data_2l4n_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2l4n 
    _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_2l4n   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2l4n 
    _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   2l4n   "Master copy"    parsed_2l4n   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2l4n 
    _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   2l4n.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"     0   parsed_2l4n   1   
        1   2l4n.mr   .   .    DYANA/DIANA   2   "dihedral angle"          "Not applicable"      "Not applicable"    90   parsed_2l4n   1   
        1   2l4n.mr   .   .    DYANA/DIANA   3    distance                  NOE                   simple             25   parsed_2l4n   1   
        1   2l4n.mr   .   .    DYANA/DIANA   4    distance                 "disulfide bond"       simple              0   parsed_2l4n   1   
        1   2l4n.mr   .   .    DYANA/DIANA   5    distance                 "general distance"     simple              0   parsed_2l4n   1   
        1   2l4n.mr   .   .    DYANA/DIANA   6    distance                 "disulfide bond"       simple              0   parsed_2l4n   1   
        1   2l4n.mr   .   .    DYANA/DIANA   7    distance                  NOE                   simple              0   parsed_2l4n   1   
        1   2l4n.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"      "Not applicable"     0   parsed_2l4n   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2l4n 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            3 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

         1   1   .   .   .   parsed_2l4n   1   
         2   1   .   .   .   parsed_2l4n   1   
         3   1   .   .   .   parsed_2l4n   1   
         4   1   .   .   .   parsed_2l4n   1   
         5   1   .   .   .   parsed_2l4n   1   
         6   1   .   .   .   parsed_2l4n   1   
         7   1   .   .   .   parsed_2l4n   1   
         8   1   .   .   .   parsed_2l4n   1   
         9   1   .   .   .   parsed_2l4n   1   
        10   1   .   .   .   parsed_2l4n   1   
        11   1   .   .   .   parsed_2l4n   1   
        12   1   .   .   .   parsed_2l4n   1   
        13   1   .   .   .   parsed_2l4n   1   
        14   1   .   .   .   parsed_2l4n   1   
        15   1   .   .   .   parsed_2l4n   1   
        16   1   .   .   .   parsed_2l4n   1   
        17   1   .   .   .   parsed_2l4n   1   
        18   1   .   .   .   parsed_2l4n   1   
        19   1   .   .   .   parsed_2l4n   1   
        20   1   .   .   .   parsed_2l4n   1   
        21   1   .   .   .   parsed_2l4n   1   
        22   1   .   .   .   parsed_2l4n   1   
        23   1   .   .   .   parsed_2l4n   1   
        24   1   .   .   .   parsed_2l4n   1   
        25   1   .   .   .   parsed_2l4n   1   
    stop_


    loop_
        _Dist_constraint.Tree_node_member_constraint_ID 
        _Dist_constraint.Tree_node_member_node_ID 
        _Dist_constraint.Constraint_tree_node_member_ID 
        _Dist_constraint.Assembly_atom_ID 
        _Dist_constraint.Entity_assembly_ID 
        _Dist_constraint.Entity_ID 
        _Dist_constraint.Comp_index_ID 
        _Dist_constraint.Seq_ID 
        _Dist_constraint.Comp_ID 
        _Dist_constraint.Atom_ID 
        _Dist_constraint.Resonance_ID 
        _Dist_constraint.Auth_asym_ID 
        _Dist_constraint.Auth_seq_ID 
        _Dist_constraint.Auth_comp_ID 
        _Dist_constraint.Auth_atom_ID 
        _Dist_constraint.Entry_ID 
        _Dist_constraint.Distance_constraint_list_ID 

