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 subtype subsubtype item_count
569563 2m3i 18964 cing 2-parsed STAR distance NOE simple 78


data_2m3i_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2m3i 
    _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_2m3i   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2m3i 
    _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   2m3i   "Master copy"    parsed_2m3i   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2m3i 
    _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   2m3i.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_2m3i   1   
        1   2m3i.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             78   parsed_2m3i   1   
        1   2m3i.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     0   parsed_2m3i   1   
        1   2m3i.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_2m3i   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2m3i 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            2 
    _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_2m3i   1   
         2   1   .   .   .   parsed_2m3i   1   
         3   1   .   .   .   parsed_2m3i   1   
         4   1   .   .   .   parsed_2m3i   1   
         5   1   .   .   .   parsed_2m3i   1   
         6   1   .   .   .   parsed_2m3i   1   
         7   1   .   .   .   parsed_2m3i   1   
         8   1   .   .   .   parsed_2m3i   1   
         9   1   .   .   .   parsed_2m3i   1   
        10   1   .   .   .   parsed_2m3i   1   
        11   1   .   .   .   parsed_2m3i   1   
        12   1   .   .   .   parsed_2m3i   1   
        13   1   .   .   .   parsed_2m3i   1   
        14   1   .   .   .   parsed_2m3i   1   
        15   1   .   .   .   parsed_2m3i   1   
        16   1   .   .   .   parsed_2m3i   1   
        17   1   .   .   .   parsed_2m3i   1   
        18   1   .   .   .   parsed_2m3i   1   
        19   1   .   .   .   parsed_2m3i   1   
        20   1   .   .   .   parsed_2m3i   1   
        21   1   .   .   .   parsed_2m3i   1   
        22   1   .   .   .   parsed_2m3i   1   
        23   1   .   .   .   parsed_2m3i   1   
        24   1   .   .   .   parsed_2m3i   1   
        25   1   .   .   .   parsed_2m3i   1   
        26   1   .   .   .   parsed_2m3i   1   
        27   1   .   .   .   parsed_2m3i   1   
        28   1   .   .   .   parsed_2m3i   1   
        29   1   .   .   .   parsed_2m3i   1   
        30   1   .   .   .   parsed_2m3i   1   
        31   1   .   .   .   parsed_2m3i   1   
        32   1   .   .   .   parsed_2m3i   1   
        33   1   .   .   .   parsed_2m3i   1   
        34   1   .   .   .   parsed_2m3i   1   
        35   1   .   .   .   parsed_2m3i   1   
        36   1   .   .   .   parsed_2m3i   1   
        37   1   .   .   .   parsed_2m3i   1   
        38   1   .   .   .   parsed_2m3i   1   
        39   1   .   .   .   parsed_2m3i   1   
        40   1   .   .   .   parsed_2m3i   1   
        41   1   .   .   .   parsed_2m3i   1   
        42   1   .   .   .   parsed_2m3i   1   
        43   1   .   .   .   parsed_2m3i   1   
        44   1   .   .   .   parsed_2m3i   1   
        45   1   .   .   .   parsed_2m3i   1   
        46   1   .   .   .   parsed_2m3i   1   
        47   1   .   .   .   parsed_2m3i   1   
        48   1   .   .   .   parsed_2m3i   1   
        49   1   .   .   .   parsed_2m3i   1   
        50   1   .   .   .   parsed_2m3i   1   
        51   1   .   .   .   parsed_2m3i   1   
        52   1   .   .   .   parsed_2m3i   1   
        53   1   .   .   .   parsed_2m3i   1   
        54   1   .   .   .   parsed_2m3i   1   
        55   1   .   .   .   parsed_2m3i   1   
        56   1   .   .   .   parsed_2m3i   1   
        57   1   .   .   .   parsed_2m3i   1   
        58   1   .   .   .   parsed_2m3i   1   
        59   1   .   .   .   parsed_2m3i   1   
        60   1   .   .   .   parsed_2m3i   1   
        61   1   .   .   .   parsed_2m3i   1   
        62   1   .   .   .   parsed_2m3i   1   
        63   1   .   .   .   parsed_2m3i   1   
        64   1   .   .   .   parsed_2m3i   1   
