NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype subsubtype item_count
31082 1dsq cing 2-parsed STAR distance NOE simple 75


data_1dsq_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1dsq 
    _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_1dsq   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1dsq 
    _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   1dsq   "Master copy"    parsed_1dsq   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1dsq 
    _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   1dsq.mr   .   .   "MR format"     1    comment                  "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
        1   1dsq.mr   .   .    n/a            2    comment                  "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
        1   1dsq.mr   .   .    DYANA/DIANA    3    distance                 "general distance"     simple              7   parsed_1dsq   1   
        1   1dsq.mr   .   .    n/a            4    comment                  "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
        1   1dsq.mr   .   .    DYANA/DIANA    5    distance                 "hydrogen bond"        simple             18   parsed_1dsq   1   
        1   1dsq.mr   .   .    n/a            6    comment                  "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
        1   1dsq.mr   .   .    DYANA/DIANA    7    distance                  NOE                   simple             18   parsed_1dsq   1   
        1   1dsq.mr   .   .    n/a            8    comment                  "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
        1   1dsq.mr   .   .    DYANA/DIANA    9    distance                  NOE                   simple             75   parsed_1dsq   1   
        1   1dsq.mr   .   .    n/a           10    comment                  "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
        1   1dsq.mr   .   .    DYANA/DIANA   11    distance                 "general distance"     simple              0   parsed_1dsq   1   
        1   1dsq.mr   .   .    DYANA/DIANA   12    distance                 "hydrogen bond"        simple              0   parsed_1dsq   1   
        1   1dsq.mr   .   .   "MR format"    13   "nomenclature mapping"    "Not applicable"      "Not applicable"     0   parsed_1dsq   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_9
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1dsq 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            9 
    _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_1dsq   1   
         2   1   .   .   .   parsed_1dsq   1   
         3   1   .   .   .   parsed_1dsq   1   
         4   1   .   .   .   parsed_1dsq   1   
         5   1   .   .   .   parsed_1dsq   1   
         6   1   .   .   .   parsed_1dsq   1   
         7   1   .   .   .   parsed_1dsq   1   
         8   1   .   .   .   parsed_1dsq   1   
         9   1   .   .   .   parsed_1dsq   1   
        10   1   .   .   .   parsed_1dsq   1   
        11   1   .   .   .   parsed_1dsq   1   
        12   1   .   .   .   parsed_1dsq   1   
        13   1   .   .   .   parsed_1dsq   1   
        14   1   .   .   .   parsed_1dsq   1   
        15   1   .   .   .   parsed_1dsq   1   
        16   1   .   .   .   parsed_1dsq   1   
        17   1   .   .   .   parsed_1dsq   1   
        18   1   .   .   .   parsed_1dsq   1   
        19   1   .   .   .   parsed_1dsq   1   
        20   1   .   .   .   parsed_1dsq   1   
        21   1   .   .   .   parsed_1dsq   1   
        22   1   .   .   .   parsed_1dsq   1   
        23   1   .   .   .   parsed_1dsq   1   
        24   1   .   .   .   parsed_1dsq   1   
        25   1   .   .   .   parsed_1dsq   1   
        26   1   .   .   .   parsed_1dsq   1   
        27   1   .   .   .   parsed_1dsq   1   
        28   1   .   .   .   parsed_1dsq   1   
        29   1   .   .   .   parsed_1dsq   1   
        30   1   .   .   .   parsed_1dsq   1   
        31   1   .   .   .   parsed_1dsq   1   
        32   1   .   .   .   parsed_1dsq   1   
        33   1   .   .   .   parsed_1dsq   1   
        34   1   .   .   .   parsed_1dsq   1   
        35   1   .   .   .   parsed_1dsq   1   
        36   1   .   .   .   parsed_1dsq   1   
        37   1   .   .   .   parsed_1dsq   1   
        38   1   .   .   .   parsed_1dsq   1   
        39   1   .   .   .   parsed_1dsq   1   
        40   1   .   .   .   parsed_1dsq   1   
        41   1   .   .   .   parsed_1dsq   1   
        42   1   .   .   .   parsed_1dsq   1   
        43   1   .   .   .   parsed_1dsq   1   
        44   1   .   .   .   parsed_1dsq   1   
        45   1   .   .   .   parsed_1dsq   1   
        46   1   .   .   .   parsed_1dsq   1   
        47   1   .   .   .   parsed_1dsq   1   
        48   1   .   .   .   parsed_1dsq   1   
        49   1   .   .   .   parsed_1dsq   1   
        50   1   .   .   .   parsed_1dsq   1   
        51   1   .   .   .   parsed_1dsq   1   
        52   1   .   .   .   parsed_1dsq   1   
