NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
460907 | 2d8j | 11214 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2d8j save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 276 _TA_constraint_stats_list.Viol_count 14 _TA_constraint_stats_list.Viol_total 13.20 _TA_constraint_stats_list.Viol_max 0.21 _TA_constraint_stats_list.Viol_rms 0.00 _TA_constraint_stats_list.Viol_average_all_restraints 0.00 _TA_constraint_stats_list.Viol_average_violations_only 0.05 _TA_constraint_stats_list.Cutoff_violation_report 5.00 _TA_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * ID of the restraint list. * 3 * Number of restraints in list. * 4 * Number of violated restraints (each model violation is used). * 5 * Sum of violations in degrees. * 6 * Maximum violation of a restraint without averaging in any way. * 7 * Rms of violations over all restraints. * 8 * Average violation over all restraints. * 9 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. Threshold for reporting violations (degrees) in the last columns of the next table. * 10 * This tag. Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. * 2 * Torsion angle name where available. * 3 * First atom's: * 4 * Chain identifier (can be absent if none defined) * 5 * Residue number * 6 * Residue name * 7 * Name of (pseudo-)atom * 8 * Second thru fourth atom's identifiers occupy columns 7 thru 18. * 19 * Lower bound (degrees) * 20 * Upper bound (degrees) * 21 * Average angle in ensemble of models * 22 * Minimum angle in ensemble of models (counter clockwise from range) * 23 * Maximum angle in ensemble of models (clockwise from range) * 24 * Maximum violation (without any averaging) * 25 * Model number with the maximum violation * 26 * Number of models with a violation above cutoff * 27 * List of models with a violation above cutoff. See description above. * 28 * Administrative tag * 29 * Administrative tag ; loop_ _TA_constraint_stats.Restraint_ID _TA_constraint_stats.Torsion_angle_name _TA_constraint_stats.Entity_assembly_ID_1 _TA_constraint_stats.Comp_index_ID_1 _TA_constraint_stats.Comp_ID_1 _TA_constraint_stats.Atom_ID_1 _TA_constraint_stats.Entity_assembly_ID_2 _TA_constraint_stats.Comp_index_ID_2 _TA_constraint_stats.Comp_ID_2 _TA_constraint_stats.Atom_ID_2 _TA_constraint_stats.Entity_assembly_ID_3 _TA_constraint_stats.Comp_index_ID_3 _TA_constraint_stats.Comp_ID_3 _TA_constraint_stats.Atom_ID_3 _TA_constraint_stats.Entity_assembly_ID_4 _TA_constraint_stats.Comp_index_ID_4 _TA_constraint_stats.Comp_ID_4 _TA_constraint_stats.Atom_ID_4 _TA_constraint_stats.Angle_lower_bound_val _TA_constraint_stats.Angle_upper_bound_val _TA_constraint_stats.Angle_average _TA_constraint_stats.Angle_minimum _TA_constraint_stats.Angle_maximum _TA_constraint_stats.Max_violation _TA_constraint_stats.Max_violation_model_number _TA_constraint_stats.Over_cutoff_violation_count _TA_constraint_stats.Over_cutoff_violation_per_model 1 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG -90.00 -150.00 -72.07 179.31 68.71 . . 0 "[ . 1 . 2]" 2 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG 30.00 -30.00 -72.07 179.31 68.71 . . 0 "[ . 1 . 2]" 3 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG 150.00 90.00 -72.07 179.31 68.71 . . 0 "[ . 1 . 2]" 4 CHI1 1 3 SER N 1 3 SER CA 1 3 SER CB 1 3 SER OG -90.00 -150.00 -89.15 169.87 73.95 . . 0 "[ . 1 . 2]" 5 CHI1 1 3 SER N 1 3 SER CA 1 3 SER CB 1 3 SER OG 30.00 -30.00 -89.15 169.87 73.95 . . 0 "[ . 1 . 2]" 6 CHI1 1 3 SER N 1 3 SER CA 1 3 SER CB 1 3 SER OG 150.00 90.00 -89.15 169.87 73.95 . . 0 "[ . 1 . 2]" 7 CHI1 1 5 SER N 1 5 SER CA 1 5 SER CB 1 5 SER OG -90.00 -150.00 -129.04 -158.92 -170.75 . . 0 "[ . 1 . 2]" 8 CHI1 1 5 SER N 1 5 SER CA 1 5 SER CB 1 5 SER OG 30.00 -30.00 -129.04 -158.92 -170.75 . . 0 "[ . 1 . 2]" 9 CHI1 1 5 SER N 1 5 SER CA 1 5 SER CB 1 5 SER OG 150.00 90.00 -129.04 -158.92 -170.75 . . 0 "[ . 1 . 2]" 10 CHI1 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG -90.00 -150.00 -98.15 169.66 79.09 . . 0 "[ . 1 . 2]" 11 CHI1 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG 30.00 -30.00 -98.15 169.66 79.09 . . 0 "[ . 1 . 2]" 12 CHI1 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG 150.00 90.00 -98.15 169.66 79.09 . . 0 "[ . 1 . 2]" 13 CHI1 1 8 GLN N 1 8 GLN CA 1 8 GLN CB 1 8 GLN CG -90.00 -150.00 -74.32 -89.35 -54.54 . . 0 "[ . 1 . 2]" 14 CHI1 1 8 GLN N 1 8 GLN CA 1 8 GLN CB 1 8 GLN CG 30.00 -30.00 -74.32 -89.35 -54.54 . . 0 "[ . 1 . 2]" 15 CHI1 1 8 GLN N 1 8 GLN CA 1 8 GLN CB 1 8 GLN CG 150.00 90.00 -74.32 -89.35 -54.54 . . 0 "[ . 1 . 2]" 16 CHI2 1 8 GLN CA 1 8 GLN CB 1 8 GLN CG 1 8 GLN CD -90.00 -150.00 162.77 164.61 156.99 . . 0 "[ . 1 . 2]" 17 CHI2 1 8 GLN CA 1 8 GLN CB 1 8 GLN CG 1 8 GLN CD 30.00 -30.00 162.77 164.61 156.99 . . 0 "[ . 1 . 2]" 18 CHI2 1 8 GLN CA 1 8 GLN CB 1 8 GLN CG 1 8 GLN CD 150.00 90.00 162.77 164.61 156.99 . . 0 "[ . 1 . 