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 item_count
570066 2mfo 19556 cing 2-parsed STAR entry full 58


data_2mfo_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2mfo 
    _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_2mfo   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2mfo 
    _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   2mfo   "Master copy"    parsed_2mfo   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2mfo 
    _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   2mfo.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_2mfo   1   
        1   2mfo.mr   .   .    XPLOR/CNS     2    distance                  NOE                 ambi               58   parsed_2mfo   1   
        1   2mfo.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_2mfo   1   
    stop_

save_


save_MR_file_comment_1
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_2mfo 
    _Org_constr_file_comment.ID                  1 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            1 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
*HEADER    PLANT PROTEIN                           14-OCT-13   2MFO              
*TITLE     SOLUTION STRUCTURE OF THE C-TERMINALLY ENCODED PEPTIDE OF THE MODEL   
*TITLE    2 PLANT HOST MEDICAGO TRUNCATULA - CEP1                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CEP1;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: MEDICAGO TRUNCATULA;                            
*SOURCE   4 ORGANISM_TAXID: 3880;                                                
*SOURCE   5 OTHER_DETAILS: SYNTHETIC PEPTIDE WITH MODIFICATION OF HYDROXY-       
*SOURCE   6 PROLINE AT POSITIONS 4 AND 11                                        
*KEYWDS    CEP, MEDICAGO, ROOT-KNOT NEMATODE, CLE, PLANT PROTEIN                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    B.G.BOBAY, P.DIGENNARO, D.MCK. BIRD                                   
*REVDAT   1   11-DEC-13 2MFO    0                                                


;

save_


save_CNS/XPLOR_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2mfo 
    _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   2    .   OR   parsed_2mfo   1   
         1   2    .   3   .    parsed_2mfo   1   
         1   3    .    .   .    parsed_2mfo   1   
         2   1   2    .   OR   parsed_2mfo   1   
         2   2    .   3   .    parsed_2mfo   1   
         2   3    .   4   .    parsed_2mfo   1   
         2   4    .    .   .    parsed_2mfo   1   
         3   1   2    .   OR   parsed_2mfo   1   
         3   2    .   3   .    parsed_2mfo   1   
         3   3    .    .   .    parsed_2mfo   1   
         4   1   2    .   OR   parsed_2mfo   1   
         4   2    .   3   .    parsed_2mfo   1   
         4   3    .    .   .    parsed_2mfo   1   
         5   1   2    .   OR   parsed_2mfo   1   
         5   2    .   3   .    parsed_2mfo   1   
         5   3    .    .   .    parsed_2mfo   1   
         6   1   2    .   OR   parsed_2mfo   1   
         6   2    .   3   .    parsed_2mfo   1   
         6   3    .    .   .    parsed_2mfo   1   
         7   1   2    .   OR   parsed_2mfo   1   
         7   2    .   3   .    parsed_2mfo   1   
         7   3    .   4   .    parsed_2mfo   1   
         7   4    .   5   .    parsed_2mfo   1   
         7   5    .   6   .    parsed_2mfo   1   
         7   6    .   7   .    parsed_2mfo   1   
         7   7    .    .   .    parsed_2mfo   1   
         8   1   2    .   OR   parsed_2mfo   1   
         8   2    .   3   .    parsed_2mfo   1   
         8   3    .    .   .    parsed_2mfo   1   
         9   1   2    .   OR   parsed_2mfo   1   
         9   2    .   3   .    parsed_2mfo   1   
         9   3    .    .   .    parsed_2mfo   1   
        10   1   2    .   OR   parsed_2mfo   1   
        10   2    .   3   .    parsed_2mfo   1   
        10   3    .    .   .    parsed_2mfo   1   
        11   1   2    .   OR   parsed_2mfo   1   
        11   2    .   3   .    parsed_2mfo   1   
        11   3    .    .   .    parsed_2mfo   1   
        12   1   2    .   OR   parsed_2mfo   1   
        12   2    .   3   .    parsed_2mfo   1   
        12   3    .   4   .    parsed_2mfo   1   
        12   4    .   5   .    parsed_2mfo   1   
        12   5    .   6   .    parsed_2mfo   1   
        12   6    .   7   .    parsed_2mfo   1   
        12   7    .    .   .    parsed_2mfo   1   
        13   1   2    .   OR   parsed_2mfo   1   