        53   1   .   .   .   parsed_1dsq   1   
        54   1   .   .   .   parsed_1dsq   1   
        55   1   .   .   .   parsed_1dsq   1   
        56   1   .   .   .   parsed_1dsq   1   
        57   1   .   .   .   parsed_1dsq   1   
        58   1   .   .   .   parsed_1dsq   1   
        59   1   .   .   .   parsed_1dsq   1   
        60   1   .   .   .   parsed_1dsq   1   
        61   1   .   .   .   parsed_1dsq   1   
        62   1   .   .   .   parsed_1dsq   1   
        63   1   .   .   .   parsed_1dsq   1   
        64   1   .   .   .   parsed_1dsq   1   
        65   1   .   .   .   parsed_1dsq   1   
        66   1   .   .   .   parsed_1dsq   1   
        67   1   .   .   .   parsed_1dsq   1   
        68   1   .   .   .   parsed_1dsq   1   
        69   1   .   .   .   parsed_1dsq   1   
        70   1   .   .   .   parsed_1dsq   1   
        71   1   .   .   .   parsed_1dsq   1   
        72   1   .   .   .   parsed_1dsq   1   
        73   1   .   .   .   parsed_1dsq   1   
        74   1   .   .   .   parsed_1dsq   1   
        75   1   .   .   .   parsed_1dsq   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   .   .   .   .   .   .   .   .   .   29   PRO    HD3   parsed_1dsq   1   
         1   1   2   .   .   .   .   .   .   .   .   .   38   GLY    HN    parsed_1dsq   1   
         2   1   1   .   .   .   .   .   .   .   .   .   29   PRO    HD3   parsed_1dsq   1   
         2   1   2   .   .   .   .   .   .   .   .   .   39   HIS    HN    parsed_1dsq   1   
         3   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HN    parsed_1dsq   1   
         3   1   2   .   .   .   .   .   .   .   .   .   29   PRO    QB    parsed_1dsq   1   
         4   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HA    parsed_1dsq   1   
         4   1   2   .   .   .   .   .   .   .   .   .   30   VAL    QG1   parsed_1dsq   1   
         5   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HA    parsed_1dsq   1   
         5   1   2   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
         6   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HN    parsed_1dsq   1   
         6   1   2   .   .   .   .   .   .   .   .   .   30   VAL    QG1   parsed_1dsq   1   
         7   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HN    parsed_1dsq   1   
         7   1   2   .   .   .   .   .   .   .   .   .   30   VAL    HB    parsed_1dsq   1   
         8   1   1   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
         8   1   2   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
         9   1   1   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
         9   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HN    parsed_1dsq   1   
        10   1   1   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
        10   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HA1   parsed_1dsq   1   
        11   1   1   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
        11   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        12   1   1   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
        12   1   2   .   .   .   .   .   .   .   .   .   37   THR    QG2   parsed_1dsq   1   
        13   1   1   .   .   .   .   .   .   .   .   .   30   VAL    QG2   parsed_1dsq   1   
        13   1   2   .   .   .   .   .   .   .   .   .   37   THR    HA    parsed_1dsq   1   
        14   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HA    parsed_1dsq   1   
        14   1   2   .   .   .   .   .   .   .   .   .   37   THR    HA    parsed_1dsq   1   
        15   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HA    parsed_1dsq   1   
        15   1   2   .   .   .   .   .   .   .   .   .   38   GLY    HN    parsed_1dsq   1   
        16   1   1   .   .   .   .   .   .   .   .   .   30   VAL    HN    parsed_1dsq   1   
        16   1   2   .   .   .   .   .   .   .   .   .   40   ILE    QG2   parsed_1dsq   1   
        17   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        17   1   2   .   .   .   .   .   .   .   .   .   31   CYS-   HB2   parsed_1dsq   1   
        18   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        18   1   2   .   .   .   .   .   .   .   .   .   31   CYS-   HB3   parsed_1dsq   1   
        19   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HA    parsed_1dsq   1   
        19   1   2   .   .   .   .   .   .   .   .   .   31   CYS-   HB2   parsed_1dsq   1   
        20   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HA    parsed_1dsq   1   
        20   1   2   .   .   .   .   .   .   .   .   .   33   SER    HN    parsed_1dsq   1   
        21   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HB3   parsed_1dsq   1   
        21   1   2   .   .   .   .   .   .   .   .   .   34   CYS-   HN    parsed_1dsq   1   
        22   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HB3   parsed_1dsq   1   
        22   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HN    parsed_1dsq   1   