2]" 19 CHI1 1 9 TYR N 1 9 TYR CA 1 9 TYR CB 1 9 TYR CG -90.00 -150.00 -44.15 -44.01 -46.35 . . 0 "[ . 1 . 2]" 20 CHI1 1 9 TYR N 1 9 TYR CA 1 9 TYR CB 1 9 TYR CG 30.00 -30.00 -44.15 -44.01 -46.35 . . 0 "[ . 1 . 2]" 21 CHI1 1 9 TYR N 1 9 TYR CA 1 9 TYR CB 1 9 TYR CG 150.00 90.00 -44.15 -44.01 -46.35 . . 0 "[ . 1 . 2]" 22 CHI1 1 10 PHE N 1 10 PHE CA 1 10 PHE CB 1 10 PHE CG -90.00 -150.00 -81.16 -87.08 -74.34 . . 0 "[ . 1 . 2]" 23 CHI1 1 10 PHE N 1 10 PHE CA 1 10 PHE CB 1 10 PHE CG 30.00 -30.00 -81.16 -87.08 -74.34 . . 0 "[ . 1 . 2]" 24 CHI1 1 10 PHE N 1 10 PHE CA 1 10 PHE CB 1 10 PHE CG 150.00 90.00 -81.16 -87.08 -74.34 . . 0 "[ . 1 . 2]" 25 CHI1 1 11 VAL N 1 11 VAL CA 1 11 VAL CB 1 11 VAL CG1 -90.00 -150.00 66.21 54.94 162.79 . . 0 "[ . 1 . 2]" 26 CHI1 1 11 VAL N 1 11 VAL CA 1 11 VAL CB 1 11 VAL CG1 30.00 -30.00 66.21 54.94 162.79 . . 0 "[ . 1 . 2]" 27 CHI1 1 11 VAL N 1 11 VAL CA 1 11 VAL CB 1 11 VAL CG1 150.00 90.00 66.21 54.94 162.79 . . 0 "[ . 1 . 2]" 28 CHI1 1 13 LEU N 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG -90.00 -150.00 -54.55 -64.34 -41.89 . . 0 "[ . 1 . 2]" 29 CHI1 1 13 LEU N 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG 30.00 -30.00 -54.55 -64.34 -41.89 . . 0 "[ . 1 . 2]" 30 CHI1 1 13 LEU N 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG 150.00 90.00 -54.55 -64.34 -41.89 . . 0 "[ . 1 . 2]" 31 CHI2 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG 1 13 LEU CD1 -90.00 -150.00 152.49 154.74 153.88 . . 0 "[ . 1 . 2]" 32 CHI2 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG 1 13 LEU CD1 30.00 -30.00 152.49 154.74 153.88 . . 0 "[ . 1 . 2]" 33 CHI2 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG 1 13 LEU CD1 150.00 90.00 152.49 154.74 153.88 . . 0 "[ . 1 . 2]" 34 CHI1 1 14 PHE N 1 14 PHE CA 1 14 PHE CB 1 14 PHE CG -90.00 -150.00 -40.87 -49.97 -32.78 . . 0 "[ . 1 . 2]" 35 CHI1 1 14 PHE N 1 14 PHE CA 1 14 PHE CB 1 14 PHE CG 30.00 -30.00 -40.87 -49.97 -32.78 . . 0 "[ . 1 . 2]" 36 CHI1 1 14 PHE N 1 14 PHE CA 1 14 PHE CB 1 14 PHE CG 150.00 90.00 -40.87 -49.97 -32.78 . . 0 "[ . 1 . 2]" 37 CHI1 1 15 ASP N 1 15 ASP CA 1 15 ASP CB 1 15 ASP CG -90.00 -150.00 32.73 -56.75 151.33 . . 0 "[ . 1 . 2]" 38 CHI1 1 15 ASP N 1 15 ASP CA 1 15 ASP CB 1 15 ASP CG 30.00 -30.00 32.73 -56.75 151.33 . . 0 "[ . 1 . 2]" 39 CHI1 1 15 ASP N 1 15 ASP CA 1 15 ASP CB 1 15 ASP CG 150.00 90.00 32.73 -56.75 151.33 . . 0 "[ . 1 . 2]" 40 CHI1 1 16 TYR N 1 16 TYR CA 1 16 TYR CB 1 16 TYR CG -90.00 -150.00 168.57 158.42 177.92 . . 0 "[ . 1 . 2]" 41 CHI1 1 16 TYR N 1 16 TYR CA 1 16 TYR CB 1 16 TYR CG 30.00 -30.00 168.57 158.42 177.92 . . 0 "[ . 1 . 2]" 42 CHI1 1 16 TYR N 1 16 TYR CA 1 16 TYR CB 1 16 TYR CG 150.00 90.00 168.57 158.42 177.92 . . 0 "[ . 1 . 2]" 43 CHI1 1 17 GLN N 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG -90.00 -150.00 -133.12 175.51 63.39 . . 0 "[ . 1 . 2]" 44 CHI1 1 17 GLN N 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 30.00 -30.00 -133.12 175.51 63.39 . . 0 "[ . 1 . 2]" 45 CHI1 1 17 GLN N 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 150.00 90.00 -133.12 175.51 63.39 . . 0 "[ . 1 . 2]" 46 CHI2 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 1 17 GLN CD -90.00 -150.00 177.13 -178.95 175.66 . . 0 "[ . 1 . 2]" 47 CHI2 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 1 17 GLN CD 30.00 -30.00 177.13 -178.95 175.66 . . 0 "[ . 1 . 2]" 48 CHI2 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 1 17 GLN CD 150.00 90.00 177.13 -178.95 175.66 . . 0 "[ . 1 . 2]" 49 CHI1 1 19 ARG N 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG -90.00 -150.00 -58.43 -79.62 47.38 . . 0 "[ . 1 . 2]" 50 CHI1 1 19 ARG N 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG 30.00 -30.00 -58.43 -79.62 47.38 . . 0 "[ . 1 . 2]" 51 CHI1 1 19 ARG N 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG 150.00 90.00 -58.43 -79.62 47.38 . . 0 "[ . 1 . 2]" 52 CHI2 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD -90.00 -150.00 -125.22 169.35 -71.46 . . 0 "[ . 1 . 2]" 53 CHI2 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD 30.00 -30.00 -125.22 169.35 -71.46 . . 0 "[ . 1 . 2]" 54 CHI2 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD 150.00 90.00 -125.22 169.35 -71.46 . . 0 "[ . 1 . 2]" 55 CHI3 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD 1 19 ARG NE -90.00 -150.00 156.88 174.37 89.71 . . 0 "[ . 1 . 2]" 56 CHI3 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD 1 19 ARG NE 30.00 -30.00 156.88 174.37 89.71 . . 0 "[ . 1 . 2]" 57 CHI3 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD 1 19 ARG NE 150.00 90.00 156.88 174.37 89.71 . . 0 "[ . 1 . 2]" 58 CHI1 1 20 THR N 1 20 THR CA 1 20 THR CB 1 20 THR OG1 -90.00 -150.00 60.43 55.05 54.34 . . 0 "[ . 1 . 2]" 59 CHI1 1 20 THR N 1 20 THR CA 1 20 THR CB 1 20 THR OG1 30.00 -30.00 60.43 55.05 54.34 . . 0 "[ . 1 . 2]" 60 CHI1 1 20 THR N 1 20 THR CA 1 20 THR CB 1 20 THR OG1 150.00 90.00 60.43 55.05 54.34 . . 0 "[ . 