NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type item_count
43228 2adz 6753 cing 2-parsed STAR dihedral angle 84


data_2adz_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2adz 
    _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_2adz   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2adz 
    _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   2adz   "Master copy"    parsed_2adz   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2adz 
    _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   2adz.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2adz   1   
        1   2adz.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1779   parsed_2adz   1   
        1   2adz.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               80   parsed_2adz   1   
        1   2adz.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"      84   parsed_2adz   1   
        1   2adz.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2adz   1   
    stop_

save_


save_CNS/XPLOR_dihedral_4
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_2adz 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   162   .   c   .   163   .   n    .   163   .   ca   .   163   .   c   parsed_2adz   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   163   .   c   .   164   .   n    .   164   .   ca   .   164   .   c   parsed_2adz   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   164   .   c   .   165   .   n    .   165   .   ca   .   165   .   c   parsed_2adz   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   165   .   c   .   166   .   n    .   166   .   ca   .   166   .   c   parsed_2adz   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   166   .   c   .   167   .   n    .   167   .   ca   .   167   .   c   parsed_2adz   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   167   .   c   .   168   .   n    .   168   .   ca   .   168   .   c   parsed_2adz   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   168   .   c   .   169   .   n    .   169   .   ca   .   169   .   c   parsed_2adz   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   169   .   c   .   170   .   n    .   170   .   ca   .   170   .   c   parsed_2adz   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   170   .   c   .   171   .   n    .   171   .   ca   .   171   .   c   parsed_2adz   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   171   .   c   .   172   .   n    .   172   .   ca   .   172   .   c   parsed_2adz   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   172   .   c   .   173   .   n    .   173   .   ca   .   173   .   c   parsed_2adz   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   173   .   c   .   174   .   n    .   174   .   ca   .   174   .   c   parsed_2adz   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   174   .   c   .   175   .   n    .   175   .   ca   .   175   .   c   parsed_2adz   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .     8   .   c   .     9   .   n    .     9   .   ca   .     9   .   c   parsed_2adz   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    12   .   c   .    13   .   n    .    13   .   ca   .    13   .   c   parsed_2adz   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    13   .   c   .    14   .   n    .    14   .   ca   .    14   .   c   parsed_2adz   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    14   .   c   .    15   .   n    .    15   .   ca   .    15   .   c   parsed_2adz   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    29   .   c   .    30   .   n    .    30   .   ca   .    30   .   c   parsed_2adz   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    30   .   c   .    31   .   n    .    31   .   ca   .    31   .   c   parsed_2adz   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    31   .   c   .    32   .   n    .    32   .   ca   .    32   .   c   parsed_2adz   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    32   .   c   .    33   .   n    .    33   .   ca   .    33   .   c   parsed_2adz   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    33   .   c   .    34   .   n    .    34   .   ca   .    34   .   c   parsed_2adz   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    38   .   c   .    39   .   n    .    39   .   ca   .    39   .   c   parsed_2adz   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    39   .   c   .    40   .   n    .    40   .   ca   .    40   .   c   parsed_2adz   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    40   .   c   .    41   .   n    .    41   .   ca   .    41   .   c   parsed_2adz   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .    41   .   c   .    42   .   n    .    42   .   ca   .    42   .   c   parsed_2adz   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   120   .   c   .   121   .   n    .   121   .   ca   .   121   .   c   parsed_2adz   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   121   .   c   .   122   .   n    .   122   .   ca   .   122   .   c   parsed_2adz   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   122   .   c   .   123   .   n    .   123   .   ca   .   123   .   c   parsed_2adz   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   128   .   c   .   129   .   n    .   129   .   ca   .   129   .   c   parsed_2adz   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   129   .   c   .   130   .   n    .   130   .   ca   .   130   .   c   parsed_2adz   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   130   .   c   .   131   .   n    .   131   .   ca   .   131   .   c   parsed_2adz   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   131   .   c   .   132   .   n    .   132   .   ca   .   132   .   c   parsed_2adz   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   132   .   c   .   133   .   n    .   133   .   ca   .   133   .   c   parsed_2adz   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   143   .   c   .   144   .   n    .   144   .   ca   .   144   .   c   parsed_2adz   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   144   .   c   .   145   .   n    .   145   .   ca   .   145   .   c   parsed_2adz   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   145   .   c   .   146   .   n    .   146   .   ca   .   146   .   c   parsed_2adz   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   146   .   c   .   147   .   n    .   147   .   ca   .   147   .   c   parsed_2adz   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   147   .   c   .   148   .   n    .   148   .   ca   .   