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
35481 1lpw 5394 cing 2-parsed STAR distance NOE simple 74


data_1lpw_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1lpw 
    _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_1lpw   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1lpw 
    _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   1lpw   "Master copy"    parsed_1lpw   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1lpw 
    _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   1lpw.mr   .   .   "MR format"     1    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a            2    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS      3    distance                 "general distance"     simple             40   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a            4    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS      5    distance                  NOE                   simple             74   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a            6    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS      7    distance                  NOE                   simple              0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a            8    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS      9    distance                  NOE                   simple              0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a           10    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS     11   "dihedral angle"          "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a           12    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS     13   "dihedral angle"          "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a           14    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS     15   "dihedral angle"          "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a           16    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS     17   "dihedral angle"          "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    n/a           18    comment                  "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .    XPLOR/CNS     19   "dihedral angle"          "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
        1   1lpw.mr   .   .   "MR format"    20   "nomenclature mapping"    "Not applicable"      "Not applicable"     0   parsed_1lpw   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_5
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1lpw 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            5 
    _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_1lpw   1   
         2   1   .   .   .   parsed_1lpw   1   
         3   1   .   .   .   parsed_1lpw   1   
         4   1   .   .   .   parsed_1lpw   1   
         5   1   .   .   .   parsed_1lpw   1   
         6   1   .   .   .   parsed_1lpw   1   
         7   1   .   .   .   parsed_1lpw   1   
         8   1   .   .   .   parsed_1lpw   1   
         9   1   .   .   .   parsed_1lpw   1   
        10   1   .   .   .   parsed_1lpw   1   
        11   1   .   .   .   parsed_1lpw   1   
        12   1   .   .   .   parsed_1lpw   1   
        13   1   .   .   .   parsed_1lpw   1   
        14   1   .   .   .   parsed_1lpw   1   
        15   1   .   .   .   parsed_1lpw   1   
        16   1   .   .   .   parsed_1lpw   1   
        17   1   .   .   .   parsed_1lpw   1   
        18   1   .   .   .   parsed_1lpw   1   
        19   1   .   .   .   parsed_1lpw   1   
        20   1   .   .   .   parsed_1lpw   1   
        21   1   .   .   .   parsed_1lpw   1   
        22   1   .   .   .   parsed_1lpw   1   
        23   1   .   .   .   parsed_1lpw   1   
        24   1   .   .   .   parsed_1lpw   1   
        25   1   .   .   .   parsed_1lpw   1   
        26   1   .   .   .   parsed_1lpw   1   
        27   1   .   .   .   parsed_1lpw   1   
        28   1   .   .   .   parsed_1lpw   1   
        29   1   .   .   .   parsed_1lpw   1   
        30   1   .   .   .   parsed_1lpw   1   
        31   1   .   .   .   parsed_1lpw   1   
        32   1   .   .   .   parsed_1lpw   1   
