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
624259 6ey3 34198 cing 2-parsed STAR entry full 85


data_6ey3_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_6ey3 
    _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_6ey3   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_6ey3 
    _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   6ey3   "Master copy"    parsed_6ey3   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_6ey3 
    _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   6ey3.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_6ey3   1   
        1   6ey3.mr   .   .    DYANA/DIANA   2    distance                  NOE                 simple             85   parsed_6ey3   1   
        1   6ey3.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_6ey3   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_6ey3 
    _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    PEPTIDE BINDING PROTEIN                 10-NOV-17   6EY3              
*TITLE     MF2                                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYS-ARG-PRO-LEU-TRP-THR-ALA-CYS-GLY;                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_TAXID: 9606                                                 
*KEYWDS    STRUCTURE FROM CYANA 2.1, PEPTIDE BINDING PROTEIN                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    40                                                                    
*AUTHOR    L.CALVANESE,L.FALCIGNO,G.D'AURIA,F.COPPOLA                            
*REVDAT   1   17-JAN-18 6EY3    0                                                
;

save_


save_DYANA/DIANA_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_6ey3 
    _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_6ey3   1   
         2   1   .   .   .   parsed_6ey3   1   
         3   1   .   .   .   parsed_6ey3   1   
         4   1   .   .   .   parsed_6ey3   1   
         5   1   .   .   .   parsed_6ey3   1   
         6   1   .   .   .   parsed_6ey3   1   
         7   1   .   .   .   parsed_6ey3   1   
         8   1   .   .   .   parsed_6ey3   1   
         9   1   .   .   .   parsed_6ey3   1   
        10   1   .   .   .   parsed_6ey3   1   
        11   1   .   .   .   parsed_6ey3   1   
        12   1   .   .   .   parsed_6ey3   1   
        13   1   .   .   .   parsed_6ey3   1   
        14   1   .   .   .   parsed_6ey3   1   
        15   1   .   .   .   parsed_6ey3   1   
        16   1   .   .   .   parsed_6ey3   1   
        17   1   .   .   .   parsed_6ey3   1   
        18   1   .   .   .   parsed_6ey3   1   
        19   1   .   .   .   parsed_6ey3   1   
        20   1   .   .   .   parsed_6ey3   1   
        21   1   .   .   .   parsed_6ey3   1   
        22   1   .   .   .   parsed_6ey3   1   
        23   1   .   .   .   parsed_6ey3   1   
        24   1   .   .   .   parsed_6ey3   1   
        25   1   .   .   .   parsed_6ey3   1   
        26   1   .   .   .   parsed_6ey3   1   
        27   1   .   .   .   parsed_6ey3   1   
        28   1   .   .   .   parsed_6ey3   1   
        29   1   .   .   .   parsed_6ey3   1   
        30   1   .   .   .   parsed_6ey3   1   
        31   1   .   .   .   parsed_6ey3   1   
        32   1   .   .   .   parsed_6ey3   1   
        33   1   .   .   .   parsed_6ey3   1   
        34   1   .   .   .   parsed_6ey3   1   
        35   1   .   .   .   parsed_6ey3   1   
        36   1   .   .   .   parsed_6ey3   1   
        37   1   .   .   .   parsed_6ey3   1   
        38   1   .   .   .   parsed_6ey3   1   
        39   1   .   .   .   parsed_6ey3   1   
        40   1   .   .   .   parsed_6ey3   1   
        41   1   .   .   .   parsed_6ey3   1   
        42   1   .   .   .   parsed_6ey3   1   
        43   1   .   .   .   parsed_6ey3   1   
        44   1   .   .   .   parsed_6ey3   1   
        45   1   .   .   .   parsed_6ey3   1   
        46   1   .   .   .   parsed_6ey3   1   
        47   1   .   .   .   parsed_6ey3   1   
        48   1   .   .   .   parsed_6ey3   1   
        49   1   .   .   .   parsed_6ey3   1   
        50   1   .   .   .   parsed_6ey3   1   
        51   1   .   .   .   parsed_6ey3   1   
        52   1   .   .   .   parsed_6ey3   1   
        53   1   .   .   .   parsed_6ey3   1   
        54   1   .   .   .   parsed_6ey3   1   
        55   1   .   .   .   parsed_6ey3   1   
        56   1   .   .   .   parsed_6ey3   1   
        57   1   .   .   .   parsed_6ey3   1   
        58   1   .   .   .   parsed_6ey3   1   
        59   1   .   .   .   parsed_6ey3   1   
        60   1   .   .   .   parsed_6ey3   1   
        61   1   .   .   .   parsed_6ey3   1   
        62   1   .   .   .   parsed_6ey3   1   
        63   1   .   .   .   parsed_6ey3   1   
