BUD14_1CKB-13_25.PDB 3.27108 -9.17000 -1.75000 -3.20000 -6.86000 -0.46000 5.38000 -9.70000 1.13000 4.75000 2.28000 0.00000 0.00000 0.00000 0.02000 0.61000 0.00000 -0.36000 0.00000 -0.39000 0.00000 2.38000 65.00000 BUD14_1CKB-13_26.PDB 3.89917 -11.20000 -1.77000 -3.23000 -7.54000 -0.83000 6.01000 -10.59000 1.33000 4.82000 1.60000 0.00000 0.00000 0.00000 0.03000 0.66000 0.00000 -0.50000 0.00000 -0.54000 0.00000 2.38000 65.00000 BUD14_1CKB-13_27.PDB 3.49228 -10.42000 -1.78000 -3.20000 -7.36000 -0.83000 6.10000 -10.26000 1.30000 4.53000 2.32000 0.00000 0.00000 0.00000 0.01000 0.62000 0.00000 -0.59000 0.00000 -0.66000 0.00000 2.38000 65.00000 BUD14_1CKB-13_28.PDB 3.77521 -10.65000 -0.12000 -2.54000 -7.33000 -0.78000 4.80000 -10.90000 1.02000 4.78000 1.28000 0.00000 0.00000 0.00000 0.03000 0.52000 0.00000 -0.26000 0.00000 -0.61000 0.00000 2.38000 65.00000 BUD14_1CKB-13_29.PDB 4.10904 -9.16000 -1.79000 -2.50000 -7.02000 -1.02000 5.84000 -9.84000 1.56000 4.90000 2.25000 0.00000 0.00000 0.00000 0.05000 0.71000 0.00000 -0.42000 0.00000 -1.17000 0.00000 2.38000 65.00000 BUD14_1CKB-13_30.PDB 3.43370 -9.40000 -1.80000 -2.61000 -7.14000 -1.14000 6.15000 -9.85000 1.27000 4.97000 2.33000 0.00000 0.00000 0.00000 0.04000 0.70000 0.00000 -0.40000 0.00000 -1.23000 0.00000 2.38000 65.00000