        23   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        23   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HA1   parsed_1dsq   1   
        24   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HB3   parsed_1dsq   1   
        24   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        25   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        25   1   2   .   .   .   .   .   .   .   .   .   37   THR    HA    parsed_1dsq   1   
        26   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        26   1   2   .   .   .   .   .   .   .   .   .   37   THR    QG2   parsed_1dsq   1   
        27   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        27   1   2   .   .   .   .   .   .   .   .   .   38   GLY    HN    parsed_1dsq   1   
        28   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HN    parsed_1dsq   1   
        28   1   2   .   .   .   .   .   .   .   .   .   39   HIS    HN    parsed_1dsq   1   
        29   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HB2   parsed_1dsq   1   
        29   1   2   .   .   .   .   .   .   .   .   .   39   HIS    HD2   parsed_1dsq   1   
        30   1   1   .   .   .   .   .   .   .   .   .   31   CYS-   HA    parsed_1dsq   1   
        30   1   2   .   .   .   .   .   .   .   .   .   41   LYS+   HN    parsed_1dsq   1   
        31   1   1   .   .   .   .   .   .   .   .   .   32   PHE    HN    parsed_1dsq   1   
        31   1   2   .   .   .   .   .   .   .   .   .   41   LYS+   QB    parsed_1dsq   1   
        32   1   1   .   .   .   .   .   .   .   .   .   32   PHE    HN    parsed_1dsq   1   
        32   1   2   .   .   .   .   .   .   .   .   .   41   LYS+   HN    parsed_1dsq   1   
        33   1   1   .   .   .   .   .   .   .   .   .   33   SER    HN    parsed_1dsq   1   
        33   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HN    parsed_1dsq   1   
        34   1   1   .   .   .   .   .   .   .   .   .   33   SER    HN    parsed_1dsq   1   
        34   1   2   .   .   .   .   .   .   .   .   .   41   LYS+   QB    parsed_1dsq   1   
        35   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HN    parsed_1dsq   1   
        35   1   2   .   .   .   .   .   .   .   .   .   34   CYS-   HB3   parsed_1dsq   1   
        36   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HA    parsed_1dsq   1   
        36   1   2   .   .   .   .   .   .   .   .   .   34   CYS-   HB2   parsed_1dsq   1   
        37   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HA    parsed_1dsq   1   
        37   1   2   .   .   .   .   .   .   .   .   .   34   CYS-   HB3   parsed_1dsq   1   
        38   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HA    parsed_1dsq   1   
        38   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        39   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HN    parsed_1dsq   1   
        39   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        40   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HB2   parsed_1dsq   1   
        40   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HN    parsed_1dsq   1   
        41   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HB3   parsed_1dsq   1   
        41   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HN    parsed_1dsq   1   
        42   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HA    parsed_1dsq   1   
        42   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        43   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HB2   parsed_1dsq   1   
        43   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        44   1   1   .   .   .   .   .   .   .   .   .   34   CYS-   HB3   parsed_1dsq   1   
        44   1   2   .   .   .   .   .   .   .   .   .   36   LYS+   HN    parsed_1dsq   1   
        45   1   1   .   .   .   .   .   .   .   .   .   35   GLY    HN    parsed_1dsq   1   
        45   1   2   .   .   .   .   .   .   .   .   .   35   GLY    HA1   parsed_1dsq   1   
        46   1   1   .   .   .   .   .   .   .   .   .   36   LYS+   HA    parsed_1dsq   1   
        46   1   2   .   .   .   .   .   .   .   .   .   37   THR    QG2   parsed_1dsq   1   
        47   1   1   .   .   .   .   .   .   .   .   .   36   LYS+   HB3   parsed_1dsq   1   
        47   1   2   .   .   .   .   .   .   .   .   .   39   HIS    HE1   parsed_1dsq   1   
        48   1   1   .   .   .   .   .   .   .   .   .   37   THR    HN    parsed_1dsq   1   
        48   1   2   .   .   .   .   .   .   .   .   .   37   THR    QG2   parsed_1dsq   1   
        49   1   1   .   .   .   .   .   .   .   .   .   37   THR    HN    parsed_1dsq   1   
        49   1   2   .   .   .   .   .   .   .   .   .   37   THR    HB    parsed_1dsq   1   
        50   1   1   .   .   .   .   .   .   .   .   .   37   THR    HA    parsed_1dsq   1   
        50   1   2   .   .   .   .   .   .   .   .   .   39   HIS    HN    parsed_1dsq   1   
