NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing in_recoord stage program type item_count
36362 1ner 287 cing recoord 2-parsed STAR dihedral angle 85


data_1ner_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1ner 
    _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_1ner   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1ner 
    _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   1ner   "Master copy"    parsed_1ner   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1ner 
    _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   1ner.mr   .   .   "MR format"     1    comment                  "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    XPLOR/CNS      2    distance                  NOE                 simple             1227   parsed_1ner   1   
        1   1ner.mr   .   .    XPLOR/CNS      3    distance                 "hydrogen bond"      simple               40   parsed_1ner   1   
        1   1ner.mr   .   .    n/a            4    comment                  "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    XPLOR/CNS      5   "dihedral angle"          "Not applicable"    "Not applicable"      85   parsed_1ner   1   
        1   1ner.mr   .   .    n/a            6    comment                  "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    XPLOR/CNS      7   "coupling constant"       "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    n/a            8    comment                  "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    XPLOR/CNS      9   "chemical shift"          "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    n/a           10    comment                  "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    XPLOR/CNS     11   "chemical shift"          "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    n/a           12    comment                  "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .    PIPP          13   "chemical shift"          "Not applicable"    "Not applicable"       0   parsed_1ner   1   
        1   1ner.mr   .   .   "MR format"    14   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1ner   1   
    stop_