        13   2    .   3   .    parsed_2mfo   1   
        13   3    .    .   .    parsed_2mfo   1   
        14   1   2    .   OR   parsed_2mfo   1   
        14   2    .   3   .    parsed_2mfo   1   
        14   3    .    .   .    parsed_2mfo   1   
        15   1   2    .   OR   parsed_2mfo   1   
        15   2    .   3   .    parsed_2mfo   1   
        15   3    .    .   .    parsed_2mfo   1   
        16   1    .    .   .    parsed_2mfo   1   
        17   1    .    .   .    parsed_2mfo   1   
        18   1    .    .   .    parsed_2mfo   1   
        19   1    .    .   .    parsed_2mfo   1   
        20   1    .    .   .    parsed_2mfo   1   
        21   1    .    .   .    parsed_2mfo   1   
        22   1    .    .   .    parsed_2mfo   1   
        23   1    .    .   .    parsed_2mfo   1   
        24   1    .    .   .    parsed_2mfo   1   
        25   1    .    .   .    parsed_2mfo   1   
        26   1    .    .   .    parsed_2mfo   1   
        27   1    .    .   .    parsed_2mfo   1   
        28   1    .    .   .    parsed_2mfo   1   
        29   1    .    .   .    parsed_2mfo   1   
        30   1    .    .   .    parsed_2mfo   1   
        31   1    .    .   .    parsed_2mfo   1   
        32   1    .    .   .    parsed_2mfo   1   
        33   1    .    .   .    parsed_2mfo   1   
        34   1    .    .   .    parsed_2mfo   1   
        35   1    .    .   .    parsed_2mfo   1   
        36   1    .    .   .    parsed_2mfo   1   
        37   1    .    .   .    parsed_2mfo   1   
        38   1    .    .   .    parsed_2mfo   1   
        39   1    .    .   .    parsed_2mfo   1   
        40   1    .    .   .    parsed_2mfo   1   
        41   1   2    .   OR   parsed_2mfo   1   
        41   2    .   3   .    parsed_2mfo   1   
        41   3    .   4   .    parsed_2mfo   1   
        41   4    .    .   .    parsed_2mfo   1   
        42   1    .    .   .    parsed_2mfo   1   
        43   1    .    .   .    parsed_2mfo   1   
        44   1    .    .   .    parsed_2mfo   1   
        45   1    .    .   .    parsed_2mfo   1   
        46   1    .    .   .    parsed_2mfo   1   
        47   1    .    .   .    parsed_2mfo   1   
        48   1    .    .   .    parsed_2mfo   1   
        49   1    .    .   .    parsed_2mfo   1   
        50   1    .    .   .    parsed_2mfo   1   
        51   1    .    .   .    parsed_2mfo   1   
        52   1    .    .   .    parsed_2mfo   1   
        53   1    .    .   .    parsed_2mfo   1   
        54   1    .    .   .    parsed_2mfo   1   
        55   1    .    .   .    parsed_2mfo   1   
        56   1    .    .   .    parsed_2mfo   1   
        57   1    .    .   .    parsed_2mfo   1   
        58   1    .    .   .    parsed_2mfo   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   2   1   .   .   .   .   .   .   .   .   "    "     8   .   HN     parsed_2mfo   1   
         1   2   2   .   .   .   .   .   .   .   .   "    "     8   .   HA2    parsed_2mfo   1   
         1   3   1   .   .   .   .   .   .   .   .   "    "     8   .   HN     parsed_2mfo   1   
         1   3   2   .   .   .   .   .   .   .   .   "    "    14   .   HA2    parsed_2mfo   1   
         2   2   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
         2   2   2   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
         2   3   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
         2   3   2   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
         2   4   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
         2   4   2   .   .   .   .   .   .   .   .   "    "     4   .   HG2    parsed_2mfo   1   
         3   2   1   .   .   .   .   .   .   .   .   "    "     9   .   HN     parsed_2mfo   1   
         3   2   2   .   .   .   .   .   .   .   .   "    "     8   .   HA2    parsed_2mfo   1   
         3   3   1   .   .   .   .   .   .   .   .   "    "     9   .   HN     parsed_2mfo   1   
         3   3   2   .   .   .   .   .   .   .   .   "    "    14   .   HA2    parsed_2mfo   1   
         4   2   1   .   .   .   .   .   .   .   .   "    "     3   .   HN     parsed_2mfo   1   
         4   2   2   .   .   .   .   .   .   .   .   "    "     3   .   HA     parsed_2mfo   1   
         4   3   1   .   .   .   .   .   .   .   .   "    "     3   .   HN     parsed_2mfo   1   
         4   3   2   .   .   .   .   .   .   .   .   "    "     2   .   HA     parsed_2mfo   1   
         5   2   1   .   .   .   .   .   .   .   .   "    "     6   .   HN     parsed_2mfo   1   
