NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
646922 | 6s3w | 27397 | cing | 2-parsed | STAR | dihedral angle | 152 |
data_6s3w_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_6s3w _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_6s3w 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_6s3w _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6s3w "Master copy" parsed_6s3w stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_6s3w _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 6s3w.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6s3w 1 1 6s3w.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 27 parsed_6s3w 1 1 6s3w.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 78 parsed_6s3w 1 1 6s3w.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 152 parsed_6s3w 1 1 6s3w.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 0 parsed_6s3w 1 1 6s3w.mr . . XPLOR/CNS 6 distance NOE ambi 0 parsed_6s3w 1 1 6s3w.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6s3w 1 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_6s3w _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -41.60 . " A" 254 . C " A" 255 . N " A" 255 . CA " A" 255 . C parsed_6s3w 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.14 . " A" 255 . N " A" 255 . CA " A" 255 . C " A" 256 . N parsed_6s3w 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -32.42 . " A" 255 . C " A" 256 . N " A" 256 . CA " A" 256 . C parsed_6s3w 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -9.26 . " A" 256 . N " A" 256 . CA " A" 256 . C " A" 257 . N parsed_6s3w 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.82 . " A" 256 . C " A" 257 . N " A" 257 . CA " A" 257 . C parsed_6s3w 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -25.80 . " A" 257 . N " A" 257 . CA " A" 257 . C " A" 258 . N parsed_6s3w 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -37.68 . " A" 257 . C " A" 258 . N " A" 258 . CA " A" 258 . C parsed_6s3w 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.74 . " A" 258 . N " A" 258 . CA " A" 258 . C " A" 259 . N parsed_6s3w 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.80 . " A" 258 . C " A" 259 . N " A" 259 . CA " A" 259 . C parsed_6s3w 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -15.56 . " A" 259 . N " A" 259 . CA " A" 259 . C " A" 260 . N parsed_6s3w 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -47.72 . " A" 259 . C " A" 260 . N " A" 260 . CA " A" 260 . C parsed_6s3w 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -17.76 . " A" 260 . N " A" 260 . CA " A" 260 . C " A" 261 . N parsed_6s3w 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.26 . " A" 260 . C " A" 261 . N " A" 261 . CA " A" 261 . C parsed_6s3w 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -14.98 . " A" 261 . N " A" 261 . CA " A" 261 . C " A" 262 . N parsed_6s3w 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.60 . " A" 261 . C " A" 262 . N " A" 262 . CA " A" 262 . C parsed_6s3w 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -18.90 . " A" 262 . N " A" 262 . CA " A" 262 . C " A" 263 . N parsed_6s3w 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -46.60 . " A" 262 . C " A" 263 . N " A" 263 . CA " A" 263 . C parsed_6s3w 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 6.54 . " A" 263 . N " A" 263 . CA " A" 263 . C " A" 264 . N parsed_6s3w 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -40.62 . " A" 263 . C " A" 264 . N " A" 264 . CA " A" 264 . C parsed_6s3w 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 2.00 . " A" 264 . N " A" 264 . CA " A" 264 . C " A" 265 . N parsed_6s3w 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -51.20 . " A" 264 . C " A" 265 . N " A" 265 . CA " A" 265 . C parsed_6s3w 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 30.54 . " A" 265 . N " A" 265 . CA " A" 265 . C " A" 266 . N parsed_6s3w 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -20.06 . " A" 265 . C " A" 266 . N " A" 266 . CA " A" 266 . C parsed_6s3w 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 170.00 . " A" 266 . N " A" 266 . CA " A" 266 . C " A" 267 . N parsed_6s3w 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -24.96 . " A" 266 . C " A" 267 . N " A" 267 . CA " A" 267 . C parsed_6s3w 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 178.50 . " A" 267 . N " A" 267 . CA " A" 267 . C " A" 268 . N parsed_6s3w 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -31.24 . " A" 267 . C " A" 268 . N " A" 268 . CA " A" 268 . C parsed_6s3w 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 164.78 . " A" 268 . N " A" 268 . CA " A" 268 . C " A" 269 . N parsed_6s3w 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -31.38 . " A" 268 . C " A" 269 . N " A" 269 . CA " A" 269 . C parsed_6s3w 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 180.62 . " A" 269 . N " A" 269 . CA " A" 269 . C " A" 270 . N parsed_6s3w 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -64.18 . " A" 270 . C " A" 271 . N " A" 271 . CA " A" 271 . C parsed_6s3w 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 29.66 . " A" 271 . N " A" 271 . CA " A" 271 . C " A" 272 . N parsed_6s3w 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -39.88 . " A" 271 . C " A" 272 . N " A" 272 . CA " A" 272 . C parsed_6s3w 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 180.48 . " A" 272 . N " A" 272 . CA " A" 272 . C " A" 273 . N parsed_6s3w 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -80.10 . " A" 272 . C " A" 273 . N " A" 273 . CA " A" 273 . C parsed_6s3w 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 167.50 . " A" 273 . N " A" 273 . CA " A" 273 . C " A" 274 . N parsed_6s3w 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -80.08 . " A" 276 . C " A" 277 . N " A" 277 . CA " A" 277 . C parsed_6s3w 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 179.50 . " A" 277 . N " A" 277 . CA " A" 277 . C " A" 278 . N parsed_6s3w 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -93.88 . " A" 277 . C " A" 278 . N " A" 278 . CA " A" 278 . C parsed_6s3w 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 159.32 . " A" 278 . N " A" 278 . CA " A" 278 . C " A" 279 . N parsed_6s3w 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.86 . " A" 278 . C " A" 279 . N " A" 279 . CA " A" 279 . C parsed_6s3w 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 152.26 . " A" 279 . N " A" 279 . CA " A" 279 . C " A" 280 . N parsed_6s3w 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -82.44 . " A" 279 . C " A" 280 . N " A" 280 . CA " A" 280 . C parsed_6s3w 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 156.60 . " A" 280 . N " A" 280 . CA " A" 280 . C " A" 281 . N parsed_6s3w 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -89.74 . " A" 280 . C " A" 281 . N " A" 281 . CA " A" 281 . C parsed_6s3w 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 149.96 . " A" 281 . N " A" 281 . CA " A" 281 . C " A" 282 . N parsed_6s3w 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -95.12 . " A" 281 . C " A" 282 . N " A" 282 . CA " A" 282 . C parsed_6s3w 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 175.06 . " A" 282 . N " A" 282 . CA " A" 282 . C " A" 283 . N parsed_6s3w 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -103.16 . " A" 282 . C " A" 283 . N " A" 283 . CA " A" 283 . C parsed_6s3w 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 171.30 . " A" 283 . N " A" 283 . CA " A" 283 . C " A" 284 . N parsed_6s3w 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -93.26 . " A" 283 . C " A" 284 . N " A" 284 . CA " A" 284 . C parsed_6s3w 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 180.64 . " A" 284 . N " A" 284 . CA " A" 284 . C " A" 285 . N parsed_6s3w 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.00 133.88 . " A" 287 . C " A" 288 . N " A" 288 . CA " A" 288 . C parsed_6s3w 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 16.48 . " A" 288 . N " A" 288 . CA " A" 288 . C " A" 289 . N parsed_6s3w 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -9.40 . " A" 288 . C " A" 289 . N " A" 289 . CA " A" 289 . C parsed_6s3w 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 168.18 . " A" 289 . N " A" 289 . CA " A" 289 . C " A" 290 . N parsed_6s3w 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -67.90 . " A" 289 . C " A" 290 . N " A" 290 . CA " A" 290 . C parsed_6s3w 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 