        65   1   .   .   .   parsed_2m3i   1   
        66   1   .   .   .   parsed_2m3i   1   
        67   1   .   .   .   parsed_2m3i   1   
        68   1   .   .   .   parsed_2m3i   1   
        69   1   .   .   .   parsed_2m3i   1   
        70   1   .   .   .   parsed_2m3i   1   
        71   1   .   .   .   parsed_2m3i   1   
        72   1   .   .   .   parsed_2m3i   1   
        73   1   .   .   .   parsed_2m3i   1   
        74   1   .   .   .   parsed_2m3i   1   
        75   1   .   .   .   parsed_2m3i   1   
        76   1   .   .   .   parsed_2m3i   1   
        77   1   .   .   .   parsed_2m3i   1   
        78   1   .   .   .   parsed_2m3i   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   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
         1   1   2   .   .   .   .   .   .   .   .   .    5   .   HB1    parsed_2m3i   1   
         2   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
         2   1   2   .   .   .   .   .   .   .   .   .    5   .   HB2    parsed_2m3i   1   
         3   1   1   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
         3   1   2   .   .   .   .   .   .   .   .   .   15   .   HB1    parsed_2m3i   1   
         4   1   1   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
         4   1   2   .   .   .   .   .   .   .   .   .   15   .   HB2    parsed_2m3i   1   
         5   1   1   .   .   .   .   .   .   .   .   .   14   .   HB     parsed_2m3i   1   
         5   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
         6   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
         6   1   2   .   .   .   .   .   .   .   .   .   14   .   HB     parsed_2m3i   1   
         7   1   1   .   .   .   .   .   .   .   .   .   14   .   HA     parsed_2m3i   1   
         7   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
         8   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
         8   1   2   .   .   .   .   .   .   .   .   .   14   .   HA     parsed_2m3i   1   
         9   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
         9   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        10   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        10   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1    parsed_2m3i   1   
        11   1   1   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        11   1   2   .   .   .   .   .   .   .   .   .   12   .   HB2    parsed_2m3i   1   
        12   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2m3i   1   
        12   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        13   1   1   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_2m3i   1   
        13   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        14   1   1   .   .   .   .   .   .   .   .   .   11   .   HA     parsed_2m3i   1   
        14   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        15   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2m3i   1   
        15   1   2   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_2m3i   1   
        16   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2m3i   1   
        16   1   2   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_2m3i   1   
        17   1   1   .   .   .   .   .   .   .   .   .   11   .   HB1    parsed_2m3i   1   
        17   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        18   1   1   .   .   .   .   .   .   .   .   .   11   .   HB2    parsed_2m3i   1   
        18   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        19   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2m3i   1   
        19   1   2   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
        20   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        20   1   2   .   .   .   .   .   .   .   .   .    3   .   HB1    parsed_2m3i   1   
        21   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        21   1   2   .   .   .   .   .   .   .   .   .    3   .   HB2    parsed_2m3i   1   
        22   1   1   .   .   .   .   .   .   .   .   .    3   .   HB2    parsed_2m3i   1   