         5   2   2   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
         5   3   1   .   .   .   .   .   .   .   .   "    "     6   .   HN     parsed_2mfo   1   
         5   3   2   .   .   .   .   .   .   .   .   "    "     6   .   HB     parsed_2mfo   1   
         6   2   1   .   .   .   .   .   .   .   .   "    "    10   .   HN     parsed_2mfo   1   
         6   2   2   .   .   .   .   .   .   .   .   "    "    10   .   HB1    parsed_2mfo   1   
         6   3   1   .   .   .   .   .   .   .   .   "    "    10   .   HN     parsed_2mfo   1   
         6   3   2   .   .   .   .   .   .   .   .   "    "    10   .   HB2    parsed_2mfo   1   
         7   2   1   .   .   .   .   .   .   .   .   "    "     6   .   HB     parsed_2mfo   1   
         7   2   2   .   .   .   .   .   .   .   .   "    "     6   .   HG21   parsed_2mfo   1   
         7   3   1   .   .   .   .   .   .   .   .   "    "     6   .   HB     parsed_2mfo   1   
         7   3   2   .   .   .   .   .   .   .   .   "    "     6   .   HG22   parsed_2mfo   1   
         7   4   1   .   .   .   .   .   .   .   .   "    "     6   .   HB     parsed_2mfo   1   
         7   4   2   .   .   .   .   .   .   .   .   "    "     6   .   HG23   parsed_2mfo   1   
         7   5   1   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
         7   5   2   .   .   .   .   .   .   .   .   "    "     5   .   HG21   parsed_2mfo   1   
         7   6   1   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
         7   6   2   .   .   .   .   .   .   .   .   "    "     5   .   HG22   parsed_2mfo   1   
         7   7   1   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
         7   7   2   .   .   .   .   .   .   .   .   "    "     5   .   HG23   parsed_2mfo   1   
         8   2   1   .   .   .   .   .   .   .   .   "    "     4   .   HD2    parsed_2mfo   1   
         8   2   2   .   .   .   .   .   .   .   .   "    "     3   .   HA     parsed_2mfo   1   
         8   3   1   .   .   .   .   .   .   .   .   "    "     7   .   HD2    parsed_2mfo   1   
         8   3   2   .   .   .   .   .   .   .   .   "    "     6   .   HA     parsed_2mfo   1   
         9   2   1   .   .   .   .   .   .   .   .   "    "     7   .   HD1    parsed_2mfo   1   
         9   2   2   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
         9   3   1   .   .   .   .   .   .   .   .   "    "    11   .   HD2    parsed_2mfo   1   
         9   3   2   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        10   2   1   .   .   .   .   .   .   .   .   "    "     2   .   HB1    parsed_2mfo   1   
        10   2   2   .   .   .   .   .   .   .   .   "    "     2   .   HA     parsed_2mfo   1   
        10   3   1   .   .   .   .   .   .   .   .   "    "     4   .   HB2    parsed_2mfo   1   
        10   3   2   .   .   .   .   .   .   .   .   "    "     4   .   HA     parsed_2mfo   1   
        11   2   1   .   .   .   .   .   .   .   .   "    "     3   .   HB2    parsed_2mfo   1   
        11   2   2   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
        11   3   1   .   .   .   .   .   .   .   .   "    "     4   .   HB2    parsed_2mfo   1   
        11   3   2   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        12   2   1   .   .   .   .   .   .   .   .   "    "     4   .   HG2    parsed_2mfo   1   
        12   2   2   .   .   .   .   .   .   .   .   "    "     3   .   HA     parsed_2mfo   1   
        12   3   1   .   .   .   .   .   .   .   .   "    "     4   .   HG2    parsed_2mfo   1   
        12   3   2   .   .   .   .   .   .   .   .   "    "     4   .   HA     parsed_2mfo   1   
        12   4   1   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
        12   4   2   .   .   .   .   .   .   .   .   "    "     6   .   HA     parsed_2mfo   1   
        12   5   1   .   .   .   .   .   .   .   .   "    "     7   .   HG1    parsed_2mfo   1   
        12   5   2   .   .   .   .   .   .   .   .   "    "     6   .   HA     parsed_2mfo   1   
        12   6   1   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        12   6   2   .   .   .   .   .   .   .   .   "    "     4   .   HA     parsed_2mfo   1   
        12   7   1   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        12   7   2   .   .   .   .   .   .   .   .   "    "    11   .   HA     parsed_2mfo   1   
        13   2   1   .   .   .   .   .   .   .   .   "    "     4   .   HB2    parsed_2mfo   1   