150.16 . " A" 290 . N " A" 290 . CA " A" 290 . C " A" 291 . N parsed_6s3w 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -74.72 . " A" 291 . C " A" 292 . N " A" 292 . CA " A" 292 . C parsed_6s3w 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 169.36 . " A" 292 . N " A" 292 . CA " A" 292 . C " A" 293 . N parsed_6s3w 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -48.16 . " A" 292 . C " A" 293 . N " A" 293 . CA " A" 293 . C parsed_6s3w 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 170.06 . " A" 293 . N " A" 293 . CA " A" 293 . C " A" 294 . N parsed_6s3w 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -81.24 . " A" 293 . C " A" 294 . N " A" 294 . CA " A" 294 . C parsed_6s3w 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 163.36 . " A" 294 . N " A" 294 . CA " A" 294 . C " A" 295 . N parsed_6s3w 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -29.46 . " A" 294 . C " A" 295 . N " A" 295 . CA " A" 295 . C parsed_6s3w 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 177.58 . " A" 295 . N " A" 295 . CA " A" 295 . C " A" 296 . N parsed_6s3w 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -119.70 . " A" 296 . C " A" 297 . N " A" 297 . CA " A" 297 . C parsed_6s3w 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 170.42 . " A" 297 . N " A" 297 . CA " A" 297 . C " A" 298 . N parsed_6s3w 1 69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -65.34 . " A" 297 . C " A" 298 . N " A" 298 . CA " A" 298 . C parsed_6s3w 1 70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 149.98 . " A" 298 . N " A" 298 . CA " A" 298 . C " A" 299 . N parsed_6s3w 1 71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -79.86 . " A" 298 . C " A" 299 . N " A" 299 . CA " A" 299 . C parsed_6s3w 1 72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -16.34 . " A" 302 . N " A" 302 . CA " A" 302 . C " A" 303 . N parsed_6s3w 1 73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.84 . " A" 302 . C " A" 303 . N " A" 303 . CA " A" 303 . C parsed_6s3w 1 74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -10.24 . " A" 303 . N " A" 303 . CA " A" 303 . C " A" 304 . N parsed_6s3w 1 75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.92 . " A" 303 . C " A" 304 . N " A" 304 . CA " A" 304 . C parsed_6s3w 1 76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -18.60 . " A" 304 . N " A" 304 . CA " A" 304 . C " A" 305 . N parsed_6s3w 1 77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -26.62 . " A" 304 . C " A" 305 . N " A" 305 . CA " A" 305 . C parsed_6s3w 1 78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -17.22 . " A" 305 . N " A" 305 . CA " A" 305 . C " A" 306 . N parsed_6s3w 1 79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.76 . " A" 305 . C " A" 306 . N " A" 306 . CA " A" 306 . C parsed_6s3w 1 80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -12.04 . " A" 306 . N " A" 306 . CA " A" 306 . C " A" 307 . N parsed_6s3w 1 81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.92 . " A" 306 . C " A" 307 . N " A" 307 . CA " A" 307 . C parsed_6s3w 1 82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -26.86 . " A" 307 . N " A" 307 . CA " A" 307 . C " A" 308 . N parsed_6s3w 1 83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -35.14 . " A" 307 . C " A" 308 . N " A" 308 . CA " A" 308 . C parsed_6s3w 1 84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -14.38 . " A" 308 . N " A" 308 . CA " A" 308 . C " A" 309 . N parsed_6s3w 1 85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -44.50 . " A" 308 . C " A" 309 . N " A" 309 . CA " A" 309 . C parsed_6s3w 1 86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.66 . " A" 309 . N " A" 309 . CA " A" 309 . C " A" 310 . N parsed_6s3w 1 87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.96 . " A" 309 . C " A" 310 . N " A" 310 . CA " A" 310 . C parsed_6s3w 1 88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -10.80 . " A" 310 . N " A" 310 . CA " A" 310 . C " A" 311 . N parsed_6s3w 1 89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.16 . " A" 310 . C " A" 311 . N " A" 311 . CA " A" 311 . C parsed_6s3w 1 90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -14.16 . " A" 311 . N " A" 311 . CA " A" 311 . C " A" 312 . N parsed_6s3w 1 91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.96 . " A" 311 . C " A" 312 . N " A" 312 . CA " A" 312 . C parsed_6s3w 1 92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -13.92 . " A" 312 . N " A" 312 . CA " A" 312 . C " A" 313 . N parsed_6s3w 1 93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.40 . " A" 312 . C " A" 313 . N " A" 313 . CA " A" 313 . C parsed_6s3w 1 94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -7.76 . " A" 313 . N " A" 313 . CA " A" 313 . C " A" 314 . N parsed_6s3w 1 95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.18 . " A" 313 . C " A" 314 . N " A" 314 . CA " A" 314 . C parsed_6s3w 1 96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 0.08 . " A" 314 . N " A" 314 . CA " A" 314 . C " A" 315 . N parsed_6s3w 1 97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -49.04 . " A" 314 . C " A" 315 . N " A" 315 . CA " A" 315 . C parsed_6s3w 1 98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -1.28 . " A" 315 . N " A" 315 . CA " A" 315 . C " A" 316 . N parsed_6s3w 1 99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -67.28 . " A" 316 . C " A" 317 . N " A" 317 . CA " A" 317 . C parsed_6s3w 1 100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 167.96 . " A" 317 . N " A" 317 . CA " A" 317 . C " A" 318 . N parsed_6s3w 1 101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -31.12 . " A" 317 . C " A" 318 . N " A" 318 . CA " A" 318 . C parsed_6s3w 1 102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 181.30 . " A" 318 . N " A" 318 . CA " A" 318 . C " A" 319 . N parsed_6s3w 1 103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -34.64 . " A" 319 . C " A" 320 . N " A" 320 . CA " A" 320 . C parsed_6s3w 1 104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 4.78 . " A" 320 . N " A" 320 . CA " A" 320 . C " A" 321 . N parsed_6s3w 1 105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -32.04 . " A" 320 . C " A" 321 . N " A" 321 . CA " A" 321 . C parsed_6s3w 1 106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 4.66 . " A" 321 . N " A" 321 . CA " A" 321 . C " A" 322 . N parsed_6s3w 1 107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -42.72 . " A" 324 . C " A" 325 . N " A" 325 . CA " A" 325 . C parsed_6s3w 1 108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 180.98 . " A" 325 . N " A" 325 . CA " A" 325 . C " A" 326 . N parsed_6s3w 1 109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -30.26 . " A" 326 . C " A" 327 . N " A" 327 . CA " A" 327 . C parsed_6s3w 1 110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 19.50 . " A" 327 . N " A" 327 . CA " A" 327 . C " A" 328 . N parsed_6s3w 1 111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.46 . " A" 327 . C " A" 328 . N " A" 328 . CA " A" 328 . C parsed_6s3w 1 112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.66 . " A" 328 . N " A" 328 . CA " A" 328 . C " A" 329 . N parsed_6s3w 1 113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -47.44 . " A" 328 . C " A" 329 . N " A" 329 . CA " A" 329 . C parsed_6s3w 1 114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.70 . " A" 329 . N " A" 329 . CA " A" 329 . C " A" 330 . N parsed_6s3w 1 115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -35.08 . " A" 329 . C " A" 330 . N " A" 330 . CA " A" 330 . C parsed_6s3w 1 116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -9.74 . " A" 330 . N " A" 330 . CA " A" 330 . C " A" 331 . N parsed_6s3w 1 117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -26.22 . " A" 330 . C " A" 331 . N " A" 331 . CA " A" 331 . C parsed_6s3w 1 118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -3.82 . " A" 331 . N " A" 331 . CA " A" 331 . C " A" 332 . N parsed_6s3w 1 119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -49.78 . " A" 331 . C " A" 332 . N " A" 332 . CA " A" 332 . C parsed_6s3w 1 120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -9.94 . " A" 332 . N " A" 332 . CA " A" 332 . C " A" 333 . N parsed_6s3w 1 121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -90.68 . " A" 334 . C " A" 335 . N " A" 335 . CA " A" 335 . C parsed_6s3w 1 122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 208.80 . " A" 335 . N " A" 335 . CA " A" 335 . C " A" 336 . N parsed_6s3w 1 123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -86.70 . " A" 335 . C " A" 336 . N " A" 336 . CA " A" 336 . C parsed_6s3w 1 124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 170.72 . " A" 336 . N " A" 336 . CA " A" 336 . C " A" 337 . N parsed_6s3w 1 125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -91.80 . " A" 336 . C " A" 337 . N " A" 337 . CA " A" 337 . C parsed_6s3w 1 126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 168.30 . " A" 337 . N " A" 337 . CA " A" 337 . C " A" 338 . N parsed_6s3w 1 127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -78.98 . " A" 337 . C " A" 338 . N " A" 338 . CA " A" 338 . C parsed_6s3w 1 128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 161.80 . " A" 338 . N " A" 338 . CA " A" 338 . C " A" 339 . N parsed_6s3w 1 129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -85.96 . " A" 338 . C " A" 339 . N " A" 339 . CA " A" 339 . C parsed_6s3w 1 130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 146.26 . " A" 339 . N " A" 339 . CA " A" 339 . C " A" 340 . N parsed_6s3w 1 131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -78.54 . " A" 339 . C " A" 340 . N " A" 340 . CA " A" 340 . C parsed_6s3w 1 132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 158.56 . " A" 340 . N " A" 340 . CA " A" 340 . C " A" 341 . N parsed_6s3w 1 133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -59.68 . " A" 340 . C " A" 341 . N " A" 341 . CA " A" 341 . C parsed_6s3w 1 134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 141.48 . " A" 341 . N " A" 341 . CA " A" 341 . C " A" 342 . N parsed_6s3w 1 135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -28.94 . " A" 341 . C " A" 342 . N " A" 342 . CA " A" 342 . C parsed_6s3w 1 136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 179.22 . " A" 342 . N " A" 342 . CA " A" 342 . C " A" 343 . N parsed_6s3w 1 137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -98.68 . " A" 342 . C " A" 343 . N " A" 343 . CA " A" 343 . C parsed_6s3w 1 138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 195.28 . " A" 343 . N " A" 343 . CA " A" 343 . C " A" 344 . N parsed_6s3w 1 139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -40.10 . " B" 2 . C " B" 3 . N " B" 3 . CA " B" 3 . C parsed_6s3w 1 140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 170.74 . " B" 3 . N " B" 3 . CA " B" 3 . C " B" 4 . N parsed_6s3w 1 141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -53.76 . " B" 3 . C " B" 4 . N " B" 4 . CA " B" 4 . C parsed_6s3w 1 142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 155.06 . " B" 4 . N " B" 4 . CA " B" 4 . C " B" 5 . N parsed_6s3w 1 143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -69.12 . " B" 4 . C " B" 5 . N " B" 5 . CA " B" 5 . C parsed_6s3w 1 144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 153.90 . " B" 5 . N " B" 5 . CA " B" 5 . C " B" 6 . N parsed_6s3w 1 145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -69.84 . " B" 5 . C " B" 6 . N " B" 6 . CA " B" 6 . C parsed_6s3w 1 146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.82 . " B" 6 . N " B" 6 . CA " B" 6 . C " B" 7 . N parsed_6s3w 1 147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -67.16 . " B" 7 . C " B" 8 . N " B" 8 . CA " B" 8 . C parsed_6s3w 1 148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 182.86 . " B" 8 . N " B" 8 . CA " B" 8 . C " B" 9 . N parsed_6s3w 1 149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 170.00 -476.58 . " B" 8 . C " B" 9 . N " B" 9 . CA " B" 9 . C parsed_6s3w 1 150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.00 235.56 . " B" 9 . N " B" 9 . CA " B" 9 . C " B" 10 . N parsed_6s3w 1 151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -54.20 . " B" 9 . C " B" 10 . N " B" 10 . CA " B" 10 . C parsed_6s3w 1 152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 167.98 . " B" 10 . N " B" 10 . CA " B" 10 . C " B" 11 . N parsed_6s3w 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 "# Restraints file 3: torsion_angles_tola3.tbl" 1 1 1 45 parsed_6s3w 1 2 "# Restraints file 4: torsion_angles_tolbp.tbl" 416 1 416 45 parsed_6s3w 1 stop_ save_
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