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-17_1.PDB 6.94000 -42.43000 -19.89000 -72.59000 -3.06000 89.21000 -93.44000 10.06000 41.89000 97.08000 0.00000 0.00000 0.00000 3.49000 20.51000 0.00000 -2.20000 0.00000 -1.17000 0.00000 0.00000 66.00000 BUD14_1CKB-17_2.PDB 8.25000 -42.18000 -19.94000 -71.71000 -3.38000 88.59000 -91.98000 12.86000 41.72000 95.38000 0.00000 0.00000 0.00000 2.93000 20.39000 0.00000 -2.64000 0.00000 -1.40000 0.00000 0.00000 66.00000 BUD14_1CKB-17_3.PDB 8.03000 -42.54000 -19.87000 -71.63000 -3.01000 88.38000 -92.24000 10.88000 41.48000 96.67000 0.00000 0.00000 0.00000 3.48000 20.55000 0.00000 -2.40000 0.00000 -1.17000 0.00000 0.00000 66.00000 BUD14_1CKB-17_4.PDB 6.14000 -42.12000 -19.36000 -72.82000 -2.96000 89.24000 -93.66000 10.24000 41.68000 95.84000 0.00000 0.00000 0.00000 3.31000 20.53000 0.00000 -2.11000 0.00000 -1.13000 0.00000 0.00000 66.00000 BUD14_1CKB-17_5.PDB 8.22000 -42.58000 -19.91000 -71.58000 -3.34000 88.87000 -92.01000 11.31000 41.84000 96.73000 0.00000 0.00000 0.00000 2.69000 20.57000 0.00000 -2.45000 0.00000 -1.35000 0.00000 0.00000 66.00000 BUD14_1CKB-17_6.PDB 7.03000 -42.20000 -19.90000 -72.21000 -3.44000 89.19000 -92.82000 11.84000 42.25000 95.39000 0.00000 0.00000 0.00000 2.74000 20.59000 0.00000 -2.40000 0.00000 -1.42000 0.00000 0.00000 66.00000 BUD14_1CKB-17_7.PDB 7.54000 -41.52000 -18.50000 -72.05000 -2.78000 88.41000 -93.01000 11.61000 40.30000 95.53000 0.00000 0.00000 0.00000 2.63000 20.71000 0.00000 -2.26000 0.00000 -0.82000 0.00000 0.00000 66.00000 BUD14_1CKB-17_8.PDB 7.34000 -41.82000 -19.19000 -71.16000 -2.51000 87.12000 -92.34000 12.25000 39.49000 95.81000 0.00000 0.00000 0.00000 2.54000 20.51000 0.00000 -2.38000 0.00000 -0.48000 0.00000 0.00000 66.00000 BUD14_1CKB-17_9.PDB 10.24000 -41.55000 -15.91000 -71.17000 -1.58000 86.31000 -92.40000 12.30000 38.88000 95.04000 0.00000 0.00000 0.00000 2.81000 20.52000 0.00000 -2.17000 0.00000 -0.32000 0.00000 0.00000 66.00000 BUD14_1CKB-17_10.PDB 8.17000 -42.43000 -17.08000 -72.79000 -1.64000 88.00000 -94.18000 10.06000 40.40000 97.33000 0.00000 0.00000 0.00000 3.33000 20.34000 0.00000 -2.48000 0.00000 -0.35000 0.00000 0.00000 66.00000 BUD14_1CKB-17_11.PDB 7.02000 -42.00000 -18.31000 -71.41000 -2.96000 86.65000 -91.73000 10.20000 40.86000 95.59000 0.00000 0.00000 0.00000 3.38000 20.43000 0.00000 -2.12000 0.00000 -1.14000 0.00000 0.00000 66.00000 BUD14_1CKB-17_12.PDB 5.02000 -43.01000 -20.48000 -72.77000 -2.68000 90.46000 -93.75000 11.71000 40.97000 95.00000 0.00000 0.00000 0.00000 2.52000 20.69000 0.00000 -2.38000 0.00000 -0.56000 0.00000 0.00000 66.00000 BUD14_1CKB-17_13.PDB 6.46000 -41.46000 -19.06000 -71.46000 -2.79000 87.53000 -92.33000 10.75000 39.98000 95.01000 0.00000 0.00000 0.00000 3.14000 20.46000 0.00000 -2.05000 0.00000 -0.81000 0.00000 0.00000 66.00000 BUD14_1CKB-17_14.PDB 7.30000 -41.44000 -17.43000 -71.33000 -2.72000 86.17000 -92.19000 10.79000 39.88000 95.05000 0.00000 0.00000 0.00000 3.36000 20.25000 0.00000 -2.01000 0.00000 -0.82000 0.00000 0.00000 66.00000 BUD14_1CKB-17_15.PDB 5.71000 -41.47000 -18.89000 -71.40000 -2.52000 87.18000 -92.49000 11.18000 39.58000 94.43000 0.00000 0.00000 0.00000 2.80000 20.61000 0.00000 -2.17000 0.00000 -0.53000 0.00000 