        13   2   2   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        13   3   1   .   .   .   .   .   .   .   .   "    "     4   .   HG2    parsed_2mfo   1   
        13   3   2   .   .   .   .   .   .   .   .   "    "     4   .   HB2    parsed_2mfo   1   
        14   2   1   .   .   .   .   .   .   .   .   "    "    11   .   HB2    parsed_2mfo   1   
        14   2   2   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        14   3   1   .   .   .   .   .   .   .   .   "    "     3   .   HB2    parsed_2mfo   1   
        14   3   2   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
        15   2   1   .   .   .   .   .   .   .   .   "    "     3   .   HN     parsed_2mfo   1   
        15   2   2   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        15   3   1   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        15   3   2   .   .   .   .   .   .   .   .   "    "     6   .   HN     parsed_2mfo   1   
        16   1   1   .   .   .   .   .   .   .   .   "    "     2   .   HN     parsed_2mfo   1   
        16   1   2   .   .   .   .   .   .   .   .   "    "     2   .   HA     parsed_2mfo   1   
        17   1   1   .   .   .   .   .   .   .   .   "    "     2   .   HN     parsed_2mfo   1   
        17   1   2   .   .   .   .   .   .   .   .   "    "     1   .   HA     parsed_2mfo   1   
        18   1   1   .   .   .   .   .   .   .   .   "    "     8   .   HN     parsed_2mfo   1   
        18   1   2   .   .   .   .   .   .   .   .   "    "    15   .   HA     parsed_2mfo   1   
        19   1   1   .   .   .   .   .   .   .   .   "    "    12   .   HN     parsed_2mfo   1   
        19   1   2   .   .   .   .   .   .   .   .   "    "    13   .   HA     parsed_2mfo   1   
        20   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        20   1   2   .   .   .   .   .   .   .   .   "    "     5   .   HG21   parsed_2mfo   1   
        21   1   1   .   .   .   .   .   .   .   .   "    "     6   .   HN     parsed_2mfo   1   
        21   1   2   .   .   .   .   .   .   .   .   "    "     6   .   HG21   parsed_2mfo   1   
        22   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        22   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        23   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        23   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HB2    parsed_2mfo   1   
        24   1   1   .   .   .   .   .   .   .   .   "    "    14   .   HN     parsed_2mfo   1   
        24   1   2   .   .   .   .   .   .   .   .   "    "    14   .   HA2    parsed_2mfo   1   
        25   1   1   .   .   .   .   .   .   .   .   "    "    14   .   HN     parsed_2mfo   1   
        25   1   2   .   .   .   .   .   .   .   .   "    "     7   .   HA     parsed_2mfo   1   
        26   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        26   1   2   .   .   .   .   .   .   .   .   "    "     4   .   HA     parsed_2mfo   1   
        27   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        27   1   2   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
        28   1   1   .   .   .   .   .   .   .   .   "    "     6   .   HN     parsed_2mfo   1   
        28   1   2   .   .   .   .   .   .   .   .   "    "     5   .   HA     parsed_2mfo   1   
        29   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HN     parsed_2mfo   1   
        29   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG1    parsed_2mfo   1   
        30   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HN     parsed_2mfo   1   
        30   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        31   1   1   .   .   .   .   .   .   .   .   "    "    13   .   HN     parsed_2mfo   1   
        31   1   2   .   .   .   .   .   .   .   .   "    "    13   .   HB     parsed_2mfo   1   
        32   1   1   .   .   .   .   .   .   .   .   "    "    13   .   HN     parsed_2mfo   1   
        32   1   2   .   .   .   .   .   .   .   .   "    "    14   .   HA2    parsed_2mfo   1   
        33   1   1   .   .   .   .   .   .   .   .   "    "     1   .   HT3    parsed_2mfo   1   
        33   1   2   .   .   .   .   .   .   .   .   "    "     5   .   HA     parsed_2mfo   1   
        34   1   1   .   .   .   .   .   .   .   .   "    "    10   .   HN     parsed_2mfo   1   
        34   1   2   .   .   .   .   .   .   .   .   "    "     9   .   HB2    parsed_2mfo   1   
        35   1   1   .   .   .   .   .   .   .   .   "    "     9   .   HN     parsed_2mfo   1   