        51   1   1   .   .   .   .   .   .   .   .   .   38   GLY    HN    parsed_1dsq   1   
        51   1   2   .   .   .   .   .   .   .   .   .   38   GLY    HA1   parsed_1dsq   1   
        52   1   1   .   .   .   .   .   .   .   .   .   39   HIS    HN    parsed_1dsq   1   
        52   1   2   .   .   .   .   .   .   .   .   .   39   HIS    QB    parsed_1dsq   1   
        53   1   1   .   .   .   .   .   .   .   .   .   39   HIS    HD2   parsed_1dsq   1   
        53   1   2   .   .   .   .   .   .   .   .   .   39   HIS    QB    parsed_1dsq   1   
        54   1   1   .   .   .   .   .   .   .   .   .   39   HIS    QB    parsed_1dsq   1   
        54   1   2   .   .   .   .   .   .   .   .   .   40   ILE    HN    parsed_1dsq   1   
        55   1   1   .   .   .   .   .   .   .   .   .   39   HIS    HD2   parsed_1dsq   1   
        55   1   2   .   .   .   .   .   .   .   .   .   43   ASP-   HN    parsed_1dsq   1   
        56   1   1   .   .   .   .   .   .   .   .   .   39   HIS    QB    parsed_1dsq   1   
        56   1   2   .   .   .   .   .   .   .   .   .   43   ASP-   HN    parsed_1dsq   1   
        57   1   1   .   .   .   .   .   .   .   .   .   39   HIS    HD2   parsed_1dsq   1   
        57   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HA    parsed_1dsq   1   
        58   1   1   .   .   .   .   .   .   .   .   .   39   HIS    HD2   parsed_1dsq   1   
        58   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HB2   parsed_1dsq   1   
        59   1   1   .   .   .   .   .   .   .   .   .   39   HIS    HD2   parsed_1dsq   1   
        59   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HN    parsed_1dsq   1   
        60   1   1   .   .   .   .   .   .   .   .   .   40   ILE    HN    parsed_1dsq   1   
        60   1   2   .   .   .   .   .   .   .   .   .   40   ILE    QD1   parsed_1dsq   1   
        61   1   1   .   .   .   .   .   .   .   .   .   40   ILE    QG2   parsed_1dsq   1   
        61   1   2   .   .   .   .   .   .   .   .   .   41   LYS+   HN    parsed_1dsq   1   
        62   1   1   .   .   .   .   .   .   .   .   .   40   ILE    QG2   parsed_1dsq   1   
        62   1   2   .   .   .   .   .   .   .   .   .   42   ARG+   HN    parsed_1dsq   1   
        63   1   1   .   .   .   .   .   .   .   .   .   40   ILE    HN    parsed_1dsq   1   
        63   1   2   .   .   .   .   .   .   .   .   .   43   ASP-   HB3   parsed_1dsq   1   
        64   1   1   .   .   .   .   .   .   .   .   .   40   ILE    QG2   parsed_1dsq   1   
        64   1   2   .   .   .   .   .   .   .   .   .   43   ASP-   HN    parsed_1dsq   1   
        65   1   1   .   .   .   .   .   .   .   .   .   40   ILE    HB    parsed_1dsq   1   
        65   1   2   .   .   .   .   .   .   .   .   .   43   ASP-   HN    parsed_1dsq   1   
        66   1   1   .   .   .   .   .   .   .   .   .   42   ARG+   HA    parsed_1dsq   1   
        66   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HN    parsed_1dsq   1   
        67   1   1   .   .   .   .   .   .   .   .   .   43   ASP-   HN    parsed_1dsq   1   
        67   1   2   .   .   .   .   .   .   .   .   .   43   ASP-   HB2   parsed_1dsq   1   
        68   1   1   .   .   .   .   .   .   .   .   .   43   ASP-   HB3   parsed_1dsq   1   
        68   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HN    parsed_1dsq   1   
        69   1   1   .   .   .   .   .   .   .   .   .   44   CYSZ   HN    parsed_1dsq   1   
        69   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HB2   parsed_1dsq   1   
        70   1   1   .   .   .   .   .   .   .   .   .   44   CYSZ   HN    parsed_1dsq   1   
        70   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HB3   parsed_1dsq   1   
        71   1   1   .   .   .   .   .   .   .   .   .   44   CYSZ   HA    parsed_1dsq   1   
        71   1   2   .   .   .   .   .   .   .   .   .   44   CYSZ   HB2   parsed_1dsq   1   
        72   1   1   .   .   .   .   .   .   .   .   .   44   CYSZ   HB2   parsed_1dsq   1   
        72   1   2   .   .   .   .   .   .   .   .   .   45   LYS+   HN    parsed_1dsq   1   
        73   1   1   .   .   .   .   .   .   .   .   .   44   CYSZ   HA    parsed_1dsq   1   
        73   1   2   .   .   .   .   .   .   .   .   .   46   GLU-   HN    parsed_1dsq   1   
        74   1   1   .   .   .   .   .   .   .   .   .   45   LYS+   HN    parsed_1dsq   1   
        74   1   2   .   .   .   .   .   .   .   .   .   45   LYS+   QB    parsed_1dsq   1   
        75   1   1   .   .   .   .   .   .   .   .   .   46   GLU-   HG2   parsed_1dsq   1   
        75   1   2   .   .   .   .   .   .   .   .   .   47   GLU-   HN    parsed_1dsq   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   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
         2   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
         3   1   .   .   .   .   .   .   .   3.90   parsed_1dsq   1   
         4   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
         5   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