        22   1   2   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2m3i   1   
        23   1   1   .   .   .   .   .   .   .   .   .    3   .   HB1    parsed_2m3i   1   
        23   1   2   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2m3i   1   
        24   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        24   1   2   .   .   .   .   .   .   .   .   .    3   .   HA     parsed_2m3i   1   
        25   1   1   .   .   .   .   .   .   .   .   .    2   .   HB1    parsed_2m3i   1   
        25   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        26   1   1   .   .   .   .   .   .   .   .   .    2   .   HB2    parsed_2m3i   1   
        26   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        27   1   1   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2m3i   1   
        27   1   2   .   .   .   .   .   .   .   .   .    4   .   HB#    parsed_2m3i   1   
        28   1   1   .   .   .   .   .   .   .   .   .    4   .   HB#    parsed_2m3i   1   
        28   1   2   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
        29   1   1   .   .   .   .   .   .   .   .   .    4   .   HA     parsed_2m3i   1   
        29   1   2   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
        30   1   1   .   .   .   .   .   .   .   .   .    7   .   HN     parsed_2m3i   1   
        30   1   2   .   .   .   .   .   .   .   .   .    7   .   HB     parsed_2m3i   1   
        31   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2m3i   1   
        31   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2m3i   1   
        32   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2m3i   1   
        32   1   2   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2m3i   1   
        33   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2m3i   1   
        33   1   2   .   .   .   .   .   .   .   .   .    9   .   HB#    parsed_2m3i   1   
        34   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2m3i   1   
        34   1   2   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2m3i   1   
        35   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2m3i   1   
        35   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        36   1   1   .   .   .   .   .   .   .   .   .   10   .   HA     parsed_2m3i   1   
        36   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        37   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
        37   1   2   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2m3i   1   
        38   1   1   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2m3i   1   
        38   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2m3i   1   
        39   1   1   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2m3i   1   
        39   1   2   .   .   .   .   .   .   .   .   .    8   .   HB2    parsed_2m3i   1   
        40   1   1   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2m3i   1   
        40   1   2   .   .   .   .   .   .   .   .   .    8   .   HB1    parsed_2m3i   1   
        41   1   1   .   .   .   .   .   .   .   .   .   13   .   HA     parsed_2m3i   1   
        41   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        42   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2m3i   1   
        42   1   2   .   .   .   .   .   .   .   .   .    2   .   HB2    parsed_2m3i   1   
        43   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2m3i   1   
        43   1   2   .   .   .   .   .   .   .   .   .    2   .   HB1    parsed_2m3i   1   
        44   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2m3i   1   
        44   1   2   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        45   1   1   .   .   .   .   .   .   .   .   .   14   .   HG11   parsed_2m3i   1   
        45   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        46   1   1   .   .   .   .   .   .   .   .   .   14   .   HG12   parsed_2m3i   1   
        46   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        47   1   1   .   .   .   .   .   .   .   .   .    5   .   HA     parsed_2m3i   1   