1 . 2]" 61 CHI1 1 22 GLU N 1 22 GLU CA 1 22 GLU CB 1 22 GLU CG -90.00 -150.00 -82.34 -85.61 -88.53 . . 0 "[ . 1 . 2]" 62 CHI1 1 22 GLU N 1 22 GLU CA 1 22 GLU CB 1 22 GLU CG 30.00 -30.00 -82.34 -85.61 -88.53 . . 0 "[ . 1 . 2]" 63 CHI1 1 22 GLU N 1 22 GLU CA 1 22 GLU CB 1 22 GLU CG 150.00 90.00 -82.34 -85.61 -88.53 . . 0 "[ . 1 . 2]" 64 CHI2 1 22 GLU CA 1 22 GLU CB 1 22 GLU CG 1 22 GLU CD -90.00 -150.00 -156.97 -79.83 -153.21 . . 0 "[ . 1 . 2]" 65 CHI2 1 22 GLU CA 1 22 GLU CB 1 22 GLU CG 1 22 GLU CD 30.00 -30.00 -156.97 -79.83 -153.21 . . 0 "[ . 1 . 2]" 66 CHI2 1 22 GLU CA 1 22 GLU CB 1 22 GLU CG 1 22 GLU CD 150.00 90.00 -156.97 -79.83 -153.21 . . 0 "[ . 1 . 2]" 67 CHI1 1 23 ASP N 1 23 ASP CA 1 23 ASP CB 1 23 ASP CG -90.00 -150.00 -83.50 -76.74 -81.49 . . 0 "[ . 1 . 2]" 68 CHI1 1 23 ASP N 1 23 ASP CA 1 23 ASP CB 1 23 ASP CG 30.00 -30.00 -83.50 -76.74 -81.49 . . 0 "[ . 1 . 2]" 69 CHI1 1 23 ASP N 1 23 ASP CA 1 23 ASP CB 1 23 ASP CG 150.00 90.00 -83.50 -76.74 -81.49 . . 0 "[ . 1 . 2]" 70 CHI1 1 24 LEU N 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG -90.00 -150.00 -169.04 -173.12 -173.49 . . 0 "[ . 1 . 2]" 71 CHI1 1 24 LEU N 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 30.00 -30.00 -169.04 -173.12 -173.49 . . 0 "[ . 1 . 2]" 72 CHI1 1 24 LEU N 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 150.00 90.00 -169.04 -173.12 -173.49 . . 0 "[ . 1 . 2]" 73 CHI2 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 1 24 LEU CD1 -90.00 -150.00 79.10 81.56 79.47 . . 0 "[ . 1 . 2]" 74 CHI2 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 1 24 LEU CD1 30.00 -30.00 79.10 81.56 79.47 . . 0 "[ . 1 . 2]" 75 CHI2 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 1 24 LEU CD1 150.00 90.00 79.10 81.56 79.47 . . 0 "[ . 1 . 2]" 76 CHI1 1 25 SER N 1 25 SER CA 1 25 SER CB 1 25 SER OG -90.00 -150.00 69.70 -45.13 -171.80 . . 0 "[ . 1 . 2]" 77 CHI1 1 25 SER N 1 25 SER CA 1 25 SER CB 1 25 SER OG 30.00 -30.00 69.70 -45.13 -171.80 . . 0 "[ . 1 . 2]" 78 CHI1 1 25 SER N 1 25 SER CA 1 25 SER CB 1 25 SER OG 150.00 90.00 69.70 -45.13 -171.80 . . 0 "[ . 1 . 2]" 79 CHI1 1 26 PHE N 1 26 PHE CA 1 26 PHE CB 1 26 PHE CG -90.00 -150.00 54.87 49.77 63.24 . . 0 "[ . 1 . 2]" 80 CHI1 1 26 PHE N 1 26 PHE CA 1 26 PHE CB 1 26 PHE CG 30.00 -30.00 54.87 49.77 63.24 . . 0 "[ . 1 . 2]" 81 CHI1 1 26 PHE N 1 26 PHE CA 1 26 PHE CB 1 26 PHE CG 150.00 90.00 54.87 49.77 63.24 . . 0 "[ . 1 . 2]" 82 CHI1 1 27 ARG N 1 27 ARG CA 1 27 ARG CB 1 27 ARG CG -90.00 -150.00 -62.74 -74.35 -53.60 . . 0 "[ . 1 . 2]" 83 CHI1 1 27 ARG N 1 27 ARG CA 1 27 ARG CB 1 27 ARG CG 30.00 -30.00 -62.74 -74.35 -53.60 . . 0 "[ . 1 . 2]" 84 CHI1 1 27 ARG N 1 27 ARG CA 1 27 ARG CB 1 27 ARG CG 150.00 90.00 -62.74 -74.35 -53.60 . . 0 "[ . 1 . 2]" 85 CHI2 1 27 ARG CA 1 27 ARG CB 1 27 ARG CG 1 27 ARG CD -90.00 -150.00 -128.95 -157.75 -53.32 . . 0 "[ . 1 . 2]" 86 CHI2 1 27 ARG CA 1 27 ARG CB 1 27 ARG CG 1 27 ARG CD 30.00 -30.00 -128.95 -157.75 -53.32 . . 0 "[ . 1 . 2]" 87 CHI2 1 27 ARG CA 1 27 ARG CB 1 27 ARG CG 1 27 ARG CD 150.00 90.00 -128.95 -157.75 -53.32 . . 0 "[ . 1 . 2]" 88 CHI3 1 27 ARG CB 1 27 ARG CG 1 27 ARG CD 1 27 ARG NE -90.00 -150.00 -118.94 -89.94 -153.27 . . 0 "[ . 1 . 2]" 89 CHI3 1 27 ARG CB 1 27 ARG CG 1 27 ARG CD 1 27 ARG NE 30.00 -30.00 -118.94 -89.94 -153.27 . . 0 "[ . 1 . 2]" 90 CHI3 1 27 ARG CB 1 27 ARG CG 1 27 ARG CD 1 27 ARG NE 150.00 90.00 -118.94 -89.94 -153.27 . . 0 "[ . 1 . 2]" 91 CHI1 1 30 ASP N 1 30 ASP CA 1 30 ASP CB 1 30 ASP CG -90.00 -150.00 -98.21 89.53 -67.38 . . 0 "[ . 1 . 2]" 92 CHI1 1 30 ASP N 1 30 ASP CA 1 30 ASP CB 1 30 ASP CG 30.00 -30.00 -98.21 89.53 -67.38 . . 0 "[ . 1 . 2]" 93 CHI1 1 30 ASP N 1 30 ASP CA 1 30 ASP CB 1 30 ASP CG 150.00 90.00 -98.21 89.53 -67.38 . . 0 "[ . 1 . 2]" 94 CHI1 1 31 LYS N 1 31 LYS CA 1 31 LYS CB 1 31 LYS CG -90.00 -150.00 -62.24 -81.34 -53.77 . . 0 "[ . 1 . 2]" 95 CHI1 1 31 LYS N 1 31 LYS CA 1 31 LYS CB 1 31 LYS CG 30.00 -30.00 -62.24 -81.34 -53.77 . . 0 "[ . 1 . 2]" 96 CHI1 1 31 LYS N 1 31 LYS CA 1 31 LYS CB 1 31 LYS CG 150.00 90.00 -62.24 -81.34 -53.77 . . 0 "[ . 1 . 2]" 97 CHI2 1 31 LYS CA 1 31 LYS CB 1 31 LYS CG 1 31 LYS CD -90.00 -150.00 -80.28 -77.91 -80.10 . . 0 "[ . 1 . 2]" 98 CHI2 1 31 LYS CA 1 31 LYS CB 1 31 LYS CG 1 31 LYS CD 30.00 -30.00 -80.28 -77.91 -80.10 . . 0 "[ . 1 . 2]" 99 CHI2 1 31 LYS CA 1 31 LYS CB 1 31 LYS CG 1 31 LYS CD 150.00 90.00 -80.28 -77.91 -80.10 . . 0 "[ . 1 . 2]" 100 CHI3 1 31 LYS CB 1 31 LYS CG 1 31 LYS CD 1 31 LYS CE -90.00 -150.00 -171.17 162.99 -77.62 . . 0 "[ . 1 . 2]" 101 CHI3 1 31 LYS CB 1 31 LYS CG 1 31 LYS CD 1 31 LYS CE 30.00 -30.00 -171.17 162.99 -77.62 . . 0 "[ . 1 . 2]" 102 CHI3 1 31 LYS CB 1 31 LYS CG 1 31 LYS CD 1 31 LYS CE 150.00 90.00 -171.17 162.99 -77.62 . . 0 "[ . 1 . 2]" 103 CHI4 1 31 LYS CG 1 31 LYS CD 1 31 LYS CE 1 31 LYS NZ -90.00 -150.00 -114.02 62.72 -64.81 . . 0 "[ . 1 . 2]" 104 CHI4 1 31 LYS CG 1 31 LYS CD 1 31 LYS CE 1 31 LYS NZ 30.00 -30.00 -114.02 62.72 -64.81 . . 