NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type item_count
29060 1ah1 cing 2-parsed STAR dihedral angle 63


data_1ah1_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1ah1 
    _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_1ah1   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1ah1 
    _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   1ah1   "Master copy"    parsed_1ah1   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1ah1 
    _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   1ah1.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_1ah1   1   
        1   1ah1.mr   .   .    XPLOR/CNS     2   "dihedral angle"          "Not applicable"    "Not applicable"    63   parsed_1ah1   1   
        1   1ah1.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple              0   parsed_1ah1   1   
        1   1ah1.mr   .   .    XPLOR/CNS     4    distance                  NOE                 simple              0   parsed_1ah1   1   
        1   1ah1.mr   .   .    XPLOR/CNS     5    distance                 "disulfide bond"     simple              0   parsed_1ah1   1   
        1   1ah1.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_1ah1   1   
    stop_

save_


save_CNS/XPLOR_dihedral_2
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_1ah1 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            2 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .     2   .   c   .     3   .   n    .     3   .   ca   .     3   .   c     parsed_1ah1   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .     8   .   c   .     9   .   n    .     9   .   ca   .     9   .   c     parsed_1ah1   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .     9   .   c   .    10   .   n    .    10   .   ca   .    10   .   c     parsed_1ah1   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    15   .   c   .    16   .   n    .    16   .   ca   .    16   .   c     parsed_1ah1   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    16   .   c   .    17   .   n    .    17   .   ca   .    17   .   c     parsed_1ah1   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    17   .   c   .    18   .   n    .    18   .   ca   .    18   .   c     parsed_1ah1   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    20   .   c   .    21   .   n    .    21   .   ca   .    21   .   c     parsed_1ah1   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    21   .   c   .    22   .   n    .    22   .   ca   .    22   .   c     parsed_1ah1   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    22   .   c   .    23   .   n    .    23   .   ca   .    23   .   c     parsed_1ah1   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    29   .   c   .    30   .   n    .    30   .   ca   .    30   .   c     parsed_1ah1   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    30   .   c   .    31   .   n    .    31   .   ca   .    31   .   c     parsed_1ah1   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    31   .   c   .    32   .   n    .    32   .   ca   .    32   .   c     parsed_1ah1   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    33   .   c   .    34   .   n    .    34   .   ca   .    34   .   c     parsed_1ah1   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    34   .   c   .    35   .   n    .    35   .   ca   .    35   .   c     parsed_1ah1   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    36   .   c   .    37   .   n    .    37   .   ca   .    37   .   c     parsed_1ah1   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    38   .   c   .    39   .   n    .    39   .   ca   .    39   .   c     parsed_1ah1   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    43   .   c   .    44   .   n    .    44   .   ca   .    44   .   c     parsed_1ah1   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    44   .   c   .    45   .   n    .    45   .   ca   .    45   .   c     parsed_1ah1   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    45   .   c   .    46   .   n    .    46   .   ca   .    46   .   c     parsed_1ah1   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    46   .   c   .    47   .   n    .    47   .   ca   .    47   .   c     parsed_1ah1   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    50   .   c   .    51   .   n    .    51   .   ca   .    51   .   c     parsed_1ah1   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    55   .   c   .    56   .   n    .    56   .   ca   .    56   .   c     parsed_1ah1   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    58   .   c   .    59   .   n    .    59   .   ca   .    59   .   c     parsed_1ah1   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    68   .   c   .    69   .   n    .    69   .   ca   .    69   .   c     parsed_1ah1   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    75   .   c   .    76   .   n    .    76   .   ca   .    76   .   c     parsed_1ah1   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    76   .   c   .    77   .   n    .    77   .   ca   .    77   .   c     parsed_1ah1   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    77   .   c   .    78   .   n    .    78   .   ca   .    78   .   c     parsed_1ah1   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    78   .   c   .    79   .   n    .    79   .   ca   .    79   .   c     parsed_1ah1   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    79   .   c   .    80   .   n    .    80   .   ca   .    80   .   c     parsed_1ah1   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    80   .   c   .    81   .   n    .    81   .   ca   .    81   .   c     parsed_1ah1   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .    83   .   c   .    84   .   n    .    84   .   ca   .    84   .   c     parsed_1ah1   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .    85   .   c   .    86   .   n    .    86   .   ca   .    86   .   c     parsed_1ah1   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .    86   .   c   .    87   .   n    .    87   .   ca   .    87   .   c     parsed_1ah1   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .    87   .   c   .    88   .   n    .    88   .   ca   .    88   .   c     parsed_1ah1   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    93   .   c   .    94   .   n    .    94   .   ca   .    94   .   c     parsed_1ah1   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    95   .   c   .    96   .   n    .    96   .   ca   .    96   .   c     parsed_1ah1   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    98   .   c   .    99   .   n    .    99   .   ca   .    99   .   c     parsed_1ah1   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   105   .   c   .   106   .   n    .   106   .   ca   .   106   .   c     parsed_1ah1   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   108   .   c   .   109   .   n    .   109   .   ca   .   109   .   c     parsed_1ah1   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   114   .   c   .   115   .   n    .   115   .   ca   .   115   .   c     parsed_1ah1   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   115   .   c   .   116   .   n    .   116   .   ca   .   116   .   