        35   1   2   .   .   .   .   .   .   .   .   "    "    14   .   HA2    parsed_2mfo   1   
        36   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HA     parsed_2mfo   1   
        36   1   2   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        37   1   1   .   .   .   .   .   .   .   .   "    "    13   .   HA     parsed_2mfo   1   
        37   1   2   .   .   .   .   .   .   .   .   "    "    13   .   HN     parsed_2mfo   1   
        38   1   1   .   .   .   .   .   .   .   .   "    "     8   .   HA2    parsed_2mfo   1   
        38   1   2   .   .   .   .   .   .   .   .   "    "    15   .   HN     parsed_2mfo   1   
        39   1   1   .   .   .   .   .   .   .   .   "    "     8   .   HN     parsed_2mfo   1   
        39   1   2   .   .   .   .   .   .   .   .   "    "     8   .   HA2    parsed_2mfo   1   
        40   1   1   .   .   .   .   .   .   .   .   "    "    12   .   HA2    parsed_2mfo   1   
        40   1   2   .   .   .   .   .   .   .   .   "    "    12   .   HN     parsed_2mfo   1   
        41   2   1   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
        41   2   2   .   .   .   .   .   .   .   .   "    "     5   .   HG21   parsed_2mfo   1   
        41   3   1   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
        41   3   2   .   .   .   .   .   .   .   .   "    "     5   .   HG22   parsed_2mfo   1   
        41   4   1   .   .   .   .   .   .   .   .   "    "     5   .   HB     parsed_2mfo   1   
        41   4   2   .   .   .   .   .   .   .   .   "    "     5   .   HG23   parsed_2mfo   1   
        42   1   1   .   .   .   .   .   .   .   .   "    "    13   .   HA     parsed_2mfo   1   
        42   1   2   .   .   .   .   .   .   .   .   "    "    13   .   HB     parsed_2mfo   1   
        43   1   1   .   .   .   .   .   .   .   .   "    "     7   .   HD1    parsed_2mfo   1   
        43   1   2   .   .   .   .   .   .   .   .   "    "     6   .   HA     parsed_2mfo   1   
        44   1   1   .   .   .   .   .   .   .   .   "    "    15   .   HB1    parsed_2mfo   1   
        44   1   2   .   .   .   .   .   .   .   .   "    "    15   .   HB2    parsed_2mfo   1   
        45   1   1   .   .   .   .   .   .   .   .   "    "     2   .   HN     parsed_2mfo   1   
        45   1   2   .   .   .   .   .   .   .   .   "    "     2   .   HB2    parsed_2mfo   1   
        46   1   1   .   .   .   .   .   .   .   .   "    "     9   .   HN     parsed_2mfo   1   
        46   1   2   .   .   .   .   .   .   .   .   "    "     9   .   HB2    parsed_2mfo   1   
        47   1   1   .   .   .   .   .   .   .   .   "    "     9   .   HN     parsed_2mfo   1   
        47   1   2   .   .   .   .   .   .   .   .   "    "     9   .   HB1    parsed_2mfo   1   
        48   1   1   .   .   .   .   .   .   .   .   "    "     5   .   HN     parsed_2mfo   1   
        48   1   2   .   .   .   .   .   .   .   .   "    "     4   .   HB2    parsed_2mfo   1   
        49   1   1   .   .   .   .   .   .   .   .   "    "     4   .   HB2    parsed_2mfo   1   
        49   1   2   .   .   .   .   .   .   .   .   "    "    11   .   HG2    parsed_2mfo   1   
        50   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HB2    parsed_2mfo   1   
        50   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG1    parsed_2mfo   1   
        51   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HB2    parsed_2mfo   1   
        51   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        52   1   1   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
        52   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        53   1   1   .   .   .   .   .   .   .   .   "    "     7   .   HG2    parsed_2mfo   1   
        53   1   2   .   .   .   .   .   .   .   .   "    "    15   .   HN     parsed_2mfo   1   
        54   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        54   1   2   .   .   .   .   .   .   .   .   "    "     3   .   HG1    parsed_2mfo   1   
        55   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HG2    parsed_2mfo   1   
        55   1   2   .   .   .   .   .   .   .   .   "    "     7   .   HD1    parsed_2mfo   1   
        56   1   1   .   .   .   .   .   .   .   .   "    "     7   .   HB1    parsed_2mfo   1   
        56   1   2   .   .   .   .   .   .   .   .   "    "     7   .   HA     parsed_2mfo   1   
        57   1   1   .   .   .   .   .   .   .   .   "    "     4   .   HG2    parsed_2mfo   1   