        64   1   .   .   .   parsed_6ey3   1   
        65   1   .   .   .   parsed_6ey3   1   
        66   1   .   .   .   parsed_6ey3   1   
        67   1   .   .   .   parsed_6ey3   1   
        68   1   .   .   .   parsed_6ey3   1   
        69   1   .   .   .   parsed_6ey3   1   
        70   1   .   .   .   parsed_6ey3   1   
        71   1   .   .   .   parsed_6ey3   1   
        72   1   .   .   .   parsed_6ey3   1   
        73   1   .   .   .   parsed_6ey3   1   
        74   1   .   .   .   parsed_6ey3   1   
        75   1   .   .   .   parsed_6ey3   1   
        76   1   .   .   .   parsed_6ey3   1   
        77   1   .   .   .   parsed_6ey3   1   
        78   1   .   .   .   parsed_6ey3   1   
        79   1   .   .   .   parsed_6ey3   1   
        80   1   .   .   .   parsed_6ey3   1   
        81   1   .   .   .   parsed_6ey3   1   
        82   1   .   .   .   parsed_6ey3   1   
        83   1   .   .   .   parsed_6ey3   1   
        84   1   .   .   .   parsed_6ey3   1   
        85   1   .   .   .   parsed_6ey3   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   .   .   .   .   .   .   .   .   .   1   CYSS   HA    parsed_6ey3   1   
         1   1   2   .   .   .   .   .   .   .   .   .   1   CYSS   QB    parsed_6ey3   1   
         2   1   1   .   .   .   .   .   .   .   .   .   1   CYSS   HA    parsed_6ey3   1   
         2   1   2   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         3   1   1   .   .   .   .   .   .   .   .   .   1   CYSS   QB    parsed_6ey3   1   
         3   1   2   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         4   1   1   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         4   1   2   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
         5   1   1   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         5   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QB    parsed_6ey3   1   
         6   1   1   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         6   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QD    parsed_6ey3   1   
         7   1   1   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         7   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QG    parsed_6ey3   1   
         8   1   1   .   .   .   .   .   .   .   .   .   2   DARG   H     parsed_6ey3   1   
         8   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QH1   parsed_6ey3   1   
         9   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HA    parsed_6ey3   1   
         9   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        10   1   1   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
        10   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QB    parsed_6ey3   1   
        11   1   1   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
        11   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QD    parsed_6ey3   1   
        12   1   1   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
        12   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QG    parsed_6ey3   1   
        13   1   1   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
        13   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QH1   parsed_6ey3   1   
        14   1   1   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
        14   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD2   parsed_6ey3   1   
        15   1   1   .   .   .   .   .   .   .   .   .   2   DARG   HA    parsed_6ey3   1   
        15   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD3   parsed_6ey3   1   
        16   1   1   .   .   .   .   .   .   .   .   .   2   DARG   QB    parsed_6ey3   1   
        16   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QD    parsed_6ey3   1   
        17   1   1   .   .   .   .   .   .   .   .   .   2   DARG   QB    parsed_6ey3   1   
        17   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QG    parsed_6ey3   1   
        18   1   1   .   .   .   .   .   .   .   .   .   2   DARG   QB    parsed_6ey3   1   
        18   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QH1   parsed_6ey3   1   
        19   1   1   .   .   .   .   .   .   .   .   .   2   DARG   QD    parsed_6ey3   1   
        19   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QH1   parsed_6ey3   1   
        20   1   1   .   .   .   .   .   .   .   .   .   2   DARG   QG    parsed_6ey3   1   
        20   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QD    parsed_6ey3   1   
        21   1   1   .   .   .   .   .   .   .   .   .   2   DARG   QG    parsed_6ey3   1   
        21   1   2   .   .   .   .   .   .   .   .   .   2   DARG   QH1   parsed_6ey3   1   
        22   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HA    parsed_6ey3   1   