148   .   c   parsed_2adz   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   152   .   c   .   153   .   n    .   153   .   ca   .   153   .   c   parsed_2adz   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   153   .   c   .   154   .   n    .   154   .   ca   .   154   .   c   parsed_2adz   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   154   .   c   .   155   .   n    .   155   .   ca   .   155   .   c   parsed_2adz   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   155   .   c   .   156   .   n    .   156   .   ca   .   156   .   c   parsed_2adz   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   156   .   c   .   157   .   n    .   157   .   ca   .   157   .   c   parsed_2adz   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   163   .   n   .   163   .   ca   .   163   .   c    .   164   .   n   parsed_2adz   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   164   .   n   .   164   .   ca   .   164   .   c    .   165   .   n   parsed_2adz   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   165   .   n   .   165   .   ca   .   165   .   c    .   166   .   n   parsed_2adz   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   166   .   n   .   166   .   ca   .   166   .   c    .   167   .   n   parsed_2adz   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   167   .   n   .   167   .   ca   .   167   .   c    .   168   .   n   parsed_2adz   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   168   .   n   .   168   .   ca   .   168   .   c    .   169   .   n   parsed_2adz   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   169   .   n   .   169   .   ca   .   169   .   c    .   170   .   n   parsed_2adz   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   170   .   n   .   170   .   ca   .   170   .   c    .   171   .   n   parsed_2adz   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   171   .   n   .   171   .   ca   .   171   .   c    .   172   .   n   parsed_2adz   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   172   .   n   .   172   .   ca   .   172   .   c    .   173   .   n   parsed_2adz   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   173   .   n   .   173   .   ca   .   173   .   c    .   174   .   n   parsed_2adz   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.0   -10.0   .   .   174   .   n   .   174   .   ca   .   174   .   c    .   175   .   n   parsed_2adz   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .     8   .   n   .     8   .   ca   .     8   .   c    .     9   .   n   parsed_2adz   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .     9   .   n   .     9   .   ca   .     9   .   c    .    10   .   n   parsed_2adz   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    12   .   n   .    12   .   ca   .    12   .   c    .    13   .   n   parsed_2adz   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    13   .   n   .    13   .   ca   .    13   .   c    .    14   .   n   parsed_2adz   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    14   .   n   .    14   .   ca   .    14   .   c    .    15   .   n   parsed_2adz   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    29   .   n   .    29   .   ca   .    29   .   c    .    30   .   n   parsed_2adz   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    30   .   n   .    30   .   ca   .    30   .   c    .    31   .   n   parsed_2adz   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    31   .   n   .    31   .   ca   .    31   .   c    .    32   .   n   parsed_2adz   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    32   .   n   .    32   .   ca   .    32   .   c    .    33   .   n   parsed_2adz   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    33   .   n   .    33   .   ca   .    33   .   c    .    34   .   n   parsed_2adz   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    39   .   n   .    39   .   ca   .    39   .   c    .    40   .   n   parsed_2adz   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    40   .   n   .    40   .   ca   .    40   .   c    .    41   .   n   parsed_2adz   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .    41   .   n   .    41   .   ca   .    41   .   c    .    42   .   n   parsed_2adz   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   121   .   n   .   121   .   ca   .   121   .   c    .   122   .   n   parsed_2adz   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   122   .   n   .   122   .   ca   .   122   .   c    .   123   .   n   parsed_2adz   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   123   .   n   .   123   .   ca   .   123   .   c    .   124   .   n   parsed_2adz   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   129   .   n   .   129   .   ca   .   129   .   c    .   130   .   n   parsed_2adz   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   130   .   n   .   130   .   ca   .   130   .   c    .   131   .   n   parsed_2adz   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   131   .   n   .   131   .   ca   .   131   .   c    .   132   .   n   parsed_2adz   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   132   .   n   .   132   .   ca   .   132   .   c    .   133   .   n   parsed_2adz   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   144   .   n   .   144   .   ca   .   144   .   c    .   145   .   n   parsed_2adz   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   145   .   n   .   145   .   ca   .   145   .   c    .   146   .   n   parsed_2adz   1   
        79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   146   .   n   .   146   .   ca   .   146   .   c    .   147   .   n   parsed_2adz   1   
        80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   147   .   n   .   147   .   ca   .   147   .   c    .   148   .   n   parsed_2adz   1   
        81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   153   .   n   .   153   .   ca   .   153   .   c    .   154   .   n   parsed_2adz   1   
        82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   154   .   n   .   154   .   ca   .   154   .   c    .   155   .   n   parsed_2adz   1   
        83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   155   .   n   .   155   .   ca   .   155   .   c    .   156   .   n   parsed_2adz   1   
        84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.0   170.0   .   .   156   .   n   .   156   .   ca   .   156   .   c    .   157   .   n   parsed_2adz   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   
;
restraints dihedral reset