        33   1   .   .   .   parsed_1lpw   1   
        34   1   .   .   .   parsed_1lpw   1   
        35   1   .   .   .   parsed_1lpw   1   
        36   1   .   .   .   parsed_1lpw   1   
        37   1   .   .   .   parsed_1lpw   1   
        38   1   .   .   .   parsed_1lpw   1   
        39   1   .   .   .   parsed_1lpw   1   
        40   1   .   .   .   parsed_1lpw   1   
        41   1   .   .   .   parsed_1lpw   1   
        42   1   .   .   .   parsed_1lpw   1   
        43   1   .   .   .   parsed_1lpw   1   
        44   1   .   .   .   parsed_1lpw   1   
        45   1   .   .   .   parsed_1lpw   1   
        46   1   .   .   .   parsed_1lpw   1   
        47   1   .   .   .   parsed_1lpw   1   
        48   1   .   .   .   parsed_1lpw   1   
        49   1   .   .   .   parsed_1lpw   1   
        50   1   .   .   .   parsed_1lpw   1   
        51   1   .   .   .   parsed_1lpw   1   
        52   1   .   .   .   parsed_1lpw   1   
        53   1   .   .   .   parsed_1lpw   1   
        54   1   .   .   .   parsed_1lpw   1   
        55   1   .   .   .   parsed_1lpw   1   
        56   1   .   .   .   parsed_1lpw   1   
        57   1   .   .   .   parsed_1lpw   1   
        58   1   .   .   .   parsed_1lpw   1   
        59   1   .   .   .   parsed_1lpw   1   
        60   1   .   .   .   parsed_1lpw   1   
        61   1   .   .   .   parsed_1lpw   1   
        62   1   .   .   .   parsed_1lpw   1   
        63   1   .   .   .   parsed_1lpw   1   
        64   1   .   .   .   parsed_1lpw   1   
        65   1   .   .   .   parsed_1lpw   1   
        66   1   .   .   .   parsed_1lpw   1   
        67   1   .   .   .   parsed_1lpw   1   
        68   1   .   .   .   parsed_1lpw   1   
        69   1   .   .   .   parsed_1lpw   1   
        70   1   .   .   .   parsed_1lpw   1   
        71   1   .   .   .   parsed_1lpw   1   
        72   1   .   .   .   parsed_1lpw   1   
        73   1   .   .   .   parsed_1lpw   1   
        74   1   .   .   .   parsed_1lpw   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   .   .   .   .   .   .   .   .   a    9   .   h1'   parsed_1lpw   1   
         1   1   2   .   .   .   .   .   .   .   .   a    9   .   h2'   parsed_1lpw   1   
         2   1   1   .   .   .   .   .   .   .   .   b   10   .   h1'   parsed_1lpw   1   
         2   1   2   .   .   .   .   .   .   .   .   b   10   .   h2'   parsed_1lpw   1   
         3   1   1   .   .   .   .   .   .   .   .   b    4   .   h1'   parsed_1lpw   1   
         3   1   2   .   .   .   .   .   .   .   .   b    4   .   h2'   parsed_1lpw   1   
         4   1   1   .   .   .   .   .   .   .   .   a    6   .   h1'   parsed_1lpw   1   
         4   1   2   .   .   .   .   .   .   .   .   a    6   .   h2'   parsed_1lpw   1   
         5   1   1   .   .   .   .   .   .   .   .   b    1   .   h1'   parsed_1lpw   1   
         5   1   2   .   .   .   .   .   .   .   .   b    1   .   h2'   parsed_1lpw   1   
         6   1   1   .   .   .   .   .   .   .   .   b    8   .   h1'   parsed_1lpw   1   
         6   1   2   .   .   .   .   .   .   .   .   b    8   .   h2'   parsed_1lpw   1   
         7   1   1   .   .   .   .   .   .   .   .   b    6   .   h1'   parsed_1lpw   1   
         7   1   2   .   .   .   .   .   .   .   .   b    6   .   h2'   parsed_1lpw   1   
         8   1   1   .   .   .   .   .   .   .   .   b    2   .   h1'   parsed_1lpw   1   
         8   1   2   .   .   .   .   .   .   .   .   b    2   .   h2'   parsed_1lpw   1   
         9   1   1   .   .   .   .   .   .   .   .   a    8   .   h1'   parsed_1lpw   1   
         9   1   2   .   .   .   .   .   .   .   .   a    8   .   h2'   parsed_1lpw   1   
        10   1   1   .   .   .   .   .   .   .   .   a    7   .   h1'   parsed_1lpw   1   
        10   1   2   .   .   .   .   .   .   .   .   a    7   .   h2'   parsed_1lpw   1   
        11   1   1   .   .   .   .   .   .   .   .   b    3   .   h1'   parsed_1lpw   1   
        11   1   2   .   .   .   .   .   .   .   .   b    3   .   h2'   parsed_1lpw   1   
        12   1   1   .   .   .   .   .   .   .   .   a    4   .   h1'   parsed_1lpw   1   
        12   1   2   .   .   .   .   .   .   .   .   a    4   .   h2'   parsed_1lpw   1   