        22   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HB3   parsed_6ey3   1   
        23   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HA    parsed_6ey3   1   
        23   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD3   parsed_6ey3   1   
        24   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HA    parsed_6ey3   1   
        24   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   QG    parsed_6ey3   1   
        25   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HB2   parsed_6ey3   1   
        25   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HB3   parsed_6ey3   1   
        26   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HB2   parsed_6ey3   1   
        26   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD2   parsed_6ey3   1   
        27   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HB2   parsed_6ey3   1   
        27   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD3   parsed_6ey3   1   
        28   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HB2   parsed_6ey3   1   
        28   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   QG    parsed_6ey3   1   
        29   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HB3   parsed_6ey3   1   
        29   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD3   parsed_6ey3   1   
        30   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HB3   parsed_6ey3   1   
        30   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   QG    parsed_6ey3   1   
        31   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HD2   parsed_6ey3   1   
        31   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   HD3   parsed_6ey3   1   
        32   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HD2   parsed_6ey3   1   
        32   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   QG    parsed_6ey3   1   
        33   1   1   .   .   .   .   .   .   .   .   .   3   DPRO   HD3   parsed_6ey3   1   
        33   1   2   .   .   .   .   .   .   .   .   .   3   DPRO   QG    parsed_6ey3   1   
        34   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        34   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   H     parsed_6ey3   1   
        35   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        35   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        36   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        36   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HB2   parsed_6ey3   1   
        37   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        37   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        38   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        38   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HG    parsed_6ey3   1   
        39   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        39   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD1   parsed_6ey3   1   
        40   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   H     parsed_6ey3   1   
        40   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD2   parsed_6ey3   1   
        41   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        41   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HB2   parsed_6ey3   1   
        42   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        42   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        43   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        43   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HG    parsed_6ey3   1   
        44   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        44   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD1   parsed_6ey3   1   
        45   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        45   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD2   parsed_6ey3   1   
        46   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HA    parsed_6ey3   1   
        46   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   H     parsed_6ey3   1   
        47   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB2   parsed_6ey3   1   
        47   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   H     parsed_6ey3   1   
        48   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB2   parsed_6ey3   1   
        48   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        49   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB2   parsed_6ey3   1   
        49   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD1   parsed_6ey3   1   
        50   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB2   parsed_6ey3   1   