c     parsed_1ah1   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0    90.0   .   .    30   .   n   .    30   .   ca   .    30   .   cb   .    30   .   og1   parsed_1ah1   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    35   .   n   .    35   .   ca   .    35   .   cb   .    35   .   og1   parsed_1ah1   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0    90.0   .   .    45   .   n   .    45   .   ca   .    45   .   cb   .    45   .   og1   parsed_1ah1   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    51   .   n   .    51   .   ca   .    51   .   cb   .    51   .   og1   parsed_1ah1   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0    90.0   .   .    59   .   n   .    59   .   ca   .    59   .   cb   .    59   .   og1   parsed_1ah1   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .    69   .   n   .    69   .   ca   .    69   .   cb   .    69   .   og1   parsed_1ah1   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    71   .   n   .    71   .   ca   .    71   .   cb   .    71   .   og1   parsed_1ah1   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    80   .   n   .    80   .   ca   .    80   .   cb   .    80   .   og1   parsed_1ah1   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   113   .   n   .   113   .   ca   .   113   .   cb   .   113   .   og1   parsed_1ah1   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    16   .   n   .    16   .   ca   .    16   .   cb   .    16   .   cg1   parsed_1ah1   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    67   .   n   .    67   .   ca   .    67   .   cb   .    67   .   cg1   parsed_1ah1   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    81   .   n   .    81   .   ca   .    81   .   cb   .    81   .   cg1   parsed_1ah1   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    93   .   n   .    93   .   ca   .    93   .   cb   .    93   .   cg1   parsed_1ah1   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   109   .   n   .   109   .   ca   .   109   .   cb   .   109   .   cg1   parsed_1ah1   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   115   .   n   .   115   .   ca   .   115   .   cb   .   115   .   cg1   parsed_1ah1   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .     3   .   n   .     3   .   ca   .     3   .   cb   .     3   .   cg1   parsed_1ah1   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0    90.0   .   .     8   .   n   .     8   .   ca   .     8   .   cb   .     8   .   cg1   parsed_1ah1   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .     9   .   n   .     9   .   ca   .     9   .   cb   .     9   .   cg1   parsed_1ah1   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .    20   .   n   .    20   .   ca   .    20   .   cb   .    20   .   cg1   parsed_1ah1   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .    44   .   n   .    44   .   ca   .    44   .   cb   .    44   .   cg1   parsed_1ah1   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .    47   .   n   .    47   .   ca   .    47   .   cb   .    47   .   cg1   parsed_1ah1   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    77   .   n   .    77   .   ca   .    77   .   cb   .    77   .   cg1   parsed_1ah1   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   "angle restraints for phi"                                 2    1     3    2   parsed_1ah1   1   
         2                             8.3     5   77     5   82   parsed_1ah1   1   
         3                             8.0     7   77     7   82   parsed_1ah1   1   
         4                             8.0     9   77     9   82   parsed_1ah1   1   
         5                             8.1    11   77    11   82   parsed_1ah1   1   
         6                             8.3    13   77    13   82   parsed_1ah1   1   
         7                             8.0    15   77    15   82   parsed_1ah1   1   
         8                             8.6    17   77    17   82   parsed_1ah1   1   
         9                             8.6    19   77    19   82   parsed_1ah1   1   
        10                             8.0    21   77    21   82   parsed_1ah1   1   
        11                             8.9    23   77    23   82   parsed_1ah1   1   
        12                             8.2    25   77    25   82   parsed_1ah1   1   
        13                             8.8    27   77    27   82   parsed_1ah1   1   
        14                             9.4    29   77    29   82   parsed_1ah1   1   
        15                             8.2    31   77    31   82   parsed_1ah1   1   
        16                             9.6    33   77    33   82   parsed_1ah1   1   
        17                             8.8    35   77    35   82   parsed_1ah1   1   
        18                             8.8    37   77    37   82   parsed_1ah1   1   
        19                             8.0    39   77    39   82   parsed_1ah1   1   
        20                             8.2    41   77    41   82   parsed_1ah1   1   
        21                             8.6    43   77    43   82   parsed_1ah1   1   
        22                             9.5    45   77    45   82   parsed_1ah1   1   
        23                             8.2    47   77    47   82   parsed_1ah1   1   
        24                             8.1    49   77    49   82   parsed_1ah1   1   
        25                             9.7    51   77    51   82   parsed_1ah1   1   
        26                             8.0    53   77    53   82   parsed_1ah1   1   
        27                             8.5    55   77    55   82   parsed_1ah1   1   
        28                             8.0    57   77    57   82   parsed_1ah1   1   
        29                             8.0    59   77    59   82   parsed_1ah1   1   
        30                             8.9    61   77    61   82   parsed_1ah1   1   
        31                             8.5    63   77    63   82   parsed_1ah1   1   
        32    <5.0                            65   77    65   83   parsed_1ah1   1   
        33    <5.0                            67   77    67   83   parsed_1ah1   1   
        34    <5.0                            69   77    69   83   parsed_1ah1   1   
        35                             5.6    71   77    71   83   parsed_1ah1   1   
        36                             8.5    73   77    73   82   parsed_1ah1   1   
        37                             8.1    75   77    75   82   parsed_1ah1   1   
        38                             8.8    77   77    77   82   parsed_1ah1   1   
        39                             8.0    79   77    79   82   parsed_1ah1   1   
        40                             8.1    81   77    81   82   parsed_1ah1   1   
        41                             8.2    83   77    83   82   parsed_1ah1   1   
        42   
;
8.0

chi 1 restraints for VAL, ILE and THR derived from CO-CH3 and N-CH3 J-values and noes

THR
;
                               85   77    89    6   parsed_1ah1   1   
        43    ILE                            107   78   108    6   parsed_1ah1   1   
        44    VAL                            120   78   121    6   parsed_1ah1   1   
    stop_

save_





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