        13   1   1   .   .   .   .   .   .   .   .   a    3   .   h1'   parsed_1lpw   1   
        13   1   2   .   .   .   .   .   .   .   .   a    3   .   h2'   parsed_1lpw   1   
        14   1   1   .   .   .   .   .   .   .   .   a    2   .   h1'   parsed_1lpw   1   
        14   1   2   .   .   .   .   .   .   .   .   a    2   .   h2'   parsed_1lpw   1   
        15   1   1   .   .   .   .   .   .   .   .   b   10   .   h6    parsed_1lpw   1   
        15   1   2   .   .   .   .   .   .   .   .   b   10   .   h1'   parsed_1lpw   1   
        16   1   1   .   .   .   .   .   .   .   .   b    4   .   h6    parsed_1lpw   1   
        16   1   2   .   .   .   .   .   .   .   .   b    4   .   h1'   parsed_1lpw   1   
        17   1   1   .   .   .   .   .   .   .   .   b    8   .   h1'   parsed_1lpw   1   
        17   1   2   .   .   .   .   .   .   .   .   b    8   .   h8    parsed_1lpw   1   
        18   1   1   .   .   .   .   .   .   .   .   a    9   .   h1'   parsed_1lpw   1   
        18   1   2   .   .   .   .   .   .   .   .   a    9   .   h8    parsed_1lpw   1   
        19   1   1   .   .   .   .   .   .   .   .   a    4   .   h1'   parsed_1lpw   1   
        19   1   2   .   .   .   .   .   .   .   .   a    4   .   h8    parsed_1lpw   1   
        20   1   1   .   .   .   .   .   .   .   .   b    2   .   h1'   parsed_1lpw   1   
        20   1   2   .   .   .   .   .   .   .   .   b    2   .   h8    parsed_1lpw   1   
        21   1   1   .   .   .   .   .   .   .   .   b    5   .   h1'   parsed_1lpw   1   
        21   1   2   .   .   .   .   .   .   .   .   b    5   .   h8    parsed_1lpw   1   
        22   1   1   .   .   .   .   .   .   .   .   b    6   .   h1'   parsed_1lpw   1   
        22   1   2   .   .   .   .   .   .   .   .   b    6   .   h8    parsed_1lpw   1   
        23   1   1   .   .   .   .   .   .   .   .   a    6   .   h1'   parsed_1lpw   1   
        23   1   2   .   .   .   .   .   .   .   .   a    6   .   h8    parsed_1lpw   1   
        24   1   1   .   .   .   .   .   .   .   .   a    3   .   h1'   parsed_1lpw   1   
        24   1   2   .   .   .   .   .   .   .   .   a    3   .   h6    parsed_1lpw   1   
        25   1   1   .   .   .   .   .   .   .   .   a    7   .   h1'   parsed_1lpw   1   
        25   1   2   .   .   .   .   .   .   .   .   a    7   .   h8    parsed_1lpw   1   
        26   1   1   .   .   .   .   .   .   .   .   a    5   .   h1'   parsed_1lpw   1   
        26   1   2   .   .   .   .   .   .   .   .   a    5   .   h6    parsed_1lpw   1   
        27   1   1   .   .   .   .   .   .   .   .   a    8   .   h5    parsed_1lpw   1   
        27   1   2   .   .   .   .   .   .   .   .   a    8   .   h1'   parsed_1lpw   1   
        28   1   1   .   .   .   .   .   .   .   .   b    9   .   h5    parsed_1lpw   1   
        28   1   2   .   .   .   .   .   .   .   .   b    9   .   h1'   parsed_1lpw   1   
        29   1   1   .   .   .   .   .   .   .   .   b    4   .   h5    parsed_1lpw   1   
        29   1   2   .   .   .   .   .   .   .   .   b    4   .   h1'   parsed_1lpw   1   
        30   1   1   .   .   .   .   .   .   .   .   b    7   .   h5    parsed_1lpw   1   
        30   1   2   .   .   .   .   .   .   .   .   b    7   .   h1'   parsed_1lpw   1   
        31   1   1   .   .   .   .   .   .   .   .   b    4   .   h2'   parsed_1lpw   1   
        31   1   2   .   .   .   .   .   .   .   .   b    4   .   h6    parsed_1lpw   1   
        32   1   1   .   .   .   .   .   .   .   .   b    1   .   h2'   parsed_1lpw   1   
        32   1   2   .   .   .   .   .   .   .   .   b    1   .   h6    parsed_1lpw   1   
        33   1   1   .   .   .   .   .   .   .   .   a    4   .   h2'   parsed_1lpw   1   
        33   1   2   .   .   .   .   .   .   .   .   a    4   .   h8    parsed_1lpw   1   
        34   1   1   .   .   .   .   .   .   .   .   b    7   .   h2'   parsed_1lpw   1   
        34   1   2   .   .   .   .   .   .   .   .   b    7   .   h6    parsed_1lpw   1   
        35   1   1   .   .   .   .   .   .   .   .   b   10   .   h2'   parsed_1lpw   1   
        35   1   2   .   .   .   .   .   .   .   .   b   10   .   h6    parsed_1lpw   1   