0 "[ . 1 . 2]" 105 CHI4 1 31 LYS CG 1 31 LYS CD 1 31 LYS CE 1 31 LYS NZ 150.00 90.00 -114.02 62.72 -64.81 . . 0 "[ . 1 . 2]" 106 CHI1 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG -90.00 -150.00 -58.29 -61.25 -62.36 . . 0 "[ . 1 . 2]" 107 CHI1 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 30.00 -30.00 -58.29 -61.25 -62.36 . . 0 "[ . 1 . 2]" 108 CHI1 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 150.00 90.00 -58.29 -61.25 -62.36 . . 0 "[ . 1 . 2]" 109 CHI2 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 -90.00 -150.00 155.29 150.06 163.84 . . 0 "[ . 1 . 2]" 110 CHI2 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 30.00 -30.00 155.29 150.06 163.84 . . 0 "[ . 1 . 2]" 111 CHI2 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 150.00 90.00 155.29 150.06 163.84 . . 0 "[ . 1 . 2]" 112 CHI1 1 33 GLN N 1 33 GLN CA 1 33 GLN CB 1 33 GLN CG -90.00 -150.00 -179.31 -178.30 -179.47 . . 0 "[ . 1 . 2]" 113 CHI1 1 33 GLN N 1 33 GLN CA 1 33 GLN CB 1 33 GLN CG 30.00 -30.00 -179.31 -178.30 -179.47 . . 0 "[ . 1 . 2]" 114 CHI1 1 33 GLN N 1 33 GLN CA 1 33 GLN CB 1 33 GLN CG 150.00 90.00 -179.31 -178.30 -179.47 . . 0 "[ . 1 . 2]" 115 CHI2 1 33 GLN CA 1 33 GLN CB 1 33 GLN CG 1 33 GLN CD -90.00 -150.00 -167.61 166.38 -67.02 . . 0 "[ . 1 . 2]" 116 CHI2 1 33 GLN CA 1 33 GLN CB 1 33 GLN CG 1 33 GLN CD 30.00 -30.00 -167.61 166.38 -67.02 . . 0 "[ . 1 . 2]" 117 CHI2 1 33 GLN CA 1 33 GLN CB 1 33 GLN CG 1 33 GLN CD 150.00 90.00 -167.61 166.38 -67.02 . . 0 "[ . 1 . 2]" 118 CHI1 1 34 VAL N 1 34 VAL CA 1 34 VAL CB 1 34 VAL CG1 -90.00 -150.00 174.77 168.01 -179.50 . . 0 "[ . 1 . 2]" 119 CHI1 1 34 VAL N 1 34 VAL CA 1 34 VAL CB 1 34 VAL CG1 30.00 -30.00 174.77 168.01 -179.50 . . 0 "[ . 1 . 2]" 120 CHI1 1 34 VAL N 1 34 VAL CA 1 34 VAL CB 1 34 VAL CG1 150.00 90.00 174.77 168.01 -179.50 . . 0 "[ . 1 . 2]" 121 CHI1 1 35 LEU N 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG -90.00 -150.00 -45.10 -44.51 -45.44 . . 0 "[ . 1 . 2]" 122 CHI1 1 35 LEU N 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG 30.00 -30.00 -45.10 -44.51 -45.44 . . 0 "[ . 1 . 2]" 123 CHI1 1 35 LEU N 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG 150.00 90.00 -45.10 -44.51 -45.44 . . 0 "[ . 1 . 2]" 124 CHI2 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG 1 35 LEU CD1 -90.00 -150.00 156.89 150.41 170.05 . . 0 "[ . 1 . 2]" 125 CHI2 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG 1 35 LEU CD1 30.00 -30.00 156.89 150.41 170.05 . . 0 "[ . 1 . 2]" 126 CHI2 1 35 LEU CA 1 35 LEU CB 1 35 LEU CG 1 35 LEU CD1 150.00 90.00 156.89 150.41 170.05 . . 0 "[ . 1 . 2]" 127 CHI1 1 36 ASP N 1 36 ASP CA 1 36 ASP CB 1 36 ASP CG -90.00 -150.00 -152.76 -159.33 -150.05 . . 0 "[ . 1 . 2]" 128 CHI1 1 36 ASP N 1 36 ASP CA 1 36 ASP CB 1 36 ASP CG 30.00 -30.00 -152.76 -159.33 -150.05 . . 0 "[ . 1 . 2]" 129 CHI1 1 36 ASP N 1 36 ASP CA 1 36 ASP CB 1 36 ASP CG 150.00 90.00 -152.76 -159.33 -150.05 . . 0 "[ . 1 . 2]" 130 CHI1 1 37 THR N 1 37 THR CA 1 37 THR CB 1 37 THR OG1 -90.00 -150.00 55.17 41.12 64.21 . . 0 "[ . 1 . 2]" 131 CHI1 1 37 THR N 1 37 THR CA 1 37 THR CB 1 37 THR OG1 30.00 -30.00 55.17 41.12 64.21 . . 0 "[ . 1 . 2]" 132 CHI1 1 37 THR N 1 37 THR CA 1 37 THR CB 1 37 THR OG1 150.00 90.00 55.17 41.12 64.21 . . 0 "[ . 1 . 2]" 133 CHI1 1 38 SER N 1 38 SER CA 1 38 SER CB 1 38 SER OG -90.00 -150.00 -95.54 50.96 -54.74 0.02 4 0 "[ . 1 . 2]" 134 CHI1 1 38 SER N 1 38 SER CA 1 38 SER CB 1 38 SER OG 30.00 -30.00 -95.54 50.96 -54.74 . . 0 "[ . 1 . 2]" 135 CHI1 1 38 SER N 1 38 SER CA 1 38 SER CB 1 38 SER OG 150.00 90.00 -95.54 50.96 -54.74 . . 0 "[ . 1 . 2]" 136 CHI1 1 39 HIS N 1 39 HIS CA 1 39 HIS CB 1 39 HIS CG -90.00 -150.00 -156.91 -152.29 -158.93 . . 0 "[ . 1 . 2]" 137 CHI1 1 39 HIS N 1 39 HIS CA 1 39 HIS CB 1 39 HIS CG 30.00 -30.00 -156.91 -152.29 -158.93 . . 0 "[ . 1 . 2]" 138 CHI1 1 39 HIS N 1 39 HIS CA 1 39 HIS CB 1 39 HIS CG 150.00 90.00 -156.91 -152.29 -158.93 . . 0 "[ . 1 . 2]" 139 CHI1 1 40 GLU N 1 40 GLU CA 1 40 GLU CB 1 40 GLU CG -90.00 -150.00 -152.71 179.01 57.73 . . 0 "[ . 1 . 2]" 140 CHI1 1 40 GLU N 1 40 GLU CA 1 40 GLU CB 1 40 GLU CG 30.00 -30.00 -152.71 179.01 57.73 . . 0 "[ . 1 . 2]" 141 CHI1 1 40 GLU N 1 40 GLU CA 1 40 GLU CB 1 40 GLU CG 150.00 90.00 -152.71 179.01 57.73 . . 0 "[ . 1 . 2]" 142 CHI2 1 40 GLU CA 1 40 GLU CB 1 40 GLU CG 1 40 GLU CD -90.00 -150.00 166.29 -89.83 -156.84 . . 0 "[ . 1 . 2]" 143 CHI2 1 40 GLU CA 1 40 GLU CB 1 40 GLU CG 1 40 GLU CD 30.00 -30.00 166.29 -89.83 -156.84 . . 0 "[ . 1 . 2]" 144 CHI2 1 40 GLU CA 1 40 GLU CB 1 40 GLU CG 1 40 GLU CD 150.00 90.00 166.29 -89.83 -156.84 . . 0 "[ . 1 . 2]" 145 CHI1 1 42 TRP N 1 42 TRP CA 1 42 TRP CB 1 42 TRP CG -90.00 -150.00 -62.73 -68.23 -57.88 . . 0 "[ . 1 . 2]" 146 CHI1 1 42 TRP N 1 42 TRP CA 1 42 TRP CB 1 42 TRP CG 30.00 -30.00 -62.73 -68.23 -57.88 . . 0 "[ . 1 . 