save_


save_CNS/XPLOR_dihedral_5
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_1ner 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            5 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -192.0    -72.0   .   .    6   .   c    .    7   .   n    .    7   .   ca    .    7   .   c     parsed_1ner   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0    -40.0   .   .    7   .   c    .    8   .   n    .    8   .   ca    .    8   .   c     parsed_1ner   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .    8   .   c    .    9   .   n    .    9   .   ca    .    9   .   c     parsed_1ner   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   10   .   c    .   11   .   n    .   11   .   ca    .   11   .   c     parsed_1ner   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   11   .   c    .   12   .   n    .   12   .   ca    .   12   .   c     parsed_1ner   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68.0    -48.0   .   .   12   .   c    .   13   .   n    .   13   .   ca    .   13   .   c     parsed_1ner   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -84.0    -64.0   .   .   13   .   c    .   14   .   n    .   14   .   ca    .   14   .   c     parsed_1ner   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   14   .   c    .   15   .   n    .   15   .   ca    .   15   .   c     parsed_1ner   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -60.0    -40.0   .   .   15   .   c    .   16   .   n    .   16   .   ca    .   16   .   c     parsed_1ner   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   16   .   c    .   17   .   n    .   17   .   ca    .   17   .   c     parsed_1ner   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   17   .   c    .   18   .   n    .   18   .   ca    .   18   .   c     parsed_1ner   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -72.0    -32.0   .   .   18   .   c    .   19   .   n    .   19   .   ca    .   19   .   c     parsed_1ner   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -73.0    -33.0   .   .   19   .   c    .   20   .   n    .   20   .   ca    .   20   .   c     parsed_1ner   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0    -90.0   .   .   20   .   c    .   21   .   n    .   21   .   ca    .   21   .   c     parsed_1ner   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0    -30.0   .   .   23   .   c    .   24   .   n    .   24   .   ca    .   24   .   c     parsed_1ner   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   24   .   c    .   25   .   n    .   25   .   ca    .   25   .   c     parsed_1ner   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   25   .   c    .   26   .   n    .   26   .   ca    .   26   .   c     parsed_1ner   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   26   .   c    .   27   .   n    .   27   .   ca    .   27   .   c     parsed_1ner   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68.0    -48.0   .   .   27   .   c    .   28   .   n    .   28   .   ca    .   28   .   c     parsed_1ner   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -71.0    -51.0   .   .   28   .   c    .   29   .   n    .   29   .   ca    .   29   .   c     parsed_1ner   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -88.0    -68.0   .   .   29   .   c    .   30   .   n    .   30   .   ca    .   30   .   c     parsed_1ner   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -84.0    -64.0   .   .   30   .   c    .   31   .   n    .   31   .   ca    .   31   .   c     parsed_1ner   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -109.0    -49.0   .   .   31   .   c    .   32   .   n    .   32   .   ca    .   32   .   c     parsed_1ner   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -55.0    -35.0   .   .   37   .   c    .   38   .   n    .   38   .   ca    .   38   .   c     parsed_1ner   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -49.0    -29.0   .   .   38   .   c    .   39   .   n    .   39   .   ca    .   39   .   c     parsed_1ner   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -60.0    -40.0   .   .   39   .   c    .   40   .   n    .   40   .   ca    .   40   .   c     parsed_1ner   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -97.0    -57.0   .   .   40   .   c    .   41   .   n    .   41   .   ca    .   41   .   c     parsed_1ner   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -94.0    -74.0   .   .   41   .   c    .   42   .   n    .   42   .   ca    .   42   .   c     parsed_1ner   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0    -40.0   .   .   42   .   c    .   43   .   n    .   43   .   ca    .   43   .   c     parsed_1ner   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -132.0    -92.0   .   .   43   .   c    .   44   .   n    .   44   .   ca    .   44   .   c     parsed_1ner   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   44   .   c    .   45   .   n    .   45   .   ca    .   45   .   c     parsed_1ner   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   45   .   c    .   46   .   n    .   46   .   ca    .   46   .   c     parsed_1ner   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -240.0   -120.0   .   .   46   .   c    .   47   .   n    .   47   .   ca    .   47   .   c     parsed_1ner   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -50.0   .   .   48   .   c    .   49   .   n    .   49   .   ca    .   49   .   c     parsed_1ner   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   49   .   c    .   50   .   n    .   50   .   ca    .   50   .   c     parsed_1ner   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -69.0    -49.0   .   .   50   .   c    .   51   .   n    .   51   .   ca    .   51   .   c     parsed_1ner   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -61.0    -41.0   .   .   51   .   c    .   52   .   n    .   52   .   ca    .   52   .   c     parsed_1ner   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -60.0    -40.0   .   .   52   .   c    .   53   .   n    .   53   .   ca    .   53   .   c     parsed_1ner   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -76.0    -56.0   .   .   53   .   c    .   54   .   n    .   54   .   ca    .   54   .   c     parsed_1ner   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -72.0    -42.0   .   .   54   .   c    .   55   .   n    .   55   .   ca    .   55   .   c     parsed_1ner   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -73.0    -47.0   .   .   55   .   c    .   56   .   n    .   56   .   ca    .   56   .   c     parsed_1ner   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -81.0    -61.0   .   .   56   .   c    .   57   .   n    .   57   .   ca    .   57   .   c     parsed_1ner   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -120.0    -60.0   .   .   57   .   c    .   58   .   n    .   58   .   ca    .   58   .   c     parsed_1ner   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     52.0     72.0   .   .   58   .   c    .   59   .   n    .   59   .   ca    .   59   .   c     parsed_1ner   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -152.0   -112.0   .   .   59   .   c    .   60   .   n    .   60   .   ca    .   60   .   c     parsed_1ner   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -180.0    -60.0   .   .   60   .   c    .   61   .   n    .   61   .   ca    .   61   .   c     parsed_1ner   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -78.0    -18.0   .   .   62   .   c    .   63   .   n    .   63   .   ca    .   63   .   c     parsed_1ner   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0    -90.0   .   .   63   .   c    .   64   .   n    .   64   .   ca    .   64   .   c     parsed_1ner   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -70.0   .   .   64   .   c    .   65   .   n    .   65   .   ca    .   65   .   c     parsed_1ner   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -157.0   -117.0   .   .   65   .   c    .   66   .   n    .   66   .   ca    .   66   .   c     parsed_1ner   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   67   .   c    .   68   .   n    .   68   .   ca    .   68   .   c     parsed_1ner   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -180.0    -60.0   .   .   68   .   c    .   69   .   n    .   69   .   ca    .   69   .   c     parsed_1ner   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -180.0    -60.0   .   .   69   .   c    .   70   .   n    .   70   .   ca    .   70   .   c     parsed_1ner   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -180.0   -100.0   .   .   70   .   c    .   71   .   n    .   71   .   ca    .   71   .   c     parsed_1ner   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -146.0     -6.0   .   .   73   .   c    .   74   .   n    .   74   .   ca    .   74   .   c     parsed_1ner   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   14   .   n    .   14   .   ca   .   14   .   cb    .   14   .   cg1   parsed_1ner   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   64   .   n    .   64   .   ca   .   64   .   cb    .   64   .   cg1   parsed_1ner   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   15   .   n    .   15   .   ca   .   15   .   cb    .   15   .   cg1   parsed_1ner   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   53   .   n    .   53   .   ca   .   53   .   cb    .   53   .   cg1   parsed_1ner   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   54   .   n    .   54   .   ca   .   54   .   cb    .   54   .   cg1   parsed_1ner   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   65   .   n    .   65   .   ca   .   65   .   cb    .   65   .   cg1   parsed_1ner   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0     80.0   .   .   37   .   n    .   37   .   ca   .   37   .   cb    .   37   .   og1   parsed_1ner   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   38   .   n    .   38   .   ca   .   38   .   cb    .   38   .   og1   parsed_1ner   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   60   .   n    .   60   .   ca   .   60   .   cb    .   60   .   og1   parsed_1ner   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .    9   .   n    .    9   .   ca   .    9   .   cb    .    9   .   cg    parsed_1ner   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   13   .   n    .   13   .   ca   .   13   .   cb    .   13   .   cg    parsed_1ner   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   18   .   n    .   18   .   ca   .   18   .   cb    .   18   .   cg    parsed_1ner   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   21   .   n    .   21   .   ca   .   21   .   cb    .   21   .   cg    parsed_1ner   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0     80.0   .   .   24   .   n    .   24   .   ca   .   24   .   cb    .   24   .   og    parsed_1ner   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   25   .   n    .   25   .   ca   .   25   .   cb    .   25   .   cg    parsed_1ner   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   32   .   n    .   32   .   ca   .   32   .   cb    .   32   .   cg    parsed_1ner   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   34   .   n    .   34   .   ca   .   34   .   cb    .   34   .   cg    parsed_1ner   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   49   .   n    .   49   .   ca   .   49   .   cb    .   49   .   cg    parsed_1ner   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   51   .   n    .   51   .   ca   .   51   .   cb    .   51   .   cg    parsed_1ner   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   61   .   n    .   61   .   ca   .   61   .   cb    .   61   .   cg    parsed_1ner   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   66   .   n    .   66   .   ca   .   66   .   cb    .   66   .   cg    parsed_1ner   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .    8   .   n    .    8   .   ca   .    8   .   cb    .    8   .   cg    parsed_1ner   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   23   .   n    .   23   .   ca   .   23   .   cb    .   23   .   cg    parsed_1ner   1   
        79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   69   .   n    .   69   .   ca   .   69   .   cb    .   69   .   cg    parsed_1ner   1   
        80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0    -40.0   .   .   70   .   n    .   70   .   ca   .   70   .   cb    .   70   .   cg    parsed_1ner   1   
        81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .    7   .   n    .    7   .   ca   .    7   .   cb    .    7   .   cg    parsed_1ner   1   
        82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   18   .   ca   .   18   .   cb   .   18   .   cg    .   18   .   cd1   parsed_1ner   1   
        83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   23   .   ca   .   23   .   cb   .   23   .   cg    .   23   .   cd1   parsed_1ner   1   
        84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   53   .   ca   .   53   .   cb   .   53   .   cg1   .   53   .   cd1   parsed_1ner   1   
        85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0    200.0   .   .   54   .   ca   .   54   .   cb   .   54   .   cg1   .   54   .   cd1   parsed_1ner   1   
    stop_