        57   1   2   .   .   .   .   .   .   .   .   "    "     4   .   HD2    parsed_2mfo   1   
        58   1   1   .   .   .   .   .   .   .   .   "    "     3   .   HG1    parsed_2mfo   1   
        58   1   2   .   .   .   .   .   .   .   .   "    "     7   .   HB2    parsed_2mfo   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   2   .   .   .   .   .   2.548   1.737   3.359   parsed_2mfo   1   
         1   3   .   .   .   .   .   2.548   1.737   3.359   parsed_2mfo   1   
         2   2   .   .   .   .   .   3.062   1.890   4.234   parsed_2mfo   1   
         2   3   .   .   .   .   .   3.062   1.890   4.234   parsed_2mfo   1   
         2   4   .   .   .   .   .   3.062   1.890   4.234   parsed_2mfo   1   
         3   2   .   .   .   .   .   2.331   1.652   3.010   parsed_2mfo   1   
         3   3   .   .   .   .   .   2.331   1.652   3.010   parsed_2mfo   1   
         4   2   .   .   .   .   .   2.169   1.581   2.757   parsed_2mfo   1   
         4   3   .   .   .   .   .   2.169   1.581   2.757   parsed_2mfo   1   
         5   2   .   .   .   .   .   2.778   1.813   3.743   parsed_2mfo   1   
         5   3   .   .   .   .   .   2.778   1.813   3.743   parsed_2mfo   1   
         6   2   .   .   .   .   .   3.551   1.975   5.127   parsed_2mfo   1   
         6   3   .   .   .   .   .   3.551   1.975   5.127   parsed_2mfo   1   
         7   2   .   .   .   .   .   2.916   1.853   3.979   parsed_2mfo   1   
         7   3   .   .   .   .   .   2.916   1.853   3.979   parsed_2mfo   1   
         7   4   .   .   .   .   .   2.916   1.853   3.979   parsed_2mfo   1   
         7   5   .   .   .   .   .   2.916   1.853   3.979   parsed_2mfo   1   
         7   6   .   .   .   .   .   2.916   1.853   3.979   parsed_2mfo   1   
         7   7   .   .   .   .   .   2.916   1.853   3.979   parsed_2mfo   1   
         8   2   .   .   .   .   .   2.212   1.601   2.823   parsed_2mfo   1   
         8   3   .   .   .   .   .   2.212   1.601   2.823   parsed_2mfo   1   
         9   2   .   .   .   .   .   3.182   1.916   4.448   parsed_2mfo   1   
         9   3   .   .   .   .   .   3.182   1.916   4.448   parsed_2mfo   1   
        10   2   .   .   .   .   .   2.476   1.710   3.242   parsed_2mfo   1   
        10   3   .   .   .   .   .   2.476   1.710   3.242   parsed_2mfo   1   
        11   2   .   .   .   .   .   2.185   1.588   2.782   parsed_2mfo   1   
        11   3   .   .   .   .   .   2.185   1.588   2.782   parsed_2mfo   1   
        12   2   .   .   .   .   .   2.580   1.748   3.412   parsed_2mfo   1   
        12   3   .   .   .   .   .   2.580   1.748   3.412   parsed_2mfo   1   
        12   4   .   .   .   .   .   2.580   1.748   3.412   parsed_2mfo   1   
        12   5   .   .   .   .   .   2.580   1.748   3.412   parsed_2mfo   1   
        12   6   .   .   .   .   .   2.580   1.748   3.412   parsed_2mfo   1   
        12   7   .   .   .   .   .   2.580   1.748   3.412   parsed_2mfo   1   
        13   2   .   .   .   .   .   2.130   1.563   2.697   parsed_2mfo   1   
        13   3   .   .   .   .   .   2.130   1.563   2.697   parsed_2mfo   1   
        14   2   .   .   .   .   .   2.234   1.610   2.858   parsed_2mfo   1   
        14   3   .   .   .   .   .   2.234   1.610   2.858   parsed_2mfo   1   
        15   2   .   .   .   .   .   3.312   1.941   4.683   parsed_2mfo   1   
        15   3   .   .   .   .   .   3.312   1.941   4.683   parsed_2mfo   1   
        16   1   .   .   .   .   .   4.164   1.997   6.331   parsed_2mfo   1   
        17   1   .   .   .   .   .   2.745   1.803   3.687   parsed_2mfo   1   
        18   1   .   .   .   .   .   2.347   1.659   3.035   parsed_2mfo   1   
        19   1   .   .   .   .   .   2.803   1.800   6.000   parsed_2mfo   1   
        20   1   .   .   .   .   .   2.478   1.711   3.245   parsed_2mfo   1   
        21   1   .   .   .   .   .   2.349   1.659   3.039   parsed_2mfo   1   
        22   1   .   .   .   .   .   2.825   1.828   3.822   parsed_2mfo   1   
        23   1   .   .   .   .   .   3.441   1.961   4.921   parsed_2mfo   1   
        24   1   .   .   .   .   .   2.307   1.642   2.972   parsed_2mfo   1   
        25   1   .   .   .   .   .   2.182   1.800   6.000   parsed_2mfo   1   
        26   1   .   .   .   .   .   2.051   1.525   2.577   parsed_2mfo   1   
        27   1   .   .   .   .   .   3.295   1.938   4.652   parsed_2mfo   1   
        28   1   .   .   .   .   .   2.131   1.563   2.699   parsed_2mfo   1   