2]" 147 CHI1 1 42 TRP N 1 42 TRP CA 1 42 TRP CB 1 42 TRP CG 150.00 90.00 -62.73 -68.23 -57.88 . . 0 "[ . 1 . 2]" 148 CHI1 1 43 TRP N 1 43 TRP CA 1 43 TRP CB 1 43 TRP CG -90.00 -150.00 -65.81 -75.82 -60.95 . . 0 "[ . 1 . 2]" 149 CHI1 1 43 TRP N 1 43 TRP CA 1 43 TRP CB 1 43 TRP CG 30.00 -30.00 -65.81 -75.82 -60.95 . . 0 "[ . 1 . 2]" 150 CHI1 1 43 TRP N 1 43 TRP CA 1 43 TRP CB 1 43 TRP CG 150.00 90.00 -65.81 -75.82 -60.95 . . 0 "[ . 1 . 2]" 151 CHI1 1 44 LEU N 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG -90.00 -150.00 174.35 167.56 -179.42 . . 0 "[ . 1 . 2]" 152 CHI1 1 44 LEU N 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG 30.00 -30.00 174.35 167.56 -179.42 . . 0 "[ . 1 . 2]" 153 CHI1 1 44 LEU N 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG 150.00 90.00 174.35 167.56 -179.42 . . 0 "[ . 1 . 2]" 154 CHI2 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG 1 44 LEU CD1 -90.00 -150.00 71.96 70.32 69.72 . . 0 "[ . 1 . 2]" 155 CHI2 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG 1 44 LEU CD1 30.00 -30.00 71.96 70.32 69.72 . . 0 "[ . 1 . 2]" 156 CHI2 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG 1 44 LEU CD1 150.00 90.00 71.96 70.32 69.72 . . 0 "[ . 1 . 2]" 157 CHI1 1 46 ARG N 1 46 ARG CA 1 46 ARG CB 1 46 ARG CG -90.00 -150.00 72.33 69.56 68.75 . . 0 "[ . 1 . 2]" 158 CHI1 1 46 ARG N 1 46 ARG CA 1 46 ARG CB 1 46 ARG CG 30.00 -30.00 72.33 69.56 68.75 . . 0 "[ . 1 . 2]" 159 CHI1 1 46 ARG N 1 46 ARG CA 1 46 ARG CB 1 46 ARG CG 150.00 90.00 72.33 69.56 68.75 . . 0 "[ . 1 . 2]" 160 CHI2 1 46 ARG CA 1 46 ARG CB 1 46 ARG CG 1 46 ARG CD -90.00 -150.00 -177.86 159.56 -155.08 . . 0 "[ . 1 . 2]" 161 CHI2 1 46 ARG CA 1 46 ARG CB 1 46 ARG CG 1 46 ARG CD 30.00 -30.00 -177.86 159.56 -155.08 . . 0 "[ . 1 . 2]" 162 CHI2 1 46 ARG CA 1 46 ARG CB 1 46 ARG CG 1 46 ARG CD 150.00 90.00 -177.86 159.56 -155.08 . . 0 "[ . 1 . 2]" 163 CHI3 1 46 ARG CB 1 46 ARG CG 1 46 ARG CD 1 46 ARG NE -90.00 -150.00 -121.84 -89.77 -153.85 . . 0 "[ . 1 . 2]" 164 CHI3 1 46 ARG CB 1 46 ARG CG 1 46 ARG CD 1 46 ARG NE 30.00 -30.00 -121.84 -89.77 -153.85 . . 0 "[ . 1 . 2]" 165 CHI3 1 46 ARG CB 1 46 ARG CG 1 46 ARG CD 1 46 ARG NE 150.00 90.00 -121.84 -89.77 -153.85 . . 0 "[ . 1 . 2]" 166 CHI1 1 47 HIS N 1 47 HIS CA 1 47 HIS CB 1 47 HIS CG -90.00 -150.00 -89.52 -90.21 -87.39 0.21 15 0 "[ . 1 . 2]" 167 CHI1 1 47 HIS N 1 47 HIS CA 1 47 HIS CB 1 47 HIS CG 30.00 -30.00 -89.52 -90.21 -87.39 . . 0 "[ . 1 . 2]" 168 CHI1 1 47 HIS N 1 47 HIS CA 1 47 HIS CB 1 47 HIS CG 150.00 90.00 -89.52 -90.21 -87.39 . . 0 "[ . 1 . 2]" 169 CHI1 1 48 LEU N 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG -90.00 -150.00 -59.76 -48.53 -49.78 . . 0 "[ . 1 . 2]" 170 CHI1 1 48 LEU N 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG 30.00 -30.00 -59.76 -48.53 -49.78 . . 0 "[ . 1 . 2]" 171 CHI1 1 48 LEU N 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG 150.00 90.00 -59.76 -48.53 -49.78 . . 0 "[ . 1 . 2]" 172 CHI2 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG 1 48 LEU CD1 -90.00 -150.00 165.75 152.58 175.24 . . 0 "[ . 1 . 2]" 173 CHI2 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG 1 48 LEU CD1 30.00 -30.00 165.75 152.58 175.24 . . 0 "[ . 1 . 2]" 174 CHI2 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG 1 48 LEU CD1 150.00 90.00 165.75 152.58 175.24 . . 0 "[ . 1 . 2]" 175 CHI1 1 49 GLU N 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG -90.00 -150.00 -81.12 -76.80 -77.57 . . 0 "[ . 1 . 2]" 176 CHI1 1 49 GLU N 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG 30.00 -30.00 -81.12 -76.80 -77.57 . . 0 "[ . 1 . 2]" 177 CHI1 1 49 GLU N 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG 150.00 90.00 -81.12 -76.80 -77.57 . . 0 "[ . 1 . 2]" 178 CHI2 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG 1 49 GLU CD -90.00 -150.00 -144.50 74.97 -72.03 . . 0 "[ . 1 . 2]" 179 CHI2 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG 1 49 GLU CD 30.00 -30.00 -144.50 74.97 -72.03 . . 0 "[ . 1 . 2]" 180 CHI2 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG 1 49 GLU CD 150.00 90.00 -144.50 74.97 -72.03 . . 0 "[ . 1 . 2]" 181 CHI1 1 50 LYS N 1 50 LYS CA 1 50 LYS CB 1 50 LYS CG -90.00 -150.00 -143.63 176.24 70.04 . . 0 "[ . 1 . 2]" 182 CHI1 1 50 LYS N 1 50 LYS CA 1 50 LYS CB 1 50 LYS CG 30.00 -30.00 -143.63 176.24 70.04 . . 0 "[ . 1 . 2]" 183 CHI1 1 50 LYS N 1 50 LYS CA 1 50 LYS CB 1 50 LYS CG 150.00 90.00 -143.63 176.24 70.04 . . 0 "[ . 1 . 2]" 184 CHI2 1 50 LYS CA 1 50 LYS CB 1 50 LYS CG 1 50 LYS CD -90.00 -150.00 162.46 64.05 -79.33 . . 0 "[ . 1 . 2]" 185 CHI2 1 50 LYS CA 1 50 LYS CB 1 50 LYS CG 1 50 LYS CD 30.00 -30.00 162.46 64.05 -79.33 . . 0 "[ . 1 . 2]" 186 CHI2 1 50 LYS CA 1 50 LYS CB 1 50 LYS CG 1 50 LYS CD 150.00 90.00 162.46 64.05 -79.33 . . 0 "[ . 1 . 2]" 187 CHI3 1 50 LYS CB 1 50 LYS CG 1 50 LYS CD 1 50 LYS CE -90.00 -150.00 -169.28 150.12 84.56 . . 0 "[ . 1 . 2]" 188 CHI3 1 50 LYS CB 1 50 LYS CG 1 50 LYS CD 1 50 LYS CE 30.00 -30.00 -169.28 150.12 84.56 . . 