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 SLA1-D3_UJ0-CSK-5_1.PDB 4.74858 -9.94000 -2.08000 -2.94000 -12.27000 -4.55000 13.32000 -15.70000 6.01000 6.29000 4.30000 0.00000 0.00000 0.00000 1.18000 1.76000 0.00000 -1.01000 0.00000 -2.49000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_2.PDB 4.80746 -9.03000 -1.31000 -2.12000 -11.35000 -3.56000 11.61000 -14.63000 5.20000 6.03000 3.64000 0.00000 0.00000 0.00000 0.77000 1.63000 0.00000 -1.34000 0.00000 -1.97000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_3.PDB 3.94347 -9.11000 -1.33000 -2.23000 -11.50000 -3.94000 11.40000 -15.24000 7.31000 5.43000 3.71000 0.00000 0.00000 0.00000 0.53000 1.88000 0.00000 -1.07000 0.00000 -2.18000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_4.PDB 4.07340 -13.10000 -2.21000 -5.97000 -11.55000 -4.95000 13.32000 -14.65000 4.46000 6.98000 3.65000 0.00000 0.00000 0.00000 1.15000 1.91000 0.00000 -0.69000 0.00000 -2.65000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_5.PDB 4.04393 -9.66000 -2.14000 -5.72000 -12.84000 -5.27000 14.34000 -16.17000 9.68000 7.33000 4.43000 0.00000 0.00000 0.00000 0.48000 1.79000 0.00000 -0.97000 0.00000 -2.80000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_6.PDB 5.58875 -8.86000 -2.15000 -3.95000 -11.90000 -4.70000 13.02000 -14.84000 7.36000 6.72000 3.76000 0.00000 0.00000 0.00000 1.28000 1.81000 0.00000 -1.09000 0.00000 -2.36000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_7.PDB 4.12138 -10.58000 -2.12000 -4.77000 -12.05000 -4.87000 12.81000 -15.41000 7.32000 6.90000 3.67000 0.00000 0.00000 0.00000 1.33000 1.95000 0.00000 -0.71000 0.00000 -2.69000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_8.PDB 4.64474 -11.97000 -2.16000 -4.71000 -12.66000 -4.78000 13.41000 -16.00000 5.89000 6.99000 4.42000 0.00000 0.00000 0.00000 1.20000 1.95000 0.00000 -0.94000 0.00000 -2.63000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_9.PDB 4.98373 -9.71000 -2.01000 -5.87000 -12.21000 -4.81000 13.98000 -15.56000 6.54000 7.92000 4.02000 0.00000 0.00000 0.00000 1.68000 1.87000 0.00000 -0.75000 0.00000 -2.62000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_10.PDB 3.64559 -10.06000 -1.31000 -2.93000 -10.94000 -4.14000 11.37000 -14.35000 5.37000 6.72000 3.27000 0.00000 0.00000 0.00000 0.47000 1.68000 0.00000 -0.83000 0.00000 -2.75000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_11.PDB 6.02146 10.43000 -1.37000 -3.76000 -11.72000 -4.20000 13.99000 -14.60000 23.74000 6.43000 4.06000 0.00000 0.00000 0.00000 1.13000 1.69000 0.00000 -0.87000 0.00000 -2.38000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_12.PDB 4.65411 14.42000 -1.94000 -4.70000 -12.36000 -4.45000 15.11000 -15.62000 28.44000 6.65000 4.60000 0.00000 0.00000 0.00000 1.68000 1.86000 0.00000 -0.45000 0.00000 -2.52000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_13.PDB 4.02275 -9.73000 -2.13000 -6.29000 -12.12000 -4.94000 13.49000 -15.43000 9.16000 7.19000 3.90000 0.00000 0.00000 0.00000 0.58000 1.98000 0.00000 -0.49000 0.00000 -2.64000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_14.PDB 4.08324 -9.75000 -1.32000 -3.02000 -10.89000 -3.57000 11.16000 -14.70000 6.39000 5.68000 3.25000 0.00000 0.00000 0.00000 0.54000 2.02000 0.00000 -1.05000 0.00000 -2.21000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_15.PDB 4.09368 -10.07000 -1.35000 -3.69000 -10.95000 -3.81000 11.57000 -14.40000 5.52000 5.93000 3.38000 0.00000 0.00000 0.00000 0.67000 1.96000 0.00000 -0.75000 0.00000 -2.20000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_16.PDB 3.57810 -13.78000 -2.15000 -5.85000 -10.84000 -4.63000 11.71000 -13.99000 4.68000 6.62000 3.02000 0.00000 0.00000 0.00000 1.14000 1.92000 0.00000 -0.92000 0.00000 -2.57000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_17.PDB 4.41577 -10.44000 -2.10000 -6.27000 -12.26000 -4.77000 13.65000 -15.67000 7.60000 7.41000 3.91000 0.00000 0.00000 0.00000 1.39000 1.88000 0.00000 -0.67000 0.00000 -2.66000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_18.PDB 5.09539 -8.74000 -2.11000 -5.47000 -12.50000 -4.61000 13.87000 -15.73000 7.97000 7.20000 4.44000 0.00000 0.00000 0.00000 1.43000 1.78000 0.00000 -0.95000 0.00000 -2.29000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_19.PDB 4.60275 -10.18000 -2.25000 -4.62000 -11.54000 -4.65000 12.04000 -14.75000 8.60000 6.54000 3.55000 0.00000 0.00000 0.00000 0.65000 1.93000 0.00000 -1.07000 0.00000 -2.68000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_20.PDB 4.60077 -10.78000 -2.26000 -5.76000 -11.53000 -4.89000 12.54000 -15.08000 7.72000 6.65000 3.29000 0.00000 0.00000 0.00000 1.76000 1.98000 0.00000 -0.54000 0.00000 -2.67000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_21.PDB 4.52538 -8.97000 -1.31000 -3.70000 -11.51000 -3.43000 11.92000 -15.28000 6.59000 6.63000 3.78000 0.00000 0.00000 0.00000 0.48000 1.76000 0.00000 -0.90000 0.00000 -2.23000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_22.PDB 4.35641 -9.42000 -1.92000 -3.92000 -11.46000 -3.71000 12.90000 -14.69000 4.57000 6.53000 3.94000 0.00000 0.00000 0.00000 1.26000 1.61000 0.00000 -0.94000 0.00000 -1.98000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_23.PDB 3.83666 -9.44000 -1.32000 -2.99000 -11.37000 -3.34000 11.79000 -15.23000 6.53000 5.45000 3.59000 0.00000 0.00000 0.00000 0.51000 1.86000 0.00000 -1.33000 0.00000 -1.73000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_24.PDB 4.11918 -12.65000 -2.17000 -4.69000 -10.89000 -4.81000 11.46000 -13.98000 5.15000 6.30000 3.04000 0.00000 0.00000 0.00000 1.43000 1.95000 0.00000 -0.79000 0.00000 -2.69000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_25.PDB 4.23223 -9.96000 -2.06000 -3.31000 -11.20000 -4.54000 12.22000 -14.33000 5.25000 6.28000 3.87000 0.00000 0.00000 0.00000 1.40000 1.78000 0.00000 -1.01000 0.00000 -2.53000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_26.PDB 3.93900 -11.80000 -2.14000 -5.58000 -11.56000 -4.76000 12.59000 -14.67000 5.90000 6.67000 3.65000 0.00000 0.00000 0.00000 1.27000 1.91000 0.00000 -0.86000 0.00000 -2.31000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_27.PDB 3.95031 -11.26000 -2.18000 -5.34000 -11.58000 -5.13000 12.33000 -15.00000 7.92000 6.23000 3.56000 0.00000 0.00000 0.00000 1.35000 2.01000 0.00000 -0.62000 0.00000 -2.79000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_28.PDB 5.11964 -3.89000 -1.29000 -3.75000 -11.89000 -4.14000 12.13000 -15.27000 11.28000 6.53000 3.93000 0.00000 0.00000 0.00000 1.79000 1.69000 0.00000 -1.12000 0.00000 -2.09000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_29.PDB 4.47338 -7.76000 -1.42000 -5.59000 -12.90000 -4.62000 13.66000 -16.48000 9.99000 7.92000 4.22000 0.00000 0.00000 0.00000 0.66000 1.79000 0.00000 -0.69000 0.00000 -2.52000 0.00000 2.38000 68.00000 SLA1-D3_UJ0-CSK-5_30.PDB 4.21773 -12.99000 -2.17000 -4.72000 -10.91000 -4.75000 11.32000 -13.96000 4.87000 6.36000 2.89000 0.00000 0.00000 0.00000 1.35000 2.01000 0.00000 -0.78000 0.00000 -2.51000 0.00000 2.38000 68.00000