        36   1   1   .   .   .   .   .   .   .   .   b    2   .   h2'   parsed_1lpw   1   
        36   1   2   .   .   .   .   .   .   .   .   b    2   .   h8    parsed_1lpw   1   
        37   1   1   .   .   .   .   .   .   .   .   b    6   .   h2'   parsed_1lpw   1   
        37   1   2   .   .   .   .   .   .   .   .   b    6   .   h8    parsed_1lpw   1   
        38   1   1   .   .   .   .   .   .   .   .   a    8   .   h2'   parsed_1lpw   1   
        38   1   2   .   .   .   .   .   .   .   .   a    8   .   h6    parsed_1lpw   1   
        39   1   1   .   .   .   .   .   .   .   .   a    5   .   h2'   parsed_1lpw   1   
        39   1   2   .   .   .   .   .   .   .   .   a    5   .   h6    parsed_1lpw   1   
        40   1   1   .   .   .   .   .   .   .   .   b    9   .   h2'   parsed_1lpw   1   
        40   1   2   .   .   .   .   .   .   .   .   b    9   .   h6    parsed_1lpw   1   
        41   1   1   .   .   .   .   .   .   .   .   a    9   .   h2'   parsed_1lpw   1   
        41   1   2   .   .   .   .   .   .   .   .   a    9   .   h8    parsed_1lpw   1   
        42   1   1   .   .   .   .   .   .   .   .   b    5   .   h2'   parsed_1lpw   1   
        42   1   2   .   .   .   .   .   .   .   .   b    5   .   h8    parsed_1lpw   1   
        43   1   1   .   .   .   .   .   .   .   .   a    2   .   h2'   parsed_1lpw   1   
        43   1   2   .   .   .   .   .   .   .   .   a    2   .   h8    parsed_1lpw   1   
        44   1   1   .   .   .   .   .   .   .   .   b    4   .   h2'   parsed_1lpw   1   
        44   1   2   .   .   .   .   .   .   .   .   b    4   .   h5    parsed_1lpw   1   
        45   1   1   .   .   .   .   .   .   .   .   b    1   .   h2'   parsed_1lpw   1   
        45   1   2   .   .   .   .   .   .   .   .   b    1   .   h5    parsed_1lpw   1   
        46   1   1   .   .   .   .   .   .   .   .   b    7   .   h3'   parsed_1lpw   1   
        46   1   2   .   .   .   .   .   .   .   .   b    7   .   h6    parsed_1lpw   1   
        47   1   1   .   .   .   .   .   .   .   .   a    6   .   h3'   parsed_1lpw   1   
        47   1   2   .   .   .   .   .   .   .   .   a    6   .   h8    parsed_1lpw   1   
        48   1   1   .   .   .   .   .   .   .   .   b    4   .   h3'   parsed_1lpw   1   
        48   1   2   .   .   .   .   .   .   .   .   b    4   .   h6    parsed_1lpw   1   
        49   1   1   .   .   .   .   .   .   .   .   a    3   .   h3'   parsed_1lpw   1   
        49   1   2   .   .   .   .   .   .   .   .   a    3   .   h6    parsed_1lpw   1   
        50   1   1   .   .   .   .   .   .   .   .   a    7   .   h3'   parsed_1lpw   1   
        50   1   2   .   .   .   .   .   .   .   .   a    7   .   h8    parsed_1lpw   1   
        51   1   1   .   .   .   .   .   .   .   .   a    4   .   h3'   parsed_1lpw   1   
        51   1   2   .   .   .   .   .   .   .   .   a    4   .   h8    parsed_1lpw   1   
        52   1   1   .   .   .   .   .   .   .   .   b    9   .   h3'   parsed_1lpw   1   
        52   1   2   .   .   .   .   .   .   .   .   b    9   .   h6    parsed_1lpw   1   
        53   1   1   .   .   .   .   .   .   .   .   a    8   .   h3'   parsed_1lpw   1   
        53   1   2   .   .   .   .   .   .   .   .   a    8   .   h6    parsed_1lpw   1   
        54   1   1   .   .   .   .   .   .   .   .   b    1   .   h3'   parsed_1lpw   1   
        54   1   2   .   .   .   .   .   .   .   .   b    1   .   h6    parsed_1lpw   1   
        55   1   1   .   .   .   .   .   .   .   .   b    3   .   h3'   parsed_1lpw   1   
        55   1   2   .   .   .   .   .   .   .   .   b    3   .   h6    parsed_1lpw   1   
        56   1   1   .   .   .   .   .   .   .   .   b    8   .   h8    parsed_1lpw   1   
        56   1   2   .   .   .   .   .   .   .   .   b    8   .   h3'   parsed_1lpw   1   
        57   1   1   .   .   .   .   .   .   .   .   b    1   .   h5    parsed_1lpw   1   
        57   1   2   .   .   .   .   .   .   .   .   b    1   .   h6    parsed_1lpw   1   
        58   1   1   .   .   .   .   .   .   .   .   b    3   .   h5    parsed_1lpw   1   
        58   1   2   .   .   .   .   .   .   .   .   b    3   .   h6    parsed_1lpw   1   