    loop_
        _TA_constraint_comment_org.ID 
        _TA_constraint_comment_org.Comment_text 
        _TA_constraint_comment_org.Comment_begin_line 
        _TA_constraint_comment_org.Comment_begin_column 
        _TA_constraint_comment_org.Comment_end_line 
        _TA_constraint_comment_org.Comment_end_column 
        _TA_constraint_comment_org.Entry_ID 
        _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 

         1   
;
Phi Angle Constraints
R7
;
     1   1     3   4   parsed_1ner   1   
         2    D8      7   1     7   4   parsed_1ner   1   
         3    W9     10   1    10   4   parsed_1ner   1   
         4    R11    14   1    14   5   parsed_1ner   1   
         5    A12    18   1    18   5   parsed_1ner   1   
         6    D13    22   1    22   5   parsed_1ner   1   
         7    V14    26   1    26   5   parsed_1ner   1   
         8    I15    30   1    30   5   parsed_1ner   1   
         9    A16    34   1    34   5   parsed_1ner   1   
        10    G17    38   1    38   5   parsed_1ner   1   
        11    L18    42   1    42   5   parsed_1ner   1   
        12    K19    46   1    46   5   parsed_1ner   1   
        13    K20    50   1    50   5   parsed_1ner   1   
        14    R21    54   1    54   5   parsed_1ner   1   
        15    S24    59   1    59   5   parsed_1ner   1   
        16    L25    63   1    63   5   parsed_1ner   1   
        17    S26    67   1    67   5   parsed_1ner   1   
        18    A27    71   1    71   5   parsed_1ner   1   
        19    L28    75   1    75   5   parsed_1ner   1   
        20    S29    79   1    79   5   parsed_1ner   1   
        21    R30    83   1    83   5   parsed_1ner   1   
        22    Q31    87   1    87   5   parsed_1ner   1   
        23    F32    91   1    91   5   parsed_1ner   1   
        24    T38    95   1    95   5   parsed_1ner   1   
        25    L39    99   1    99   5   parsed_1ner   1   
        26    A40   103   1   103   5   parsed_1ner   1   
        27    N41   107   1   107   5   parsed_1ner   1   
        28    A42   111   1   111   5   parsed_1ner   1   
        29    L43   115   1   115   5   parsed_1ner   1   
        30    E44   119   1   119   5   parsed_1ner   1   
        31    R45   123   1   123   5   parsed_1ner   1   
        32    H46   127   1   127   5   parsed_1ner   1   
        33    W47   131   1   131   5   parsed_1ner   1   
        34    K49   135   1   135   5   parsed_1ner   1   
        35    G50   139   1   139   5   parsed_1ner   1   
        36    E51   143   1   143   5   parsed_1ner   1   
        37    Q52   147   1   147   5   parsed_1ner   1   
        38    I53   151   1   151   5   parsed_1ner   1   
        39    I54   155   1   155   5   parsed_1ner   1   
        40    A55   159   1   159   5   parsed_1ner   1   
        41    N56   163   1   163   5   parsed_1ner   1   
        42    A57   167   1   167   5   parsed_1ner   1   
        43    L58   171   1   171   5   parsed_1ner   1   
        44    E59   175   1   175   5   parsed_1ner   1   
        45    T60   179   1   179   5   parsed_1ner   1   
        46    K61   183   1   183   5   parsed_1ner   1   
        47    E63   187   1   187   5   parsed_1ner   1   
        48    V64   191   1   191   5   parsed_1ner   1   
        49    I65   195   1   195   5   parsed_1ner   1   
        50    W66   199   1   199   5   parsed_1ner   1   
        51    S68   203   1   203   5   parsed_1ner   1   
        52    R69   207   1   207   5   parsed_1ner   1   
        53    Y70   211   1   211   5   parsed_1ner   1   
        54    Q71   215   1   215   5   parsed_1ner   1   
        55    E74   219   1   219   5   parsed_1ner   1   
        56   
;
Chi1 angles
Added 11/23/94
V14
;
   223   1   225   5   parsed_1ner   1   
        57    V64   229   1   229   5   parsed_1ner   1   
        58    I15   233   1   233   5   parsed_1ner   1   
        59    I53   237   1   237   5   parsed_1ner   1   
        60    I54   241   1   241   5   parsed_1ner   1   
        61    I65   245   1   245   5   parsed_1ner   1   
        62    T37   249   1   249   5   parsed_1ner   1   
        63    T38   253   1   253   5   parsed_1ner   1   
        64    T60   257   1   257   5   parsed_1ner   1   
        65   
;
Added 04/07/95
W9
;
   261   1   263   4   parsed_1ner   1   
        66    D13   267   1   267   5   parsed_1ner   1   
        67    L18   271   1   271   5   parsed_1ner   1   
        68    R21   275   1   275   5   parsed_1ner   1   
        69    S24   279   1   279   5   parsed_1ner   1   
        70    L25   283   1   283   5   parsed_1ner   1   
        71    F32   287   1   287   5   parsed_1ner   1   
        72    Y34   291   1   291   5   parsed_1ner   1   
        73    K49   295   1   295   5   parsed_1ner   1   
        74    E51   299   1   299   5   parsed_1ner   1   
        75    K61   303   1   303   5   parsed_1ner   1   
        76    W66   307   1   307   5   parsed_1ner   1   
        77   
;
Added 04/11/95
D8
;
   311   1   313   4   parsed_1ner   1   
        78    L23   317   1   317   5   parsed_1ner   1   
        79    R69   321   1   321   5   parsed_1ner   1   
        80    Y70   325   1   325   5   parsed_1ner   1   
        81   
;
Added 04/12/95
R7
;
   329   1   331   4   parsed_1ner   1   
        82   
;
Chi2 angles
Added 04/13/95
L18
;
   335   1   338   5   parsed_1ner   1   
        83    L23   342   1   342   5   parsed_1ner   1   
        84    I53   346   1   346   5   parsed_1ner   1   
        85    I54   350   1   350   5   parsed_1ner   1   
    stop_

save_





Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Monday, May 13, 2024 10:36:07 PM GMT (wattos1)