0.00000 66.00000 BUD14_1CKB-17_16.PDB 8.69000 -41.43000 -15.97000 -71.23000 -1.82000 86.65000 -92.46000 10.84000 38.98000 95.18000 0.00000 0.00000 0.00000 2.59000 20.55000 0.00000 -2.27000 0.00000 -0.38000 0.00000 0.00000 66.00000 BUD14_1CKB-17_17.PDB 8.27000 -42.32000 -16.91000 -71.55000 -2.22000 87.04000 -92.53000 10.43000 40.41000 95.79000 0.00000 0.00000 0.00000 3.15000 20.19000 0.00000 -2.41000 0.00000 -0.62000 0.00000 0.00000 66.00000 BUD14_1CKB-17_18.PDB 6.98000 -42.75000 -20.30000 -70.55000 -2.92000 86.86000 -90.67000 9.25000 40.97000 97.04000 0.00000 0.00000 0.00000 3.38000 20.25000 0.00000 -2.23000 0.00000 -1.11000 0.00000 0.00000 66.00000 BUD14_1CKB-17_19.PDB 8.04000 -42.22000 -16.89000 -71.84000 -2.15000 87.59000 -92.91000 11.19000 40.58000 95.19000 0.00000 0.00000 0.00000 2.68000 20.55000 0.00000 -2.52000 0.00000 -0.65000 0.00000 0.00000 66.00000 BUD14_1CKB-17_20.PDB 6.34000 -42.47000 -20.00000 -70.52000 -3.08000 86.39000 -90.68000 9.74000 41.04000 95.94000 0.00000 0.00000 0.00000 3.32000 20.21000 0.00000 -2.16000 0.00000 -1.18000 0.00000 0.00000 66.00000 BUD14_1CKB-17_21.PDB 6.12000 -41.54000 -18.59000 -71.73000 -1.67000 86.79000 -92.85000 10.02000 40.08000 95.17000 0.00000 0.00000 0.00000 3.15000 20.34000 0.00000 -2.31000 0.00000 -0.39000 0.00000 0.00000 66.00000 BUD14_1CKB-17_22.PDB 5.32000 -41.78000 -19.23000 -72.32000 -2.51000 88.07000 -93.70000 10.00000 39.87000 96.34000 0.00000 0.00000 0.00000 3.19000 20.65000 0.00000 -2.09000 0.00000 -0.51000 0.00000 0.00000 66.00000 BUD14_1CKB-17_23.PDB 8.99000 -41.46000 -19.04000 -72.10000 -2.71000 88.49000 -93.00000 11.51000 40.43000 95.64000 0.00000 0.00000 0.00000 4.03000 20.44000 0.00000 -1.98000 0.00000 -0.82000 0.00000 0.00000 66.00000 BUD14_1CKB-17_24.PDB 6.76000 -41.48000 -17.19000 -72.31000 -2.47000 87.67000 -93.61000 11.56000 39.76000 95.16000 0.00000 0.00000 0.00000 2.59000 20.71000 0.00000 -2.37000 0.00000 -0.55000 0.00000 0.00000 66.00000 BUD14_1CKB-17_25.PDB 8.40000 -42.00000 -17.02000 -73.01000 -1.78000 88.41000 -94.36000 11.56000 40.83000 96.00000 0.00000 0.00000 0.00000 2.62000 20.52000 0.00000 -2.42000 0.00000 -0.44000 0.00000 0.00000 66.00000 BUD14_1CKB-17_26.PDB 11.16000 -41.75000 -16.97000 -70.59000 -2.54000 86.28000 -91.43000 11.11000 39.22000 97.12000 0.00000 0.00000 0.00000 4.00000 19.89000 0.00000 -2.56000 0.00000 -0.71000 0.00000 0.00000 66.00000 BUD14_1CKB-17_27.PDB 6.81000 -41.44000 -18.86000 -71.79000 -1.63000 86.94000 -93.07000 10.54000 40.17000 95.07000 0.00000 0.00000 0.00000 3.20000 20.30000 0.00000 -1.93000 0.00000 -0.38000 0.00000 0.00000 66.00000 BUD14_1CKB-17_28.PDB 6.42000 -42.71000 -20.39000 -72.65000 -2.63000 89.94000 -92.80000 9.86000 42.02000 94.84000 0.00000 0.00000 0.00000 4.31000 20.69000 0.00000 -2.39000 0.00000 -0.97000 0.00000 0.00000 66.00000 BUD14_1CKB-17_29.PDB 7.29000 -42.07000 -16.98000 -71.86000 -1.86000 87.20000 -93.05000 9.96000 40.12000 95.14000 0.00000 0.00000 0.00000 3.22000 20.40000 0.00000 -2.11000 0.00000 -0.41000 0.00000 0.00000 66.00000 BUD14_1CKB-17_30.PDB 7.05000 -42.10000 -16.77000 -72.03000 -1.82000 87.09000 -93.15000 9.64000 40.08000 95.42000 0.00000 0.00000 0.00000 3.46000 20.29000 0.00000 -2.37000 0.00000 -0.40000 0.00000 0.00000 66.00000