        59   1   1   .   .   .   .   .   .   .   .   b    4   .   h5    parsed_1lpw   1   
        59   1   2   .   .   .   .   .   .   .   .   b    4   .   h6    parsed_1lpw   1   
        60   1   1   .   .   .   .   .   .   .   .   b    7   .   h5    parsed_1lpw   1   
        60   1   2   .   .   .   .   .   .   .   .   b    7   .   h6    parsed_1lpw   1   
        61   1   1   .   .   .   .   .   .   .   .   b    9   .   h5    parsed_1lpw   1   
        61   1   2   .   .   .   .   .   .   .   .   b    9   .   h6    parsed_1lpw   1   
        62   1   1   .   .   .   .   .   .   .   .   b   10   .   h5    parsed_1lpw   1   
        62   1   2   .   .   .   .   .   .   .   .   b   10   .   h6    parsed_1lpw   1   
        63   1   1   .   .   .   .   .   .   .   .   a    3   .   h5    parsed_1lpw   1   
        63   1   2   .   .   .   .   .   .   .   .   a    3   .   h6    parsed_1lpw   1   
        64   1   1   .   .   .   .   .   .   .   .   a    8   .   h5    parsed_1lpw   1   
        64   1   2   .   .   .   .   .   .   .   .   a    8   .   h6    parsed_1lpw   1   
        65   1   1   .   .   .   .   .   .   .   .   a    4   .   h1    parsed_1lpw   1   
        65   1   2   .   .   .   .   .   .   .   .   a    4   .   h22   parsed_1lpw   1   
        66   1   1   .   .   .   .   .   .   .   .   a    4   .   h1    parsed_1lpw   1   
        66   1   2   .   .   .   .   .   .   .   .   a    4   .   h21   parsed_1lpw   1   
        67   1   1   .   .   .   .   .   .   .   .   a    2   .   h1    parsed_1lpw   1   
        67   1   2   .   .   .   .   .   .   .   .   a    2   .   h22   parsed_1lpw   1   
        68   1   1   .   .   .   .   .   .   .   .   a    2   .   h1    parsed_1lpw   1   
        68   1   2   .   .   .   .   .   .   .   .   a    2   .   h21   parsed_1lpw   1   
        69   1   1   .   .   .   .   .   .   .   .   a    7   .   h1    parsed_1lpw   1   
        69   1   2   .   .   .   .   .   .   .   .   a    7   .   h22   parsed_1lpw   1   
        70   1   1   .   .   .   .   .   .   .   .   a    7   .   h1    parsed_1lpw   1   
        70   1   2   .   .   .   .   .   .   .   .   a    7   .   h21   parsed_1lpw   1   
        71   1   1   .   .   .   .   .   .   .   .   b    8   .   h2    parsed_1lpw   1   
        71   1   2   .   .   .   .   .   .   .   .   b    8   .   h62   parsed_1lpw   1   
        72   1   1   .   .   .   .   .   .   .   .   b    3   .   h5    parsed_1lpw   1   
        72   1   2   .   .   .   .   .   .   .   .   b    3   .   h42   parsed_1lpw   1   
        73   1   1   .   .   .   .   .   .   .   .   b    9   .   h5    parsed_1lpw   1   
        73   1   2   .   .   .   .   .   .   .   .   b    9   .   h42   parsed_1lpw   1   
        74   1   1   .   .   .   .   .   .   .   .   b   10   .   h5    parsed_1lpw   1   
        74   1   2   .   .   .   .   .   .   .   .   b   10   .   h42   parsed_1lpw   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   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         2   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         3   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         4   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         5   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         6   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         7   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         8   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
         9   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        10   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        11   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        12   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        13   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        14   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        15   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        16   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        17   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        18   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        19   