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-20_1.PDB 6.24000 -42.48000 -16.18000 -69.69000 -1.85000 82.90000 -90.54000 10.22000 39.49000 95.66000 0.00000 0.00000 0.00000 1.76000 19.83000 0.00000 -2.54000 0.00000 -0.49000 0.00000 0.00000 66.00000 BUD14_1CKB-20_2.PDB 5.32000 -42.48000 -16.17000 -70.28000 -2.10000 83.34000 -91.35000 10.02000 39.90000 95.77000 0.00000 0.00000 0.00000 1.87000 19.85000 0.00000 -2.62000 0.00000 -0.58000 0.00000 0.00000 66.00000 BUD14_1CKB-20_3.PDB 4.78000 -42.48000 -16.15000 -70.05000 -2.47000 83.20000 -91.14000 10.56000 39.84000 95.34000 0.00000 0.00000 0.00000 1.68000 19.84000 0.00000 -2.58000 0.00000 -0.97000 0.00000 0.00000 66.00000 BUD14_1CKB-20_4.PDB 5.98000 -42.47000 -16.19000 -69.97000 -2.18000 83.77000 -90.71000 10.11000 39.48000 95.70000 0.00000 0.00000 0.00000 1.63000 19.86000 0.00000 -2.61000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1CKB-20_5.PDB 6.01000 -42.34000 -15.94000 -69.44000 -2.30000 82.85000 -90.26000 10.27000 39.78000 95.04000 0.00000 0.00000 0.00000 1.73000 19.84000 0.00000 -2.50000 0.00000 -0.87000 0.00000 0.00000 66.00000 BUD14_1CKB-20_6.PDB 6.36000 -42.06000 -14.30000 -70.93000 -2.69000 84.83000 -91.79000 10.85000 40.08000 93.49000 0.00000 0.00000 0.00000 2.46000 19.90000 0.00000 -2.49000 0.00000 -1.08000 0.00000 0.00000 66.00000 BUD14_1CKB-20_7.PDB 5.37000 -42.48000 -16.21000 -70.69000 -1.93000 83.57000 -92.04000 10.29000 40.06000 96.23000 0.00000 0.00000 0.00000 1.75000 19.91000 0.00000 -2.69000 0.00000 -0.49000 0.00000 0.00000 66.00000 BUD14_1CKB-20_8.PDB 6.20000 -42.27000 -15.76000 -70.04000 -2.26000 83.31000 -91.05000 10.59000 39.94000 95.31000 0.00000 0.00000 0.00000 1.84000 19.87000 0.00000 -2.53000 0.00000 -0.86000 0.00000 0.00000 66.00000 BUD14_1CKB-20_9.PDB 5.14000 -41.85000 -15.60000 -70.14000 -2.13000 83.35000 -91.44000 10.15000 39.12000 95.26000 0.00000 0.00000 0.00000 1.73000 19.87000 0.00000 -2.73000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1CKB-20_10.PDB 7.26000 -41.58000 -16.15000 -69.44000 -1.91000 82.82000 -90.26000 10.90000 38.58000 95.38000 0.00000 0.00000 0.00000 1.59000 19.76000 0.00000 -2.24000 0.00000 -0.42000 0.00000 0.00000 66.00000 BUD14_1CKB-20_11.PDB 6.64000 -42.50000 -16.98000 -70.60000 -2.01000 84.91000 -91.51000 10.45000 39.78000 96.14000 0.00000 0.00000 0.00000 1.70000 20.08000 0.00000 -2.24000 0.00000 -0.51000 0.00000 0.00000 66.00000 BUD14_1CKB-20_12.PDB 5.08000 -42.21000 -15.91000 -70.21000 -2.29000 83.31000 -91.57000 10.46000 39.94000 95.02000 0.00000 0.00000 0.00000 2.03000 19.80000 0.00000 -2.69000 0.00000 -0.81000 0.00000 0.00000 66.00000 BUD14_1CKB-20_13.PDB 6.88000 -42.27000 -15.88000 -69.17000 -2.20000 82.78000 -89.84000 9.73000 39.45000 95.00000 0.00000 0.00000 0.00000 2.56000 19.59000 0.00000 -2.48000 0.00000 -0.79000 0.00000 0.00000 66.00000 BUD14_1CKB-20_14.PDB 5.16000 -41.67000 -15.41000 -70.27000 -2.09000 82.95000 -91.73000 10.18000 39.48000 95.07000 0.00000 0.00000 0.00000 1.80000 19.78000 0.00000 -2.61000 0.00000 -0.54000 0.00000 0.00000 66.00000 BUD14_1CKB-20_15.PDB 5.66000 -42.41000 -16.13000 -70.69000 -2.21000 83.35000 -92.08000 11.18000 40.23000 95.72000 0.00000 0.00000 0.00000 1.75000 19.82000 0.00000 -2.31000 0.00000 -0.74000 0.00000 