0 "[ . 1 . 2]" 189 CHI3 1 50 LYS CB 1 50 LYS CG 1 50 LYS CD 1 50 LYS CE 150.00 90.00 -169.28 150.12 84.56 . . 0 "[ . 1 . 2]" 190 CHI4 1 50 LYS CG 1 50 LYS CD 1 50 LYS CE 1 50 LYS NZ -90.00 -150.00 172.72 -82.86 -150.31 . . 0 "[ . 1 . 2]" 191 CHI4 1 50 LYS CG 1 50 LYS CD 1 50 LYS CE 1 50 LYS NZ 30.00 -30.00 172.72 -82.86 -150.31 . . 0 "[ . 1 . 2]" 192 CHI4 1 50 LYS CG 1 50 LYS CD 1 50 LYS CE 1 50 LYS NZ 150.00 90.00 172.72 -82.86 -150.31 . . 0 "[ . 1 . 2]" 193 CHI1 1 51 LYS N 1 51 LYS CA 1 51 LYS CB 1 51 LYS CG -90.00 -150.00 -138.99 39.68 -66.67 . . 0 "[ . 1 . 2]" 194 CHI1 1 51 LYS N 1 51 LYS CA 1 51 LYS CB 1 51 LYS CG 30.00 -30.00 -138.99 39.68 -66.67 . . 0 "[ . 1 . 2]" 195 CHI1 1 51 LYS N 1 51 LYS CA 1 51 LYS CB 1 51 LYS CG 150.00 90.00 -138.99 39.68 -66.67 . . 0 "[ . 1 . 2]" 196 CHI2 1 51 LYS CA 1 51 LYS CB 1 51 LYS CG 1 51 LYS CD -90.00 -150.00 160.17 73.83 -67.62 0.16 19 0 "[ . 1 . 2]" 197 CHI2 1 51 LYS CA 1 51 LYS CB 1 51 LYS CG 1 51 LYS CD 30.00 -30.00 160.17 73.83 -67.62 . . 0 "[ . 1 . 2]" 198 CHI2 1 51 LYS CA 1 51 LYS CB 1 51 LYS CG 1 51 LYS CD 150.00 90.00 160.17 73.83 -67.62 . . 0 "[ . 1 . 2]" 199 CHI3 1 51 LYS CB 1 51 LYS CG 1 51 LYS CD 1 51 LYS CE -90.00 -150.00 -149.71 76.97 -66.76 . . 0 "[ . 1 . 2]" 200 CHI3 1 51 LYS CB 1 51 LYS CG 1 51 LYS CD 1 51 LYS CE 30.00 -30.00 -149.71 76.97 -66.76 . . 0 "[ . 1 . 2]" 201 CHI3 1 51 LYS CB 1 51 LYS CG 1 51 LYS CD 1 51 LYS CE 150.00 90.00 -149.71 76.97 -66.76 . . 0 "[ . 1 . 2]" 202 CHI4 1 51 LYS CG 1 51 LYS CD 1 51 LYS CE 1 51 LYS NZ -90.00 -150.00 174.49 -89.50 -153.37 . . 0 "[ . 1 . 2]" 203 CHI4 1 51 LYS CG 1 51 LYS CD 1 51 LYS CE 1 51 LYS NZ 30.00 -30.00 174.49 -89.50 -153.37 . . 0 "[ . 1 . 2]" 204 CHI4 1 51 LYS CG 1 51 LYS CD 1 51 LYS CE 1 51 LYS NZ 150.00 90.00 174.49 -89.50 -153.37 . . 0 "[ . 1 . 2]" 205 CHI1 1 53 THR N 1 53 THR CA 1 53 THR CB 1 53 THR OG1 -90.00 -150.00 23.30 -75.18 -175.33 . . 0 "[ . 1 . 2]" 206 CHI1 1 53 THR N 1 53 THR CA 1 53 THR CB 1 53 THR OG1 30.00 -30.00 23.30 -75.18 -175.33 0.00 7 0 "[ . 1 . 2]" 207 CHI1 1 53 THR N 1 53 THR CA 1 53 THR CB 1 53 THR OG1 150.00 90.00 23.30 -75.18 -175.33 . . 0 "[ . 1 . 2]" 208 CHI1 1 55 LEU N 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG -90.00 -150.00 -110.23 -64.23 -72.97 . . 0 "[ . 1 . 2]" 209 CHI1 1 55 LEU N 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG 30.00 -30.00 -110.23 -64.23 -72.97 . . 0 "[ . 1 . 2]" 210 CHI1 1 55 LEU N 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG 150.00 90.00 -110.23 -64.23 -72.97 . . 0 "[ . 1 . 2]" 211 CHI2 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG 1 55 LEU CD1 -90.00 -150.00 100.09 -36.94 172.59 . . 0 "[ . 1 . 2]" 212 CHI2 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG 1 55 LEU CD1 30.00 -30.00 100.09 -36.94 172.59 . . 0 "[ . 1 . 2]" 213 CHI2 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG 1 55 LEU CD1 150.00 90.00 100.09 -36.94 172.59 . . 0 "[ . 1 . 2]" 214 CHI1 1 57 GLN N 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG -90.00 -150.00 -36.79 54.56 -52.82 . . 0 "[ . 1 . 2]" 215 CHI1 1 57 GLN N 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG 30.00 -30.00 -36.79 54.56 -52.82 . . 0 "[ . 1 . 2]" 216 CHI1 1 57 GLN N 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG 150.00 90.00 -36.79 54.56 -52.82 . . 0 "[ . 1 . 2]" 217 CHI2 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG 1 57 GLN CD -90.00 -150.00 -142.82 75.32 -55.34 . . 0 "[ . 1 . 2]" 218 CHI2 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG 1 57 GLN CD 30.00 -30.00 -142.82 75.32 -55.34 . . 0 "[ . 1 . 2]" 219 CHI2 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG 1 57 GLN CD 150.00 90.00 -142.82 75.32 -55.34 . . 0 "[ . 1 . 2]" 220 CHI1 1 58 GLN N 1 58 GLN CA 1 58 GLN CB 1 58 GLN CG -90.00 -150.00 -173.89 -160.06 -165.24 . . 0 "[ . 1 . 2]" 221 CHI1 1 58 GLN N 1 58 GLN CA 1 58 GLN CB 1 58 GLN CG 30.00 -30.00 -173.89 -160.06 -165.24 . . 0 "[ . 1 . 2]" 222 CHI1 1 58 GLN N 1 58 GLN CA 1 58 GLN CB 1 58 GLN CG 150.00 90.00 -173.89 -160.06 -165.24 . . 0 "[ . 1 . 2]" 223 CHI2 1 58 GLN CA 1 58 GLN CB 1 58 GLN CG 1 58 GLN CD -90.00 -150.00 140.19 85.03 77.29 . . 0 "[ . 1 . 2]" 224 CHI2 1 58 GLN CA 1 58 GLN CB 1 58 GLN CG 1 58 GLN CD 30.00 -30.00 140.19 85.03 77.29 . . 0 "[ . 1 . 2]" 225 CHI2 1 58 GLN CA 1 58 GLN CB 1 58 GLN CG 1 58 GLN CD 150.00 90.00 140.19 85.03 77.29 . . 0 "[ . 1 . 2]" 226 CHI1 1 59 LEU N 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG -90.00 -150.00 57.74 50.90 49.91 . . 0 "[ . 1 . 2]" 227 CHI1 1 59 LEU N 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG 30.00 -30.00 57.74 50.90 49.91 . . 0 "[ . 1 . 2]" 228 CHI1 1 59 LEU N 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG 150.00 90.00 57.74 50.90 49.91 . . 0 "[ . 1 . 2]" 229 CHI2 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG 1 59 LEU CD1 -90.00 -150.00 143.12 89.64 89.43 . . 0 "[ . 1 . 