        50   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD2   parsed_6ey3   1   
        51   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        51   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   HG    parsed_6ey3   1   
        52   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        52   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD1   parsed_6ey3   1   
        53   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        53   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD2   parsed_6ey3   1   
        54   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HB3   parsed_6ey3   1   
        54   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   H     parsed_6ey3   1   
        55   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HG    parsed_6ey3   1   
        55   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   H     parsed_6ey3   1   
        56   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HG    parsed_6ey3   1   
        56   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD1   parsed_6ey3   1   
        57   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   HG    parsed_6ey3   1   
        57   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD2   parsed_6ey3   1   
        58   1   1   .   .   .   .   .   .   .   .   .   4   DLEU   QD1   parsed_6ey3   1   
        58   1   2   .   .   .   .   .   .   .   .   .   4   DLEU   QD2   parsed_6ey3   1   
        59   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   H     parsed_6ey3   1   
        59   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   HA    parsed_6ey3   1   
        60   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   H     parsed_6ey3   1   
        60   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   HB2   parsed_6ey3   1   
        61   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   H     parsed_6ey3   1   
        61   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   HB3   parsed_6ey3   1   
        62   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   HA    parsed_6ey3   1   
        62   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   H     parsed_6ey3   1   
        63   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   HA    parsed_6ey3   1   
        63   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   HB2   parsed_6ey3   1   
        64   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   HA    parsed_6ey3   1   
        64   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   HB3   parsed_6ey3   1   
        65   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   HB2   parsed_6ey3   1   
        65   1   2   .   .   .   .   .   .   .   .   .   5   DTRP   HB3   parsed_6ey3   1   
        66   1   1   .   .   .   .   .   .   .   .   .   5   DTRP   HD1   parsed_6ey3   1   
        66   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   QG2   parsed_6ey3   1   
        67   1   1   .   .   .   .   .   .   .   .   .   6   DTHR   H     parsed_6ey3   1   
        67   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   HA    parsed_6ey3   1   
        68   1   1   .   .   .   .   .   .   .   .   .   6   DTHR   H     parsed_6ey3   1   
        68   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   QG2   parsed_6ey3   1   
        69   1   1   .   .   .   .   .   .   .   .   .   6   DTHR   H     parsed_6ey3   1   
        69   1   2   .   .   .   .   .   .   .   .   .   7   DALA   H     parsed_6ey3   1   
        70   1   1   .   .   .   .   .   .   .   .   .   6   DTHR   HA    parsed_6ey3   1   
        70   1   2   .   .   .   .   .   .   .   .   .   6   DTHR   QG2   parsed_6ey3   1   
        71   1   1   .   .   .   .   .   .   .   .   .   7   DALA   H     parsed_6ey3   1   
        71   1   2   .   .   .   .   .   .   .   .   .   7   DALA   HA    parsed_6ey3   1   
        72   1   1   .   .   .   .   .   .   .   .   .   7   DALA   H     parsed_6ey3   1   
        72   1   2   .   .   .   .   .   .   .   .   .   7   DALA   QB    parsed_6ey3   1   
        73   1   1   .   .   .   .   .   .   .   .   .   7   DALA   HA    parsed_6ey3   1   
        73   1   2   .   .   .   .   .   .   .   .   .   7   DALA   QB    parsed_6ey3   1   
        74   1   1   .   .   .   .   .   .   .   .   .   7   DALA   HA    parsed_6ey3   1   
        74   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   H     parsed_6ey3   1   
        75   1   1   .   .   .   .   .   .   .   .   .   7   DALA   QB    parsed_6ey3   1   
        75   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   H     parsed_6ey3   1   
        76   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   H     parsed_6ey3   1   