phi.tbl


helix a
162-163 : helix
;
     2   1     9   18   parsed_2adz   1   
         2   "163-164 : helix"      12   1    12   18   parsed_2adz   1   
         3   "164-165 : helix"      15   1    15   18   parsed_2adz   1   
         4   "165-166 : helix"      18   1    18   18   parsed_2adz   1   
         5   "166-167 : helix"      21   1    21   18   parsed_2adz   1   
         6   "167-168 : helix"      24   1    24   18   parsed_2adz   1   
         7   "168-169 : helix"      27   1    27   18   parsed_2adz   1   
         8   "169-170 : helix"      30   1    30   18   parsed_2adz   1   
         9   "170-171 : helix"      33   1    33   18   parsed_2adz   1   
        10   "171-172 : helix"      36   1    36   18   parsed_2adz   1   
        11   "172-173 : helix"      39   1    39   18   parsed_2adz   1   
        12   "173-174 : helix"      42   1    42   18   parsed_2adz   1   
        13   "174-175 : helix"      45   1    45   18   parsed_2adz   1   
        14   
;
strand 1
7-8 : strand
assign (resid  7 and name c  ) (resid  8 and name n  )
(resid  8 and name ca ) (resid  8 and name c  ) 1 -120.0 50.0 2
8-9 : strand
;
    50   1    54   15   parsed_2adz   1   
        15   
;
9-10 : strand
assign (resid  9 and name c  ) (resid  10 and name n  )
(resid  10 and name ca ) (resid  10 and name c  ) 1 -120.0 50.0 2
10-11 : strand
assign (resid  10 and name c  ) (resid 11 and name n  )
(resid  11 and name ca ) (resid  11 and name c  ) 1 -120.0 50.0 2
11-12 : strand
assign (resid  11 and name c  ) (resid  12 and name n  )
(resid  12 and name ca ) (resid  12 and name c  ) 1 -120.0 50.0 2
12-13 : strand
;
    57   1    66   17   parsed_2adz   1   
        16   "13-14 : strand"       69   1    69   17   parsed_2adz   1   
        17   "14-15 : strand"       72   1    72   17   parsed_2adz   1   
        18   
;
15-16 : strand
assign (resid  15 and name c  ) (resid  16 and name n  )
(resid  16 and name ca ) (resid  16 and name c  ) 1 -120.0 50.0 2
strand 2
26-27 : strand
assign (resid  26 and name c  ) (resid  27 and name n  )
(resid  27 and name ca ) (resid  27 and name c  ) 1 -120.0 50.0 2
27-28 : strand
assign (resid  27 and name c  ) (resid  28 and name n  )
(resid  28 and name ca ) (resid  28 and name c  ) 1 -120.0 50.0 2
28-29 : strand
assign (resid  28 and name c  ) (resid  29 and name n  )
(resid  29 and name ca ) (resid  29 and name c  ) 1 -120.0 50.0 2
29-30 : strand
;
    75   1    93   17   parsed_2adz   1   
        19   "30-31 : strand"       96   1    96   17   parsed_2adz   1   