2]" 230 CHI2 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG 1 59 LEU CD1 30.00 -30.00 143.12 89.64 89.43 . . 0 "[ . 1 . 2]" 231 CHI2 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG 1 59 LEU CD1 150.00 90.00 143.12 89.64 89.43 0.08 13 0 "[ . 1 . 2]" 232 CHI1 1 60 GLN N 1 60 GLN CA 1 60 GLN CB 1 60 GLN CG -90.00 -150.00 43.40 -90.04 82.73 0.04 10 0 "[ . 1 . 2]" 233 CHI1 1 60 GLN N 1 60 GLN CA 1 60 GLN CB 1 60 GLN CG 30.00 -30.00 43.40 -90.04 82.73 . . 0 "[ . 1 . 2]" 234 CHI1 1 60 GLN N 1 60 GLN CA 1 60 GLN CB 1 60 GLN CG 150.00 90.00 43.40 -90.04 82.73 . . 0 "[ . 1 . 2]" 235 CHI2 1 60 GLN CA 1 60 GLN CB 1 60 GLN CG 1 60 GLN CD -90.00 -150.00 174.24 164.91 89.49 . . 0 "[ . 1 . 2]" 236 CHI2 1 60 GLN CA 1 60 GLN CB 1 60 GLN CG 1 60 GLN CD 30.00 -30.00 174.24 164.91 89.49 . . 0 "[ . 1 . 2]" 237 CHI2 1 60 GLN CA 1 60 GLN CB 1 60 GLN CG 1 60 GLN CD 150.00 90.00 174.24 164.91 89.49 . . 0 "[ . 1 . 2]" 238 CHI1 1 62 TYR N 1 62 TYR CA 1 62 TYR CB 1 62 TYR CG -90.00 -150.00 -67.91 -66.36 -68.73 . . 0 "[ . 1 . 2]" 239 CHI1 1 62 TYR N 1 62 TYR CA 1 62 TYR CB 1 62 TYR CG 30.00 -30.00 -67.91 -66.36 -68.73 . . 0 "[ . 1 . 2]" 240 CHI1 1 62 TYR N 1 62 TYR CA 1 62 TYR CB 1 62 TYR CG 150.00 90.00 -67.91 -66.36 -68.73 . . 0 "[ . 1 . 2]" 241 CHI1 1 63 ILE N 1 63 ILE CA 1 63 ILE CB 1 63 ILE CG1 -90.00 -150.00 63.07 66.27 64.68 . . 0 "[ . 1 . 2]" 242 CHI1 1 63 ILE N 1 63 ILE CA 1 63 ILE CB 1 63 ILE CG1 30.00 -30.00 63.07 66.27 64.68 . . 0 "[ . 1 . 2]" 243 CHI1 1 63 ILE N 1 63 ILE CA 1 63 ILE CB 1 63 ILE CG1 150.00 90.00 63.07 66.27 64.68 . . 0 "[ . 1 . 2]" 244 CHI21 1 63 ILE CA 1 63 ILE CB 1 63 ILE CG1 1 63 ILE CD1 -90.00 -150.00 162.24 152.60 167.28 . . 0 "[ . 1 . 2]" 245 CHI21 1 63 ILE CA 1 63 ILE CB 1 63 ILE CG1 1 63 ILE CD1 30.00 -30.00 162.24 152.60 167.28 . . 0 "[ . 1 . 2]" 246 CHI21 1 63 ILE CA 1 63 ILE CB 1 63 ILE CG1 1 63 ILE CD1 150.00 90.00 162.24 152.60 167.28 . . 0 "[ . 1 . 2]" 247 CHI1 1 65 SER N 1 65 SER CA 1 65 SER CB 1 65 SER OG -90.00 -150.00 87.49 65.66 61.38 . . 0 "[ . 1 . 2]" 248 CHI1 1 65 SER N 1 65 SER CA 1 65 SER CB 1 65 SER OG 30.00 -30.00 87.49 65.66 61.38 . . 0 "[ . 1 . 2]" 249 CHI1 1 65 SER N 1 65 SER CA 1 65 SER CB 1 65 SER OG 150.00 90.00 87.49 65.66 61.38 . . 0 "[ . 1 . 2]" 250 CHI1 1 66 ASN N 1 66 ASN CA 1 66 ASN CB 1 66 ASN CG -90.00 -150.00 -73.26 -87.30 -156.92 . . 0 "[ . 1 . 2]" 251 CHI1 1 66 ASN N 1 66 ASN CA 1 66 ASN CB 1 66 ASN CG 30.00 -30.00 -73.26 -87.30 -156.92 . . 0 "[ . 1 . 2]" 252 CHI1 1 66 ASN N 1 66 ASN CA 1 66 ASN CB 1 66 ASN CG 150.00 90.00 -73.26 -87.30 -156.92 . . 0 "[ . 1 . 2]" 253 CHI1 1 67 TYR N 1 67 TYR CA 1 67 TYR CB 1 67 TYR CG -90.00 -150.00 -84.26 -89.49 -79.04 . . 0 "[ . 1 . 2]" 254 CHI1 1 67 TYR N 1 67 TYR CA 1 67 TYR CB 1 67 TYR CG 30.00 -30.00 -84.26 -89.49 -79.04 . . 0 "[ . 1 . 2]" 255 CHI1 1 67 TYR N 1 67 TYR CA 1 67 TYR CB 1 67 TYR CG 150.00 90.00 -84.26 -89.49 -79.04 . . 0 "[ . 1 . 2]" 256 CHI1 1 68 VAL N 1 68 VAL CA 1 68 VAL CB 1 68 VAL CG1 -90.00 -150.00 -56.33 -45.49 -47.88 . . 0 "[ . 1 . 2]" 257 CHI1 1 68 VAL N 1 68 VAL CA 1 68 VAL CB 1 68 VAL CG1 30.00 -30.00 -56.33 -45.49 -47.88 . . 0 "[ . 1 . 2]" 258 CHI1 1 68 VAL N 1 68 VAL CA 1 68 VAL CB 1 68 VAL CG1 150.00 90.00 -56.33 -45.49 -47.88 . . 0 "[ . 1 . 2]" 259 CHI1 1 70 GLU N 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG -90.00 -150.00 -134.60 71.31 -82.39 0.01 7 0 "[ . 1 . 2]" 260 CHI1 1 70 GLU N 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG 30.00 -30.00 -134.60 71.31 -82.39 . . 0 "[ . 1 . 2]" 261 CHI1 1 70 GLU N 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG 150.00 90.00 -134.60 71.31 -82.39 . . 0 "[ . 1 . 2]" 262 CHI2 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG 1 70 GLU CD -90.00 -150.00 -149.94 -86.95 -150.72 . . 0 "[ . 1 . 2]" 263 CHI2 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG 1 70 GLU CD 30.00 -30.00 -149.94 -86.95 -150.72 . . 0 "[ . 1 . 2]" 264 CHI2 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG 1 70 GLU CD 150.00 90.00 -149.94 -86.95 -150.72 . . 0 "[ . 1 . 2]" 265 CHI1 1 71 ASP N 1 71 ASP CA 1 71 ASP CB 1 71 ASP CG -90.00 -150.00 -152.05 -150.30 -150.64 0.07 6 0 "[ . 1 . 2]" 266 CHI1 1 71 ASP N 1 71 ASP CA 1 71 ASP CB 1 71 ASP CG 30.00 -30.00 -152.05 -150.30 -150.64 . . 0 "[ . 1 . 2]" 267 CHI1 1 71 ASP N 1 71 ASP CA 1 71 ASP CB 1 71 ASP CG 150.00 90.00 -152.05 -150.30 -150.64 . . 0 "[ . 1 . 2]" 268 CHI1 1 72 SER N 1 72 SER CA 1 72 SER CB 1 72 SER OG -90.00 -150.00 106.79 65.56 61.43 . . 0 "[ . 1 . 2]" 269 CHI1 1 72 SER N 1 72 SER CA 1 72 SER CB 1 72 SER OG 30.00 -30.00 106.79 65.56 61.43 . . 0 "[ . 1 . 2]" 270 CHI1 1 72 SER N 1 72 SER CA 1 72 SER CB 1 72 SER OG 150.00 90.00 106.79 65.56 61.43 . . 0 "[ . 1 . 2]" 271 CHI1 1 75 SER N 1 75 SER CA 1 75 SER CB 1 75 SER OG -90.00 -150.00 -102.28 166.85 74.66 . . 0 "[ . 1 . 2]" 272 CHI1 1 75 SER N 1 75 SER CA 1 75 SER CB 1 75 SER OG 30.00 -30.00 -102.28 166.85 74.66 . . 