        29   1   .   .   .   .   .   2.632   1.766   3.498   parsed_2mfo   1   
        30   1   .   .   .   .   .   3.254   1.930   4.578   parsed_2mfo   1   
        31   1   .   .   .   .   .   3.053   1.888   4.218   parsed_2mfo   1   
        32   1   .   .   .   .   .   2.753   1.800   6.000   parsed_2mfo   1   
        33   1   .   .   .   .   .   3.690   1.988   5.392   parsed_2mfo   1   
        34   1   .   .   .   .   .   4.000   2.000   6.000   parsed_2mfo   1   
        35   1   .   .   .   .   .   2.631   1.766   3.496   parsed_2mfo   1   
        36   1   .   .   .   .   .   3.793   1.994   5.592   parsed_2mfo   1   
        37   1   .   .   .   .   .   3.400   1.955   4.845   parsed_2mfo   1   
        38   1   .   .   .   .   .   3.350   1.947   4.753   parsed_2mfo   1   
        39   1   .   .   .   .   .   2.703   1.790   3.616   parsed_2mfo   1   
        40   1   .   .   .   .   .   3.739   1.992   5.486   parsed_2mfo   1   
        41   2   .   .   .   .   .   2.679   1.782   3.576   parsed_2mfo   1   
        41   3   .   .   .   .   .   2.679   1.782   3.576   parsed_2mfo   1   
        41   4   .   .   .   .   .   2.679   1.782   3.576   parsed_2mfo   1   
        42   1   .   .   .   .   .   3.853   1.998   5.708   parsed_2mfo   1   
        43   1   .   .   .   .   .   2.903   1.850   3.956   parsed_2mfo   1   
        44   1   .   .   .   .   .   1.679   1.327   2.031   parsed_2mfo   1   
        45   1   .   .   .   .   .   3.178   1.916   4.440   parsed_2mfo   1   
        46   1   .   .   .   .   .   3.197   1.920   4.474   parsed_2mfo   1   
        47   1   .   .   .   .   .   2.863   1.838   3.888   parsed_2mfo   1   
        48   1   .   .   .   .   .   3.204   1.921   4.487   parsed_2mfo   1   
        49   1   .   .   .   .   .   2.093   1.546   2.640   parsed_2mfo   1   
        50   1   .   .   .   .   .   3.019   1.880   4.158   parsed_2mfo   1   
        51   1   .   .   .   .   .   2.068   1.533   2.603   parsed_2mfo   1   
        52   1   .   .   .   .   .   2.374   1.669   3.079   parsed_2mfo   1   
        53   1   .   .   .   .   .   3.017   1.879   4.155   parsed_2mfo   1   
        54   1   .   .   .   .   .   1.987   1.494   2.480   parsed_2mfo   1   
        55   1   .   .   .   .   .   3.691   1.988   5.394   parsed_2mfo   1   
        56   1   .   .   .   .   .   3.821   1.996   5.646   parsed_2mfo   1   
        57   1   .   .   .   .   .   4.139   1.998   6.280   parsed_2mfo   1   
        58   1   .   .   .   .   .   3.530   1.973   5.087   parsed_2mfo   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   "spec=noesy_300ms, no=4, id=4, vol=1.816045e+03"       1   127    1   175   parsed_2mfo   1   
         2   "spec=noesy_300ms, no=9, id=9, vol=6.018966e+02"       3   127    3   175   parsed_2mfo   1   
         3   "spec=noesy_300ms, no=18, id=18, vol=3.091220e+03"     6   127    6   177   parsed_2mfo   1   
         4   "spec=noesy_300ms, no=19, id=19, vol=4.761451e+03"     8   127    8   177   parsed_2mfo   1   
         5   "spec=noesy_300ms, no=21, id=21, vol=1.079472e+03"    10   127   10   177   parsed_2mfo   1   
         6   "spec=noesy_300ms, no=28, id=28, vol=2.477839e+02"    12   127   12   177   parsed_2mfo   1   
         7   "spec=noesy_300ms, no=43, id=42, vol=8.076169e+02"    14   127   14   177   parsed_2mfo   1   
         8   "spec=noesy_300ms, no=46, id=45, vol=4.242001e+03"    20   127   20   177   parsed_2mfo   1   
         9   "spec=noesy_300ms, no=50, id=46, vol=4.784346e+02"    22   127   22   177   parsed_2mfo   1   
        10   "spec=noesy_300ms, no=60, id=52, vol=2.154293e+03"    24   127   24   177   parsed_2mfo   1   
        11   "spec=noesy_300ms, no=64, id=54, vol=4.566457e+03"    26   127   26   177   parsed_2mfo   1   
        12   "spec=noesy_300ms, no=67, id=57, vol=1.683139e+03"    28   127   28   177   parsed_2mfo   1   
        13   "spec=noesy_300ms, no=69, id=59, vol=5.309807e+03"    34   127   34   177   parsed_2mfo   1   
        14   "spec=noesy_300ms, no=70, id=60, vol=3.995469e+03"    36   127   36   177   parsed_2mfo   1   
        15   "spec=noesy_300ms, no=74, id=63, vol=3.760891e+02"    38   127   38   177   parsed_2mfo   1   
        16   "spec=noesy_300ms, no=0, id=0, vol=9.525598e+01"      40   127   40   175   parsed_2mfo   1   
        17   "spec=noesy_300ms, no=1, id=1, vol=1.160118e+03"      41   127   41   175   parsed_2mfo   1   