        20   "31-32 : strand"       99   1    99   17   parsed_2adz   1   
        21   "32-33 : strand"      102   1   102   17   parsed_2adz   1   
        22   "33-34 : strand"      105   1   105   17   parsed_2adz   1   
        23   
;
34-35 : strand
assign (resid  34 and name c  ) (resid  35 and name n  )
(resid  35 and name ca ) (resid  35 and name c  ) 1 -120.0 50.0 2
strand 3
38-39 : strand
;
   108   1   113   17   parsed_2adz   1   
        24   "39-40 : strand"      116   1   116   17   parsed_2adz   1   
        25   "40-41 : strand"      119   1   119   17   parsed_2adz   1   
        26   "41-42 : strand"      122   1   122   17   parsed_2adz   1   
        27   
;
42-43 : strand
assign (resid  42 and name c  ) (resid 43 and name n  )
(resid  43 and name ca ) (resid  43 and name c  ) 1 -120.0 50.0 2
strand 4
120-121 : strand
;
   125   1   130   19   parsed_2adz   1   
        28   "121-122 : strand"    133   1   133   19   parsed_2adz   1   
        29   "122-123 : strand"    136   1   136   19   parsed_2adz   1   
        30   
;
strand 5
128-129 : strand
;
   140   1   141   19   parsed_2adz   1   
        31   "129-130 : str"       144   1   144   16   parsed_2adz   1   
        32   "130-131 : str"       147   1   147   16   parsed_2adz   1   
        33   "131-132 : str"       150   1   150   16   parsed_2adz   1   
        34   "132-133 : str"       153   1   153   16   parsed_2adz   1   
        35   
;
133-134 : std
assign (resid 133  and name c  ) (resid 134  and name n  )
(resid 134  and name ca ) (resid 134  and name c  ) 1 -120.0 50.0 2
strand 6
143-144 : strand
;
   156   2   161   19   parsed_2adz   1   
        36   "144-145 : strand"    164   1   164   19   parsed_2adz   1   
        37   "145-146 : strand"    167   1   167   19   parsed_2adz   1   
        38   "146-147 : strand"    170   1   170   19   parsed_2adz   1   
        39   "147-148 : strand"    173   1   173   19   parsed_2adz   1   
        40   
;
strand 7
151-152 : strand
assign (resid 151  and name c  ) (resid 152  and name n  )
(resid 152  and name ca ) (resid 152  and name c  ) 1 -120.0 50.0 2
152-153 : strand
;
   177   1   181   19   parsed_2adz   1   
        41   "153-154 : strand"    184   1   184   19   parsed_2adz   1   
        42   "154-155 : strand"    187   1   187   19   parsed_2adz   1   
        43   "155-156 : strand"    190   1   190   19   parsed_2adz   1   
        44   "156-157 : strand"    193   1   193   19   parsed_2adz   1   
        45   
;
psi.tbl