         6   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
         7   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
         8   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
         9   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        10   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        11   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        12   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        13   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        14   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        15   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        16   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        17   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        18   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        19   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        20   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        21   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        22   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        23   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        24   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        25   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        26   1   .   .   .   .   .   .   .   5.50   parsed_1dsq   1   
        27   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        28   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        29   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        30   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        31   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        32   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        33   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        34   1   .   .   .   .   .   .   .   3.90   parsed_1dsq   1   
        35   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        36   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        37   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        38   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        39   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        40   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        41   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        42   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        43   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        44   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        45   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        46   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
        47   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        48   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
        49   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        50   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        51   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        52   1   .   .   .   .   .   .   .   3.90   parsed_1dsq   1   
        53   1   .   .   .   .   .   .   .   3.90   parsed_1dsq   1   
        54   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        55   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        56   1   .   .   .   .   .   .   .   5.60   parsed_1dsq   1   
        57   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        58   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        59   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        60   1   .   .   .   .   .   .   .   3.20   parsed_1dsq   1   
        61   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
        62   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
        63   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   1   
        64   1   .   .   .   .   .   .   .   3.80   parsed_1dsq   1   
        65   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        66   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        67   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        68   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        69   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        70   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        71   1   .   .   .   .   .   .   .   2.70   parsed_1dsq   1   
        72   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        73   1   .   .   .   .   .   .   .   5.00   parsed_1dsq   1   
        74   1   .   .   .   .   .   .   .   3.90   parsed_1dsq   1   
        75   1   .   .   .   .   .   .   .   3.30   parsed_1dsq   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   "PRO 29"                                                                      1    1     1    8   parsed_1dsq   1   
         2   "VAL 30"                                                                      5    1     5    8   parsed_1dsq   1   