        47   1   2   .   .   .   .   .   .   .   .   .    5   .   HD2    parsed_2m3i   1   
        48   1   1   .   .   .   .   .   .   .   .   .   13   .   HD#    parsed_2m3i   1   
        48   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        49   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2m3i   1   
        49   1   2   .   .   .   .   .   .   .   .   .   11   .   HG1    parsed_2m3i   1   
        50   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2m3i   1   
        50   1   2   .   .   .   .   .   .   .   .   .   11   .   HG2    parsed_2m3i   1   
        51   1   1   .   .   .   .   .   .   .   .   .    3   .   HA     parsed_2m3i   1   
        51   1   2   .   .   .   .   .   .   .   .   .    9   .   HB#    parsed_2m3i   1   
        52   1   1   .   .   .   .   .   .   .   .   .   14   .   HG2#   parsed_2m3i   1   
        52   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        53   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        53   1   2   .   .   .   .   .   .   .   .   .   14   .   HG2#   parsed_2m3i   1   
        54   1   1   .   .   .   .   .   .   .   .   .    7   .   HA     parsed_2m3i   1   
        54   1   2   .   .   .   .   .   .   .   .   .   10   .   HB#    parsed_2m3i   1   
        55   1   1   .   .   .   .   .   .   .   .   .   10   .   HN     parsed_2m3i   1   
        55   1   2   .   .   .   .   .   .   .   .   .   10   .   HB#    parsed_2m3i   1   
        56   1   1   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2m3i   1   
        56   1   2   .   .   .   .   .   .   .   .   .   10   .   HB#    parsed_2m3i   1   
        57   1   1   .   .   .   .   .   .   .   .   .    2   .   HN     parsed_2m3i   1   
        57   1   2   .   .   .   .   .   .   .   .   .    2   .   HB#    parsed_2m3i   1   
        58   1   1   .   .   .   .   .   .   .   .   .    2   .   HB#    parsed_2m3i   1   
        58   1   2   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2m3i   1   
        59   1   1   .   .   .   .   .   .   .   .   .    2   .   HB#    parsed_2m3i   1   
        59   1   2   .   .   .   .   .   .   .   .   .    8   .   HB#    parsed_2m3i   1   
        60   1   1   .   .   .   .   .   .   .   .   .    3   .   HN     parsed_2m3i   1   
        60   1   2   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_2m3i   1   
        61   1   1   .   .   .   .   .   .   .   .   .    3   .   HB#    parsed_2m3i   1   
        61   1   2   .   .   .   .   .   .   .   .   .    4   .   HN     parsed_2m3i   1   
        62   1   1   .   .   .   .   .   .   .   .   .    5   .   HN     parsed_2m3i   1   
        62   1   2   .   .   .   .   .   .   .   .   .    5   .   HB#    parsed_2m3i   1   
        63   1   1   .   .   .   .   .   .   .   .   .    5   .   HA     parsed_2m3i   1   
        63   1   2   .   .   .   .   .   .   .   .   .    6   .   HD#    parsed_2m3i   1   
        64   1   1   .   .   .   .   .   .   .   .   .    5   .   HB#    parsed_2m3i   1   
        64   1   2   .   .   .   .   .   .   .   .   .    5   .   HD2    parsed_2m3i   1   
        65   1   1   .   .   .   .   .   .   .   .   .    5   .   HB#    parsed_2m3i   1   
        65   1   2   .   .   .   .   .   .   .   .   .    6   .   HD#    parsed_2m3i   1   
        66   1   1   .   .   .   .   .   .   .   .   .    8   .   HN     parsed_2m3i   1   
        66   1   2   .   .   .   .   .   .   .   .   .    8   .   HB#    parsed_2m3i   1   
        67   1   1   .   .   .   .   .   .   .   .   .    8   .   HB#    parsed_2m3i   1   
        67   1   2   .   .   .   .   .   .   .   .   .    9   .   HN     parsed_2m3i   1   
        68   1   1   .   .   .   .   .   .   .   .   .    9   .   HA     parsed_2m3i   1   
        68   1   2   .   .   .   .   .   .   .   .   .   15   .   HB#    parsed_2m3i   1   
        69   1   1   .   .   .   .   .   .   .   .   .   10   .   HA     parsed_2m3i   1   
        69   1   2   .   .   .   .   .   .   .   .   .   13   .   HG#    parsed_2m3i   1   
        70   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2m3i   1   
        70   1   2   .   .   .   .   .   .   .   .   .   11   .   HB#    parsed_2m3i   1   