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        20   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        21   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        22   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        23   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        24   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        25   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        26   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        27   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        28   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        29   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        30   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        31   1   .   .   .   .   .   2.50   1.60   3.00   parsed_1lpw   1   
        32   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        33   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        34   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        35   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        36   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        37   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        38   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        39   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        40   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        41   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        42   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        43   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        44   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        45   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        46   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        47   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        48   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        49   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        50   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        51   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        52   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        53   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        54   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        55   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        56   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        57   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        58   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        59   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        60   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        61   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        62   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        63   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        64   1   .   .   .   .   .   2.50   1.50   3.00   parsed_1lpw   1   
        65   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        66   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        67   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        68   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        69   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        70   1   .   .   .   .   .   4.50   2.50   5.40   parsed_1lpw   1   
        71   1   .   .   .   .   .   5.50   3.00   6.60   parsed_1lpw   1   
        72   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        73   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   1   
        74   1   .   .   .   .   .   3.50   2.00   4.20   parsed_1lpw   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      9     2   57     2   60   parsed_1lpw   1   
         2     10     4   57     4   61   parsed_1lpw   1   
         3     11     6   57     6   61   parsed_1lpw   1   
         4     12     8   57     8   61   parsed_1lpw   1   
         5     13    10   57    10   61   parsed_1lpw   1   
         6     14    12   57    12   61   parsed_1lpw   1   
         7     15    14   57    14   61   parsed_1lpw   1   