        18   "spec=noesy_300ms, no=3, id=3, vol=2.972429e+03"      42   127   42   175   parsed_2mfo   1   
        19   "spec=noesy_300ms, no=5, id=5, vol=1.023647e+03"      43   127   43   175   parsed_2mfo   1   
        20   "spec=noesy_300ms, no=6, id=6, vol=2.145841e+03"      44   127   44   175   parsed_2mfo   1   
        21   "spec=noesy_300ms, no=7, id=7, vol=2.952132e+03"      45   127   45   175   parsed_2mfo   1   
        22   "spec=noesy_300ms, no=8, id=8, vol=9.775608e+02"      46   127   46   175   parsed_2mfo   1   
        23   "spec=noesy_300ms, no=10, id=10, vol=2.990211e+02"    47   127   47   177   parsed_2mfo   1   
        24   "spec=noesy_300ms, no=12, id=12, vol=3.294418e+03"    48   127   48   177   parsed_2mfo   1   
        25   "spec=noesy_300ms, no=13, id=13, vol=4.596512e+03"    49   127   49   177   parsed_2mfo   1   
        26   "spec=noesy_300ms, no=14, id=14, vol=6.662370e+03"    50   127   50   177   parsed_2mfo   1   
        27   "spec=noesy_300ms, no=15, id=15, vol=3.882345e+02"    51   127   51   177   parsed_2mfo   1   
        28   "spec=noesy_300ms, no=20, id=20, vol=5.301626e+03"    52   127   52   177   parsed_2mfo   1   
        29   "spec=noesy_300ms, no=22, id=22, vol=1.494044e+03"    53   127   53   177   parsed_2mfo   1   
        30   "spec=noesy_300ms, no=23, id=23, vol=4.180225e+02"    54   127   54   177   parsed_2mfo   1   
        31   "spec=noesy_300ms, no=24, id=24, vol=6.136197e+02"    55   127   55   177   parsed_2mfo   1   
        32   "spec=noesy_300ms, no=25, id=25, vol=1.140197e+03"    56   127   56   177   parsed_2mfo   1   
        33   "spec=noesy_300ms, no=26, id=26, vol=1.965813e+02"    57   127   57   177   parsed_2mfo   1   
        34   "spec=noesy_300ms, no=27, id=27, vol=1.212351e+02"    58   127   58   177   parsed_2mfo   1   
        35   "spec=noesy_300ms, no=32, id=32, vol=1.497984e+03"    59   127   59   177   parsed_2mfo   1   
        36   "spec=noesy_300ms, no=33, id=33, vol=1.666771e+02"    60   127   60   177   parsed_2mfo   1   
        37   "spec=noesy_300ms, no=36, id=36, vol=3.213223e+02"    61   127   61   177   parsed_2mfo   1   
        38   "spec=noesy_300ms, no=38, id=38, vol=3.512018e+02"    62   127   62   177   parsed_2mfo   1   
        39   "spec=noesy_300ms, no=39, id=39, vol=1.272619e+03"    63   127   63   177   parsed_2mfo   1   
        40   "spec=noesy_300ms, no=41, id=41, vol=1.343096e+03"    65   127   65   177   parsed_2mfo   1   
        41   "spec=noesy_300ms, no=40, id=40, vol=1.818241e+02"    64   127   64   177   parsed_2mfo   1   
        42   "spec=noesy_300ms, no=44, id=43, vol=1.517876e+02"    68   127   68   177   parsed_2mfo   1   
        43   "spec=noesy_300ms, no=45, id=44, vol=8.302312e+02"    69   127   69   177   parsed_2mfo   1   
        44   "spec=noesy_300ms, no=52, id=47, vol=2.217165e+04"    70   127   70   177   parsed_2mfo   1   
        45   "spec=noesy_300ms, no=56, id=48, vol=4.818916e+02"    71   127   71   177   parsed_2mfo   1   
        46   "spec=noesy_300ms, no=57, id=49, vol=4.652965e+02"    72   127   72   177   parsed_2mfo   1   
        47   "spec=noesy_300ms, no=58, id=50, vol=9.017086e+02"    73   127   73   177   parsed_2mfo   1   
        48   "spec=noesy_300ms, no=59, id=51, vol=4.589437e+02"    74   127   74   177   parsed_2mfo   1   
        49   "spec=noesy_300ms, no=62, id=53, vol=5.910746e+03"    75   127   75   177   parsed_2mfo   1   
        50   "spec=noesy_300ms, no=65, id=55, vol=6.558028e+02"    76   127   76   177   parsed_2mfo   1   
        51   "spec=noesy_300ms, no=66, id=56, vol=6.346321e+03"    77   127   77   177   parsed_2mfo   1   
        52   "spec=noesy_300ms, no=72, id=61, vol=2.769851e+03"    78   127   78   177   parsed_2mfo   1   
        53   "spec=noesy_300ms, no=73, id=62, vol=6.582287e+02"    79   127   79   177   parsed_2mfo   1   
        54   "spec=noesy_300ms, no=77, id=66, vol=8.071985e+03"    80   127   80   177   parsed_2mfo   1   
        55   "spec=noesy_300ms, no=79, id=68, vol=1.963229e+02"    81   127   81   177   parsed_2mfo   1   
        56   "spec=noesy_300ms, no=80, id=69, vol=1.595237e+02"    82   127   82   177   parsed_2mfo   1   
        57   "spec=noesy_300ms, no=81, id=70, vol=9.877696e+01"    83   127   83   177   parsed_2mfo   1   
        58   "spec=noesy_300ms, no=83, id=72, vol=2.567265e+02"    84   127   84   177   parsed_2mfo   1   
    stop_

save_





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