        71   1   1   .   .   .   .   .   .   .   .   .   11   .   HN     parsed_2m3i   1   
        71   1   2   .   .   .   .   .   .   .   .   .   11   .   HG#    parsed_2m3i   1   
        72   1   1   .   .   .   .   .   .   .   .   .   11   .   HB#    parsed_2m3i   1   
        72   1   2   .   .   .   .   .   .   .   .   .   12   .   HN     parsed_2m3i   1   
        73   1   1   .   .   .   .   .   .   .   .   .   12   .   HA     parsed_2m3i   1   
        73   1   2   .   .   .   .   .   .   .   .   .   12   .   HB#    parsed_2m3i   1   
        74   1   1   .   .   .   .   .   .   .   .   .   12   .   HB#    parsed_2m3i   1   
        74   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        75   1   1   .   .   .   .   .   .   .   .   .   12   .   HB#    parsed_2m3i   1   
        75   1   2   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        76   1   1   .   .   .   .   .   .   .   .   .   13   .   HG#    parsed_2m3i   1   
        76   1   2   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        77   1   1   .   .   .   .   .   .   .   .   .   14   .   HN     parsed_2m3i   1   
        77   1   2   .   .   .   .   .   .   .   .   .   14   .   HG1#   parsed_2m3i   1   
        78   1   1   .   .   .   .   .   .   .   .   .   15   .   HN     parsed_2m3i   1   
        78   1   2   .   .   .   .   .   .   .   .   .   15   .   HB#    parsed_2m3i   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   .   .   .   .   .   2.470   1.800   3.140   parsed_2m3i   1   
         2   1   .   .   .   .   .   2.470   1.800   3.140   parsed_2m3i   1   
         3   1   .   .   .   .   .   2.550   1.800   3.300   parsed_2m3i   1   
         4   1   .   .   .   .   .   2.550   1.800   3.300   parsed_2m3i   1   
         5   1   .   .   .   .   .   2.705   1.800   3.610   parsed_2m3i   1   
         6   1   .   .   .   .   .   2.300   1.800   2.800   parsed_2m3i   1   
         7   1   .   .   .   .   .   2.455   1.800   3.110   parsed_2m3i   1   
         8   1   .   .   .   .   .   2.300   1.800   2.800   parsed_2m3i   1   
         9   1   .   .   .   .   .   2.270   1.800   2.740   parsed_2m3i   1   
        10   1   .   .   .   .   .   2.365   1.800   2.930   parsed_2m3i   1   
        11   1   .   .   .   .   .   2.365   1.800   2.930   parsed_2m3i   1   
        12   1   .   .   .   .   .   2.565   1.800   3.330   parsed_2m3i   1   
        13   1   .   .   .   .   .   2.905   1.800   4.010   parsed_2m3i   1   
        14   1   .   .   .   .   .   2.535   1.800   3.270   parsed_2m3i   1   
        15   1   .   .   .   .   .   2.765   1.800   3.730   parsed_2m3i   1   
        16   1   .   .   .   .   .   2.765   1.800   3.730   parsed_2m3i   1   
        17   1   .   .   .   .   .   3.000   1.800   4.200   parsed_2m3i   1   
        18   1   .   .   .   .   .   3.000   1.800   4.200   parsed_2m3i   1   
        19   1   .   .   .   .   .   2.315   1.800   2.830   parsed_2m3i   1   
        20   1   .   .   .   .   .   2.660   1.800   3.520   parsed_2m3i   1   
        21   1   .   .   .   .   .   2.660   1.800   3.520   parsed_2m3i   1   
        22   1   .   .   .   .   .   2.890   1.800   3.980   parsed_2m3i   1   
        23   1   .   .   .   .   .   2.890   1.800   3.980   parsed_2m3i   1   
        24   1   .   .   .   .   .   2.285   1.800   2.770   parsed_2m3i   1   
        25   1   .   .   .   .   .   2.625   1.800   3.450   parsed_2m3i   1   
        26   1   .   .   .   .   .   2.625   1.800   3.450   parsed_2m3i   1   
        27   1   .   .   .   .   .   2.975   1.800   4.150   parsed_2m3i   1   
        28   1   .   .   .   .   .   3.315   1.800   4.830   parsed_2m3i   1   
        29   1   .   .   .   .   .   2.640   1.800   3.480   parsed_2m3i   1   
        30   1   .   .   .   .   .   2.735   1.800   3.670   parsed_2m3i   1   
        31   1   .   .   .   .   .   2.660   1.800   3.520   parsed_2m3i   1   
        32   1   .   .   .   .   .   2.255   1.800   2.710   parsed_2m3i   1   
        33   1   .   .   .   .   .   2.835   1.800   3.870   parsed_2m3i   1   