         1   1   1   .   .   .   .   .   .   .   .   .    2   ASP    HA    parsed_2l4n   1   
         1   1   2   .   .   .   .   .   .   .   .   .    2   ASP    QB    parsed_2l4n   1   
         2   1   1   .   .   .   .   .   .   .   .   .    3   GLY    QA    parsed_2l4n   1   
         2   1   2   .   .   .   .   .   .   .   .   .    4   GLY    H     parsed_2l4n   1   
         3   1   1   .   .   .   .   .   .   .   .   .    5   ALA    H     parsed_2l4n   1   
         3   1   2   .   .   .   .   .   .   .   .   .    5   ALA    QB    parsed_2l4n   1   
         4   1   1   .   .   .   .   .   .   .   .   .    5   ALA    HA    parsed_2l4n   1   
         4   1   2   .   .   .   .   .   .   .   .   .    6   GLN    H     parsed_2l4n   1   
         5   1   1   .   .   .   .   .   .   .   .   .    5   ALA    QB    parsed_2l4n   1   
         5   1   2   .   .   .   .   .   .   .   .   .    6   GLN    H     parsed_2l4n   1   
         6   1   1   .   .   .   .   .   .   .   .   .    6   GLN    H     parsed_2l4n   1   
         6   1   2   .   .   .   .   .   .   .   .   .    6   GLN    QB    parsed_2l4n   1   
         7   1   1   .   .   .   .   .   .   .   .   .    6   GLN    H     parsed_2l4n   1   
         7   1   2   .   .   .   .   .   .   .   .   .    6   GLN    QG    parsed_2l4n   1   
         8   1   1   .   .   .   .   .   .   .   .   .    6   GLN    HA    parsed_2l4n   1   
         8   1   2   .   .   .   .   .   .   .   .   .    6   GLN    QG    parsed_2l4n   1   
         9   1   1   .   .   .   .   .   .   .   .   .    6   GLN    QB    parsed_2l4n   1   
         9   1   2   .   .   .   .   .   .   .   .   .    6   GLN    QG    parsed_2l4n   1   
        10   1   1   .   .   .   .   .   .   .   .   .    6   GLN    QB    parsed_2l4n   1   
        10   1   2   .   .   .   .   .   .   .   .   .    7   ASP    H     parsed_2l4n   1   
        11   1   1   .   .   .   .   .   .   .   .   .    7   ASP    H     parsed_2l4n   1   
        11   1   2   .   .   .   .   .   .   .   .   .    7   ASP    HB2   parsed_2l4n   1   
        12   1   1   .   .   .   .   .   .   .   .   .    7   ASP    H     parsed_2l4n   1   
        12   1   2   .   .   .   .   .   .   .   .   .    7   ASP    HB3   parsed_2l4n   1   
        13   1   1   .   .   .   .   .   .   .   .   .    7   ASP    H     parsed_2l4n   1   
        13   1   2   .   .   .   .   .   .   .   .   .    7   ASP    QB    parsed_2l4n   1   
        14   1   1   .   .   .   .   .   .   .   .   .    7   ASP    HA    parsed_2l4n   1   
        14   1   2   .   .   .   .   .   .   .   .   .    8   CYSS   H     parsed_2l4n   1   
        15   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   CB    parsed_2l4n   1   
        15   1   2   .   .   .   .   .   .   .   .   .   34   CYSS   CB    parsed_2l4n   1   
        16   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   CB    parsed_2l4n   1   
        16   1   2   .   .   .   .   .   .   .   .   .   34   CYSS   SG    parsed_2l4n   1   
        17   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   CB    parsed_2l4n   1   
        17   1   2   .   .   .   .   .   .   .   .   .   34   CYSS   SG    parsed_2l4n   1   
        18   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   H     parsed_2l4n   1   
        18   1   2   .   .   .   .   .   .   .   .   .    8   CYSS   QB    parsed_2l4n   1   
        19   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   HA    parsed_2l4n   1   
        19   1   2   .   .   .   .   .   .   .   .   .    9   CYSS   H     parsed_2l4n   1   
        20   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   HB2   parsed_2l4n   1   
        20   1   2   .   .   .   .   .   .   .   .   .    9   CYSS   H     parsed_2l4n   1   
        21   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   HB3   parsed_2l4n   1   
        21   1   2   .   .   .   .   .   .   .   .   .    9   CYSS   H     parsed_2l4n   1   
        22   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   QB    parsed_2l4n   1   
        22   1   2   .   .   .   .   .   .   .   .   .   38   ALA    QB    parsed_2l4n   1   
        23   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   QB    parsed_2l4n   1   
        23   1   2   .   .   .   .   .   .   .   .   .    9   CYSS   H     parsed_2l4n   1   
        24   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   SG    parsed_2l4n   1   
        24   1   2   .   .   .   .   .   .   .   .   .   34   CYSS   CB    parsed_2l4n   1   
        25   1   1   .   .   .   .   .   .   .   .   .    8   CYSS   SG    parsed_2l4n   1   
        25   1   2   .   .   .   .   .   .   .   .   .   34   CYSS   CB    parsed_2l4n   1   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