0.00000 66.00000 BUD14_1CKB-20_16.PDB 5.38000 -41.63000 -15.38000 -70.15000 -2.17000 83.12000 -91.44000 10.06000 39.16000 95.25000 0.00000 0.00000 0.00000 1.76000 19.77000 0.00000 -2.62000 0.00000 -0.55000 0.00000 0.00000 66.00000 BUD14_1CKB-20_17.PDB 5.05000 -43.02000 -16.71000 -69.86000 -2.26000 83.81000 -91.11000 10.49000 40.41000 95.13000 0.00000 0.00000 0.00000 1.62000 19.78000 0.00000 -2.73000 0.00000 -0.73000 0.00000 0.00000 66.00000 BUD14_1CKB-20_18.PDB 6.50000 -42.40000 -16.03000 -69.46000 -2.22000 83.17000 -90.51000 10.82000 39.74000 94.90000 0.00000 0.00000 0.00000 1.74000 19.77000 0.00000 -2.47000 0.00000 -0.76000 0.00000 0.00000 66.00000 BUD14_1CKB-20_19.PDB 4.99000 -41.85000 -15.61000 -70.75000 -1.78000 83.47000 -92.10000 10.22000 39.61000 95.43000 0.00000 0.00000 0.00000 1.62000 19.97000 0.00000 -2.69000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1CKB-20_20.PDB 6.30000 -41.07000 -13.39000 -70.23000 -1.90000 82.53000 -91.60000 10.67000 38.76000 93.51000 0.00000 0.00000 0.00000 2.01000 19.76000 0.00000 -2.44000 0.00000 -0.57000 0.00000 0.00000 66.00000 BUD14_1CKB-20_21.PDB 5.36000 -41.48000 -15.05000 -70.73000 -1.66000 83.54000 -91.92000 8.97000 39.62000 94.69000 0.00000 0.00000 0.00000 2.46000 19.67000 0.00000 -2.66000 0.00000 -0.42000 0.00000 0.00000 66.00000 BUD14_1CKB-20_22.PDB 7.38000 -42.40000 -16.38000 -70.49000 -2.69000 84.05000 -91.55000 11.69000 40.31000 96.87000 0.00000 0.00000 0.00000 1.75000 19.87000 0.00000 -2.70000 0.00000 -1.10000 0.00000 0.00000 66.00000 BUD14_1CKB-20_23.PDB 5.45000 -42.46000 -17.05000 -69.86000 -3.05000 83.93000 -90.26000 10.41000 40.42000 95.60000 0.00000 0.00000 0.00000 1.69000 20.07000 0.00000 -2.58000 0.00000 -1.34000 0.00000 0.00000 66.00000 BUD14_1CKB-20_24.PDB 7.33000 -42.43000 -16.66000 -70.92000 -2.45000 84.18000 -92.16000 11.78000 40.68000 97.01000 0.00000 0.00000 0.00000 1.96000 19.80000 0.00000 -2.77000 0.00000 -0.91000 0.00000 0.00000 66.00000 BUD14_1CKB-20_25.PDB 6.33000 -42.30000 -17.48000 -70.41000 -3.08000 84.26000 -91.25000 11.18000 41.01000 96.71000 0.00000 0.00000 0.00000 1.87000 19.94000 0.00000 -2.71000 0.00000 -1.47000 0.00000 0.00000 66.00000 BUD14_1CKB-20_26.PDB 7.28000 -41.75000 -16.24000 -71.01000 -2.83000 84.28000 -92.22000 12.49000 40.10000 96.74000 0.00000 0.00000 0.00000 1.65000 19.86000 0.00000 -2.79000 0.00000 -1.14000 0.00000 0.00000 66.00000 BUD14_1CKB-20_27.PDB 6.08000 -42.39000 -16.72000 -71.13000 -3.34000 84.82000 -92.23000 11.72000 41.07000 96.80000 0.00000 0.00000 0.00000 1.93000 19.90000 0.00000 -2.98000 0.00000 -1.49000 0.00000 0.00000 66.00000 BUD14_1CKB-20_28.PDB 5.40000 -42.43000 -17.01000 -70.05000 -3.31000 84.09000 -90.45000 10.97000 40.49000 95.37000 0.00000 0.00000 0.00000 1.72000 20.16000 0.00000 -2.61000 0.00000 -1.38000 0.00000 0.00000 66.00000 BUD14_1CKB-20_29.PDB 8.74000 -42.43000 -16.03000 -69.92000 -2.08000 83.86000 -90.53000 11.66000 39.69000 96.00000 0.00000 0.00000 0.00000 1.63000 19.81000 0.00000 -2.53000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1CKB-20_30.PDB 4.60000 -42.32000 -16.75000 -69.72000 -3.13000 83.56000 -90.22000 10.26000 40.43000 95.03000 0.00000 0.00000 0.00000 1.76000 19.98000 0.00000 -2.81000 0.00000 -1.48000 0.00000 0.00000 66.00000