        34   1   .   .   .   .   .   2.410   1.800   3.020   parsed_2m3i   1   
        35   1   .   .   .   .   .   2.815   1.800   3.830   parsed_2m3i   1   
        36   1   .   .   .   .   .   3.125   1.800   4.450   parsed_2m3i   1   
        37   1   .   .   .   .   .   3.260   1.800   4.720   parsed_2m3i   1   
        38   1   .   .   .   .   .   2.145   1.800   2.490   parsed_2m3i   1   
        39   1   .   .   .   .   .   2.905   1.800   4.010   parsed_2m3i   1   
        40   1   .   .   .   .   .   2.905   1.800   4.010   parsed_2m3i   1   
        41   1   .   .   .   .   .   2.845   1.800   3.890   parsed_2m3i   1   
        42   1   .   .   .   .   .   2.535   1.800   3.270   parsed_2m3i   1   
        43   1   .   .   .   .   .   2.535   1.800   3.270   parsed_2m3i   1   
        44   1   .   .   .   .   .   2.690   1.800   3.580   parsed_2m3i   1   
        45   1   .   .   .   .   .   3.650   1.800   5.500   parsed_2m3i   1   
        46   1   .   .   .   .   .   3.650   1.800   5.500   parsed_2m3i   1   
        47   1   .   .   .   .   .   3.465   1.800   5.130   parsed_2m3i   1   
        48   1   .   .   .   .   .   3.395   1.800   4.990   parsed_2m3i   1   
        49   1   .   .   .   .   .   3.355   1.800   4.910   parsed_2m3i   1   
        50   1   .   .   .   .   .   3.355   1.800   4.910   parsed_2m3i   1   
        51   1   .   .   .   .   .   3.595   1.800   5.390   parsed_2m3i   1   
        52   1   .   .   .   .   .   3.820   1.800   5.840   parsed_2m3i   1   
        53   1   .   .   .   .   .   3.200   1.800   4.600   parsed_2m3i   1   
        54   1   .   .   .   .   .   3.525   1.800   5.250   parsed_2m3i   1   
        55   1   .   .   .   .   .   2.980   1.800   4.160   parsed_2m3i   1   
        56   1   .   .   .   .   .   4.160   1.800   6.520   parsed_2m3i   1   
        57   1   .   .   .   .   .   2.285   1.800   2.770   parsed_2m3i   1   
        58   1   .   .   .   .   .   2.975   1.800   4.150   parsed_2m3i   1   
        59   1   .   .   .   .   .   2.145   1.800   2.490   parsed_2m3i   1   
        60   1   .   .   .   .   .   2.305   1.800   2.810   parsed_2m3i   1   
        61   1   .   .   .   .   .   2.620   1.800   3.440   parsed_2m3i   1   
        62   1   .   .   .   .   .   2.235   1.800   2.670   parsed_2m3i   1   
        63   1   .   .   .   .   .   2.210   1.800   2.620   parsed_2m3i   1   
        64   1   .   .   .   .   .   2.515   1.800   3.230   parsed_2m3i   1   
        65   1   .   .   .   .   .   2.705   1.800   3.610   parsed_2m3i   1   
        66   1   .   .   .   .   .   2.590   1.800   3.380   parsed_2m3i   1   
        67   1   .   .   .   .   .   2.380   1.800   2.960   parsed_2m3i   1   
        68   1   .   .   .   .   .   3.080   1.800   4.360   parsed_2m3i   1   
        69   1   .   .   .   .   .   3.105   1.800   4.410   parsed_2m3i   1   
        70   1   .   .   .   .   .   2.360   1.800   2.920   parsed_2m3i   1   
        71   1   .   .   .   .   .   3.025   1.800   4.250   parsed_2m3i   1   
        72   1   .   .   .   .   .   2.700   1.800   3.600   parsed_2m3i   1   
        73   1   .   .   .   .   .   2.090   1.800   2.380   parsed_2m3i   1   
        74   1   .   .   .   .   .   2.750   1.800   3.700   parsed_2m3i   1   
        75   1   .   .   .   .   .   2.710   1.800   3.620   parsed_2m3i   1   
        76   1   .   .   .   .   .   2.555   1.800   3.310   parsed_2m3i   1   
        77   1   .   .   .   .   .   2.520   1.800   3.240   parsed_2m3i   1   
        78   1   .   .   .   .   .   2.185   1.800   2.570   parsed_2m3i   1   
    stop_


    loop_
        _Dist_constraint_parse_err.ID 
        _Dist_constraint_parse_err.Content 
        _Dist_constraint_parse_err.Begin_line 
        _Dist_constraint_parse_err.Begin_column 
        _Dist_constraint_parse_err.End_line 
        _Dist_constraint_parse_err.End_column 
        _Dist_constraint_parse_err.Entry_ID 
        _Dist_constraint_parse_err.Distance_constraint_list_ID 

        1   "# H proton - H proton"    1   1   1   21   parsed_2m3i   1   
    stop_

save_





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