         1   1   .   .   .   .   .   .   .   2.63   parsed_2l4n   1   
         2   1   .   .   .   .   .   .   .   3.16   parsed_2l4n   1   
         3   1   .   .   .   .   .   .   .   3.52   parsed_2l4n   1   
         4   1   .   .   .   .   .   .   .   2.84   parsed_2l4n   1   
         5   1   .   .   .   .   .   .   .   3.76   parsed_2l4n   1   
         6   1   .   .   .   .   .   .   .   3.64   parsed_2l4n   1   
         7   1   .   .   .   .   .   .   .   3.66   parsed_2l4n   1   
         8   1   .   .   .   .   .   .   .   3.87   parsed_2l4n   1   
         9   1   .   .   .   .   .   .   .   2.40   parsed_2l4n   1   
        10   1   .   .   .   .   .   .   .   4.21   parsed_2l4n   1   
        11   1   .   .   .   .   .   .   .   4.16   parsed_2l4n   1   
        12   1   .   .   .   .   .   .   .   4.16   parsed_2l4n   1   
        13   1   .   .   .   .   .   .   .   3.29   parsed_2l4n   1   
        14   1   .   .   .   .   .   .   .   3.22   parsed_2l4n   1   
        15   1   .   .   .   .   .   .   .   3.99   parsed_2l4n   1   
        16   1   .   .   .   .   .   .   .   3.10   parsed_2l4n   1   
        17   1   .   .   .   .   .   .   .   3.10   parsed_2l4n   1   
        18   1   .   .   .   .   .   .   .   3.31   parsed_2l4n   1   
        19   1   .   .   .   .   .   .   .   3.05   parsed_2l4n   1   
        20   1   .   .   .   .   .   .   .   3.96   parsed_2l4n   1   
        21   1   .   .   .   .   .   .   .   3.96   parsed_2l4n   1   
        22   1   .   .   .   .   .   .   .   3.68   parsed_2l4n   1   
        23   1   .   .   .   .   .   .   .   3.09   parsed_2l4n   1   
        24   1   .   .   .   .   .   .   .   3.10   parsed_2l4n   1   
        25   1   .   .   .   .   .   .   .   3.10   parsed_2l4n   1   
    stop_


    loop_
        _Dist_constraint_comment_org.ID 
        _Dist_constraint_comment_org.Comment_text 
        _Dist_constraint_comment_org.Comment_begin_line 
        _Dist_constraint_comment_org.Comment_begin_column 
        _Dist_constraint_comment_org.Comment_end_line 
        _Dist_constraint_comment_org.Comment_end_column 
        _Dist_constraint_comment_org.Entry_ID 
        _Dist_constraint_comment_org.Distance_constraint_list_ID 

         1   "Distance Constraints"     1    1    1   21   parsed_2l4n   1   
         2   "peak 3"                   2   49    2   55   parsed_2l4n   1   
         3   "peak 2759"                3   49    3   58   parsed_2l4n   1   
         4   "peak 2678"                4   49    4   58   parsed_2l4n   1   
         5   "peak 2040"                5   49    5   58   parsed_2l4n   1   
         6   "peak 2042"                6   49    6   58   parsed_2l4n   1   
         7   "peak 2661"                7   49    7   58   parsed_2l4n   1   
         8   "peak 2686"                8   49    8   58   parsed_2l4n   1   
         9   "peak 1038"                9   49    9   58   parsed_2l4n   1   
        10   "peak 23"                 10   49   10   56   parsed_2l4n   1   
        11   "peak 1040"               11   49   11   58   parsed_2l4n   1   
        12   "peak 1021"               12   49   12   58   parsed_2l4n   1   
        13   "peak 2047"               13   49   13   58   parsed_2l4n   1   
        14   "peak 1021"               14   49   14   58   parsed_2l4n   1   
        15   "peak 167"                15   49   15   57   parsed_2l4n   1   
        16   "peak 870"                19   49   19   57   parsed_2l4n   1   
        17   "peak 2048"               20   49   20   58   parsed_2l4n   1   
        18   "peak 2806"               21   49   21   58   parsed_2l4n   1   
        19   "peak 2805"               22   49   22   58   parsed_2l4n   1   
        20   "peak 2803"               23   49   23   58   parsed_2l4n   1   
        21   "peak 2805"               24   49   24   58   parsed_2l4n   1   
    stop_

save_