helix

163-164 : helix
;
   197   1   202   18   parsed_2adz   1   
        46   "164-165 : helix"     205   1   205   18   parsed_2adz   1   
        47   "165-166 : helix"     208   1   208   18   parsed_2adz   1   
        48   "166-167: helix"      211   1   211   17   parsed_2adz   1   
        49   "167-168 : helix"     214   1   214   18   parsed_2adz   1   
        50   "168-169 : helix"     217   1   217   18   parsed_2adz   1   
        51   "169-170 : helix"     220   1   220   18   parsed_2adz   1   
        52   "170-171 : helix"     223   1   223   18   parsed_2adz   1   
        53   "171-172 : helix"     226   1   226   18   parsed_2adz   1   
        54   "172-173 : helix"     229   1   229   18   parsed_2adz   1   
        55   "173-174 : helix"     232   1   232   18   parsed_2adz   1   
        56   "174-175 : helix"     235   1   235   18   parsed_2adz   1   
        57   
;
strand 1
8-9 : strand
;
   239   1   240   15   parsed_2adz   1   
        58   "9-10 : strand"       243   1   243   16   parsed_2adz   1   
        59   
;
10-11 : strand
assign (resid  10 and name n ) (resid  10 and name ca )
(resid  10 and name c ) (resid  11 and name n  ) 1 120.0   50.0  2
11-12 : strand
assign (resid  11 and name n ) (resid  11 and name ca )
(resid  11 and name c ) (resid  12 and name n  ) 1 120.0   50.0  2
12-13 : strand
;
   246   1   252   17   parsed_2adz   1   
        60   "13-14 : strand"      255   1   255   17   parsed_2adz   1   
        61   "14-15 : strand"      258   1   258   17   parsed_2adz   1   
        62   
;
15-16 : strand
assign (resid  15 and name n ) (resid  15 and name ca )
(resid  15 and name c ) (resid  16 and name n  ) 1 120.0   50.0  2
16-17 : strand
assign (resid  16 and name n ) (resid  16 and name ca )
(resid  16 and name c ) (resid  17 and name n  ) 1 120.0   50.0  2
strand 2
27-28 : strand
assign (resid  27 and name n ) (resid  27 and name ca )
(resid  27 and name c ) (resid  28 and name n  ) 1 120.0   50.0  2
28-29 : strand
assign (resid  28 and name n ) (resid  28 and name ca )
(resid  28 and name c ) (resid  29 and name n  ) 1 120.0   50.0  2
29-30 : strand
;
   261   1   276   17   parsed_2adz   1   
        63   "30-31 : strand"      279   1   279   17   parsed_2adz   1   
        64   "31-32 : strand"      282   1   282   17   parsed_2adz   1   
        65   "32-33 : strand"      285   1   285   17   parsed_2adz   1   
        66   "33-34 : strand"      288   1   288   17   parsed_2adz   1   
        67   
;
34-35 : strand
assign (resid  34 and name n ) (resid  34 and name ca )
(resid  34 and name c ) (resid  35 and name n  ) 1 120.0   50.0  2
strand 3
38-39 : strand
assign (resid  38 and name n ) (resid  38 and name ca )
(resid  38 and name c ) (resid  39 and name n  ) 1 120.0   50.0  2
39-40 : strand
;
   291   2   299   17   parsed_2adz   1   
        68   "40-41 : strand"      302   1   302   17   parsed_2adz   1   
        69   "41-42 : strand"      305   1   305   17   parsed_2adz   1   
        70   
;
42-43 : strand
assign (resid  42 and name n ) (resid  42 and name ca )
(resid  42 and name c ) (resid  43 and name n  ) 1 120.0   50.0  2
strand 4
121-122 : strand
;
   308   1   313   19   parsed_2adz   1   
        71   "122-123 : strand"    316   1   316   19   parsed_2adz   1   
        72   "123-124 : strand"    319   1   319   19   parsed_2adz   1   
        73   
;
strand 5
129-130 : strand
;
   323   1   324   19   parsed_2adz   1   
        74   "130-131 : strand"    327   1   327   19   parsed_2adz   1   
        75   "131-132 : strand"    330   1   330   19   parsed_2adz   1   
        76   "132-133 : strand"    333   1   333   19   parsed_2adz   1   
        77   
;
strand 6
143-144 : strand
assign (resid 143  and name n ) (resid 143  and name ca )
(resid 143  and name c ) (resid 144  and name n  ) 1 120.0   50.0  2
144-145 : strand
;
   337   1   341   19   parsed_2adz   1   
        78   "145-146 : strand"    344   1   344   19   parsed_2adz   1   
        79   "146-147 : strand"    347   1   347   19   parsed_2adz   1   
        80   "147-148 : strand"    350   1   350   19   parsed_2adz   1   
        81   
;
233-234 : strand
assign (resid  233 and name n ) (resid  233 and name ca )
(resid  233 and name c ) (resid  234 and name n  ) 1 120.0   50.0  2
strand 7
153-154 : strand
;
   353   1   358   19   parsed_2adz   1   
        82   "154-155 : strand"    361   1   361   19   parsed_2adz   1   
        83   "155-156 : strand"    364   1   364   19   parsed_2adz   1   
        84   "156-157 : strand"    367   1   367   19   parsed_2adz   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   "'"    213   83   213   83   parsed_2adz   1   
    stop_

save_





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