         8     16    16   57    16   61   parsed_1lpw   1   
         9     17    18   57    18   61   parsed_1lpw   1   
        10     18    20   57    20   61   parsed_1lpw   1   
        11     19    22   57    22   61   parsed_1lpw   1   
        12    127    24   57    24   62   parsed_1lpw   1   
        13    128    26   57    26   62   parsed_1lpw   1   
        14     64    28   57    28   61   parsed_1lpw   1   
        15     20    31   57    31   61   parsed_1lpw   1   
        16     21    33   57    33   61   parsed_1lpw   1   
        17     22    35   57    35   61   parsed_1lpw   1   
        18     23    37   57    37   61   parsed_1lpw   1   
        19     24    39   57    39   61   parsed_1lpw   1   
        20     25    41   57    41   61   parsed_1lpw   1   
        21     26    43   57    43   61   parsed_1lpw   1   
        22     27    45   57    45   61   parsed_1lpw   1   
        23     28    47   57    47   61   parsed_1lpw   1   
        24     29    49   57    49   61   parsed_1lpw   1   
        25     30    51   57    51   61   parsed_1lpw   1   
        26    118    53   57    53   62   parsed_1lpw   1   
        27    164    56   57    56   62   parsed_1lpw   1   
        28    169    58   57    58   62   parsed_1lpw   1   
        29    164    60   57    60   62   parsed_1lpw   1   
        30    164    62   57    62   62   parsed_1lpw   1   
        31     65    65   57    65   61   parsed_1lpw   1   
        32     66    67   57    67   61   parsed_1lpw   1   
        33     67    69   57    69   61   parsed_1lpw   1   
        34     68    71   57    71   61   parsed_1lpw   1   
        35     70    73   57    73   61   parsed_1lpw   1   
        36     71    75   57    75   61   parsed_1lpw   1   
        37     72    77   57    77   61   parsed_1lpw   1   
        38     76    79   57    79   61   parsed_1lpw   1   
        39     79    81   57    81   61   parsed_1lpw   1   
        40     80    83   57    83   61   parsed_1lpw   1   
        41    109    85   57    85   62   parsed_1lpw   1   
        42    116    87   57    87   62   parsed_1lpw   1   
        43    117    89   57    89   62   parsed_1lpw   1   
        44    119    92   57    92   62   parsed_1lpw   1   
        45    119    94   57    94   62   parsed_1lpw   1   
        46     69    98   57    98   61   parsed_1lpw   1   
        47     73   100   57   100   61   parsed_1lpw   1   
        48     74   102   57   102   61   parsed_1lpw   1   
        49     75   104   57   104   61   parsed_1lpw   1   
        50     77   106   57   106   61   parsed_1lpw   1   
        51    111   108   57   108   62   parsed_1lpw   1   
        52    112   110   57   110   62   parsed_1lpw   1   
        53    113   112   57   112   62   parsed_1lpw   1   
        54    114   114   57   114   62   parsed_1lpw   1   
        55    115   116   57   116   62   parsed_1lpw   1   
        56   
;
137
H5-H6
;
      118   57   120    8   parsed_1lpw   1   
        57     23   123   57   123   61   parsed_1lpw   1   
        58     23   125   57   125   61   parsed_1lpw   1   
        59     23   127   57   127   61   parsed_1lpw   1   
        60     23   129   57   129   61   parsed_1lpw   1   
        61     23   131   57   131   61   parsed_1lpw   1   
        62     23   133   57   133   61   parsed_1lpw   1   
        63     23   135   57   135   61   parsed_1lpw   1   
        64   
;
23
H2O
;
      137   57   139    6   parsed_1lpw   1   
        65     23   142   57   142   61   parsed_1lpw   1   
        66     23   144   57   144   61   parsed_1lpw   1   
        67     23   146   57   146   61   parsed_1lpw   1   
        68     23   148   57   148   61   parsed_1lpw   1   
        69     23   150   57   150   61   parsed_1lpw   1   
        70     23   152   57   152   61   parsed_1lpw   1   
        71     23   155   57   155   61   parsed_1lpw   1   
        72     23   157   57   157   61   parsed_1lpw   1   
        73     23   159   57   159   61   parsed_1lpw   1   
        74     23   161   57   161   61   parsed_1lpw   1   
    stop_

save_





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