0 "[ . 1 . 2]" 273 CHI1 1 75 SER N 1 75 SER CA 1 75 SER CB 1 75 SER OG 150.00 90.00 -102.28 166.85 74.66 . . 0 "[ . 1 . 2]" 274 CHI1 1 76 SER N 1 76 SER CA 1 76 SER CB 1 76 SER OG -90.00 -150.00 -106.28 50.21 -59.80 . . 0 "[ . 1 . 2]" 275 CHI1 1 76 SER N 1 76 SER CA 1 76 SER CB 1 76 SER OG 30.00 -30.00 -106.28 50.21 -59.80 . . 0 "[ . 1 . 2]" 276 CHI1 1 76 SER N 1 76 SER CA 1 76 SER CB 1 76 SER OG 150.00 90.00 -106.28 50.21 -59.80 . . 0 "[ . 1 . 2]" stop_ save_ save_distance_constraint_statistics_2 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 26 _TA_constraint_stats_list.Viol_count 5 _TA_constraint_stats_list.Viol_total 2.06 _TA_constraint_stats_list.Viol_max 0.05 _TA_constraint_stats_list.Viol_rms 0.00 _TA_constraint_stats_list.Viol_average_all_restraints 0.00 _TA_constraint_stats_list.Viol_average_violations_only 0.02 _TA_constraint_stats_list.Cutoff_violation_report 5.00 _TA_constraint_stats_list.Details . loop_ _TA_constraint_stats.Restraint_ID _TA_constraint_stats.Torsion_angle_name _TA_constraint_stats.Entity_assembly_ID_1 _TA_constraint_stats.Comp_index_ID_1 _TA_constraint_stats.Comp_ID_1 _TA_constraint_stats.Atom_ID_1 _TA_constraint_stats.Entity_assembly_ID_2 _TA_constraint_stats.Comp_index_ID_2 _TA_constraint_stats.Comp_ID_2 _TA_constraint_stats.Atom_ID_2 _TA_constraint_stats.Entity_assembly_ID_3 _TA_constraint_stats.Comp_index_ID_3 _TA_constraint_stats.Comp_ID_3 _TA_constraint_stats.Atom_ID_3 _TA_constraint_stats.Entity_assembly_ID_4 _TA_constraint_stats.Comp_index_ID_4 _TA_constraint_stats.Comp_ID_4 _TA_constraint_stats.Atom_ID_4 _TA_constraint_stats.Angle_lower_bound_val _TA_constraint_stats.Angle_upper_bound_val _TA_constraint_stats.Angle_average _TA_constraint_stats.Angle_minimum _TA_constraint_stats.Angle_maximum _TA_constraint_stats.Max_violation _TA_constraint_stats.Max_violation_model_number _TA_constraint_stats.Over_cutoff_violation_count _TA_constraint_stats.Over_cutoff_violation_per_model 1 PHI 1 9 TYR C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -160.10 -100.10 -127.66 -127.23 -130.80 . . 0 "[ . 1 . 2]" 2 PSI 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 VAL N 121.80 -178.20 156.60 157.55 156.14 . . 0 "[ . 1 . 2]" 3 PHI 1 10 PHE C 1 11 VAL N 1 11 VAL CA 1 11 VAL C -153.80 -93.80 -117.42 -131.92 -111.09 . . 0 "[ . 1 . 2]" 4 PSI 1 11 VAL N 1 11 VAL CA 1 11 VAL C 1 12 ALA N 107.00 167.00 136.65 142.25 139.67 . . 0 "[ . 1 . 2]" 5 PHI 1 31 LYS C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -156.70 -96.70 -130.08 -142.78 -118.99 . . 0 "[ . 1 . 2]" 6 PSI 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 GLN N 116.00 176.00 133.35 133.62 132.67 . . 0 "[ . 1 . 2]" 7 PHI 1 32 LEU C 1 33 GLN N 1 33 GLN CA 1 33 GLN C -154.30 -94.30 -98.64 -99.59 -100.48 . . 0 "[ . 1 . 2]" 8 PSI 1 33 GLN N 1 33 GLN CA 1 33 GLN C 1 34 VAL N 118.70 178.70 121.07 118.75 135.28 . . 0 "[ . 1 . 2]" 9 PHI 1 41 GLY C 1 42 TRP N 1 42 TRP CA 1 42 TRP C -139.60 -79.60 -105.98 -102.71 -105.29 . . 0 "[ . 1 . 2]" 10 PSI 1 42 TRP N 1 42 TRP CA 1 42 TRP C 1 43 TRP N 105.70 165.70 123.17 126.65 123.42 . . 0 "[ . 1 . 2]" 11 PHI 1 42 TRP C 1 43 TRP N 1 43 TRP CA 1 43 TRP C -141.30 -81.30 -115.46 -129.32 -103.08 . . 0 "[ . 1 . 2]" 12 PSI 1 43 TRP N 1 43 TRP CA 1 43 TRP C 1 44 LEU N 94.90 154.90 150.74 142.30 154.87 . . 0 "[ . 1 . 2]" 13 PHI 1 44 LEU C 1 45 ALA N 1 45 ALA CA 1 45 ALA C -174.20 -114.20 -115.04 -114.82 -115.02 0.03 12 0 "[ . 1 . 2]" 14 PSI 1 45 ALA N 1 45 ALA CA 1 45 ALA C 1 46 ARG N 132.90 -167.10 167.31 166.80 165.68 . . 0 "[ . 1 . 2]" 15 PHI 1 45 ALA C 1 46 ARG N 1 46 ARG CA 1 46 ARG C -171.50 -111.50 -127.84 -142.91 -121.20 . . 0 "[ . 1 . 2]" 16 PSI 1 46 ARG N 1 46 ARG CA 1 46 ARG C 1 47 HIS N 116.20 176.20 149.48 133.55 160.64 . . 0 "[ . 1 . 2]" 17 PHI 1 59 LEU C 1 60 GLN N 1 60 GLN CA 1 60 GLN C -167.50 -107.50 -128.34 -117.20 -122.58 . . 0 "[ . 1 . 2]" 18 PSI 1 60 GLN N 1 60 GLN CA 1 60 GLN C 1 61 GLY N 125.40 -174.60 139.51 130.30 169.59 . . 0 "[ . 1 . 2]" 19 PHI 1 61 GLY C 1 62 TYR N 1 62 TYR CA 1 62 TYR C -141.30 -81.30 -84.18 -89.61 -81.84 . . 0 "[ . 1 . 2]" 20 PSI 1 62 TYR N 1 62 TYR CA 1 62 TYR C 1 63 ILE N 113.90 173.90 129.80 124.70 121.16 . . 0 "[ . 1 . 2]" 21 PHI 1 67 TYR C 1 68 VAL N 1 68 VAL CA 1 68 VAL C -168.40 -108.40 -110.45 -114.69 -108.41 . . 0 "[ . 1 . 2]" 22 PSI 1 68 VAL N 1 68 VAL CA 1 68 VAL C 1 69 ALA N 128.70 -171.30 177.92 171.91 -177.15 . . 0 "[ . 1 . 2]" 23 PHI 1 69 ALA C 1 70 GLU N 1 70 GLU CA 1 70 GLU C -120.40 -60.40 -78.90 -80.80 -84.20 . . 0 "[ . 1 . 2]" 24 PSI 1 70 GLU N 1 70 GLU CA 1 70 GLU C 1 71 ASP N 94.00 154.00 106.76 106.80 105.13 . . 0 "[ . 1 . 2]" 25 PHI 1 70 GLU C 1 71 ASP N 1 71 ASP CA 1 71 ASP C -153.30 -93.30 -93.77 -93.39 -93.45 0.05 17 0 "[ . 1 . 2]" 26 PSI 1 71 ASP N 1 71 ASP CA 1 71 ASP C 1 72 SER N 109.20 169.20 148.45 144.46 135.45 . . 0 "[ . 1 . 2]" stop_ save_
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