         3   "ASSUMED (APPEARS TO OVERLAP W/ HOA PEAK)"                                   17   39    17   79   parsed_1dsq   1   
         4   "POSSIBLY AN UNRELIABLE PEAK"                                                19   39    19   66   parsed_1dsq   1   
         5   "CYS- 31"                                                                    21    1    21    9   parsed_1dsq   1   
         6   "was 3.30 in p7"                                                             34   39    34   53   parsed_1dsq   1   
         7   "was 5.00 in p7"                                                             35   39    35   53   parsed_1dsq   1   
         8   "PHE 32"                                                                     37    1    37    8   parsed_1dsq   1   
         9   "32  PHE  HN      32 PHE  HB2    2.70 NON-FUNCTIONAL"                        38    1    38   67   parsed_1dsq   1   
        10   "32  PHE  HB3     33 SER  HN     3.30 NON-FUNCTIONAL"                        41    1    41   52   parsed_1dsq   1   
        11   "32  PHE  HB2     33 SER  HN     3.30 NON-FUNCTIONAL"                        42    1    42   52   parsed_1dsq   1   
        12   "SER 33"                                                                     44    1    44    8   parsed_1dsq   1   
        13   "33  SER  HN      33 SER  HB2    2.70 #COULD BE HB3, NON-FUNCTIONAL"         45    1    45   67   parsed_1dsq   1   
        14   "33  SER  HB3     34 CYS- HN     2.70 #COULD BE HB2, NON-FUNCTIONAL"         46    1    46   67   parsed_1dsq   1   
        15   "CYS- 34"                                                                    50    1    50    9   parsed_1dsq   1   
        16   "GLY 35"                                                                     63    1    63    8   parsed_1dsq   1   
        17   "35  GLY  HN      35 GLY  HA2    2.70 SPIN DIFFUSION"                        65    1    65   52   parsed_1dsq   1   
        18   "LYS 36"                                                                     67    1    67    8   parsed_1dsq   1   
        19   "36  LYS+ HN      36 LYS+ QB     3.20 NON-FUNCTIONAL"                        68    1    68   52   parsed_1dsq   1   
        20   "36  LYS+ QB     37 THR  HN      3.20 NON-FUNCTIONAL"                        70    1    70   54   parsed_1dsq   1   
        21   "THR 37"                                                                     73    1    73    8   parsed_1dsq   1   
        22   "GLY 38"                                                                     78    1    78    8   parsed_1dsq   1   
        23   "CHECK IF ITS HA2"                                                           79   40    79   56   parsed_1dsq   1   
        24   "HIS 39"                                                                     81    1    81    8   parsed_1dsq   1   
        25   "39  HIS  HD2     40 ILE  HN     3.30 SPIN DIFFUSION THRU 39 QB"             85    1    85   63   parsed_1dsq   1   
        26   "LOOKS MEDIUM (SPIN DIFFUSION)"                                              86   39    86   68   parsed_1dsq   1   
        27   "ILE 40"                                                                     92    1    92    8   parsed_1dsq   1   
        28   "40  ILE  HB      41 LYS+ HN     3.30 UNRELIABLE, SAME SHIFT AS 41 BETA"     94    1    94   71   parsed_1dsq   1   
        29   "40  ILE  HN      44 CYSZ HB3    3.30 NOT SURE WHAT THIS NOE IS????"        100    1   100   67   parsed_1dsq   1   
        30   "LYS 41"                                                                    103    1   103    8   parsed_1dsq   1   
        31   "41  LYS+ HN      41 LYS+ QB     3.30 NON-FUNCTIONAL"                       104    1   104   52   parsed_1dsq   1   
        32   "ARG 42"                                                                    106    1   106    8   parsed_1dsq   1   
        33   "42  ARG+ HN      42 ARG+ HB2    3.30 #MAY BE HB3  NON-FUNCTIONAL"          107    1   107   65   parsed_1dsq   1   
        34   "42  ARG+ HB3     43 ASP- HN     3.30 #MAY BE HB2  NON-FUNCTIONAL"          108    1   108   65   parsed_1dsq   1   
        35   "ASP 43"                                                                    111    1   111    8   parsed_1dsq   1   
        36   "43  ASP- HN      44 CYSZ HB2    5.00 DOESN'T SEEM RIGHT"                   114    1   114   56   parsed_1dsq   1   
        37   "CYSZ 44"                                                                   116    1   116    9   parsed_1dsq   1   
        38   "LYS+ 45"                                                                   123    1   123    9   parsed_1dsq   1   
        39   "GLU- 46"                                                                   126    1   126    9   parsed_1dsq   1   
        40   "GLU- 47"                                                                   129    1   129    9   parsed_1dsq   1   
    stop_

save_





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