        76   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   HA    parsed_6ey3   1   
        77   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   H     parsed_6ey3   1   
        77   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   HB2   parsed_6ey3   1   
        78   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   H     parsed_6ey3   1   
        78   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   HB3   parsed_6ey3   1   
        79   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   HA    parsed_6ey3   1   
        79   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   HB2   parsed_6ey3   1   
        80   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   HA    parsed_6ey3   1   
        80   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   HB3   parsed_6ey3   1   
        81   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   HA    parsed_6ey3   1   
        81   1   2   .   .   .   .   .   .   .   .   .   9   GLY    H     parsed_6ey3   1   
        82   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   HB2   parsed_6ey3   1   
        82   1   2   .   .   .   .   .   .   .   .   .   8   CYSS   HB3   parsed_6ey3   1   
        83   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   HB2   parsed_6ey3   1   
        83   1   2   .   .   .   .   .   .   .   .   .   9   GLY    H     parsed_6ey3   1   
        84   1   1   .   .   .   .   .   .   .   .   .   8   CYSS   HB3   parsed_6ey3   1   
        84   1   2   .   .   .   .   .   .   .   .   .   9   GLY    H     parsed_6ey3   1   
        85   1   1   .   .   .   .   .   .   .   .   .   9   GLY    H     parsed_6ey3   1   
        85   1   2   .   .   .   .   .   .   .   .   .   9   GLY    QA    parsed_6ey3   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   .   .   .   .   .   .   .   4.25   parsed_6ey3   1   
         2   1   .   .   .   .   .   .   .   2.76   parsed_6ey3   1   
         3   1   .   .   .   .   .   .   .   5.03   parsed_6ey3   1   
         4   1   .   .   .   .   .   .   .   3.73   parsed_6ey3   1   
         5   1   .   .   .   .   .   .   .   5.65   parsed_6ey3   1   
         6   1   .   .   .   .   .   .   .   6.38   parsed_6ey3   1   
         7   1   .   .   .   .   .   .   .   5.75   parsed_6ey3   1   
         8   1   .   .   .   .   .   .   .   6.37   parsed_6ey3   1   
         9   1   .   .   .   .   .   .   .   2.79   parsed_6ey3   1   
        10   1   .   .   .   .   .   .   .   4.75   parsed_6ey3   1   
        11   1   .   .   .   .   .   .   .   5.95   parsed_6ey3   1   
        12   1   .   .   .   .   .   .   .   5.78   parsed_6ey3   1   
        13   1   .   .   .   .   .   .   .   6.37   parsed_6ey3   1   
        14   1   .   .   .   .   .   .   .   3.86   parsed_6ey3   1   
        15   1   .   .   .   .   .   .   .   4.49   parsed_6ey3   1   
        16   1   .   .   .   .   .   .   .   6.01   parsed_6ey3   1   
        17   1   .   .   .   .   .   .   .   4.89   parsed_6ey3   1   
        18   1   .   .   .   .   .   .   .   7.25   parsed_6ey3   1   
        19   1   .   .   .   .   .   .   .   5.73   parsed_6ey3   1   
        20   1   .   .   .   .   .   .   .   6.01   parsed_6ey3   1   
        21   1   .   .   .   .   .   .   .   7.25   parsed_6ey3   1   
        22   1   .   .   .   .   .   .   .   3.59   parsed_6ey3   1   
        23   1   .   .   .   .   .   .   .   4.30   parsed_6ey3   1   
        24   1   .   .   .   .   .   .   .   5.30   parsed_6ey3   1   
        25   1   .   .   .   .   .   .   .   3.06   parsed_6ey3   1   
        26   1   .   .   .   .   .   .   .   4.81   parsed_6ey3   1   
        27   1   .   .   .   .   .   .   .   5.50   parsed_6ey3   1   
        28   1   .   .   .   .   .   .   .   4.28   parsed_6ey3   1   
        29   1   .   .   .   .   .   .   .   3.92   parsed_6ey3   1   
        30   1   .   .   .   .   .   .   .   3.85   parsed_6ey3   1   
        31   1   .   .   .   .   .   .   .   2.20   parsed_6ey3   1   
        32   1   .   .   .   .   .   .   .   5.27   parsed_6ey3   1   
        33   1   .   .   .   .   .   .   .   6.22   parsed_6ey3   1   
        34   1   .   .   .   .   .   .   .   3.65   parsed_6ey3   1   
        35   1   .   .   .   .   .   .   .   3.09   parsed_6ey3   1   
        36   1   .   .   .   .   .   .   .   4.08   parsed_6ey3   1   
        37   1   .   .   .   .   .   .   .   3.82   parsed_6ey3   1   
        38   1   .   .   .   .   .   .   .   5.50   parsed_6ey3   1   
        39   1   .   .   .   .   .   .   .   5.17   parsed_6ey3   1   
        40   1   .   .   .   .   .   .   .   4.90   parsed_6ey3   1   
        41   1   .   .   .   .   .   .   .   3.32   parsed_6ey3   1   
        42   1   .   .   .   .   .   .   .   2.70   parsed_6ey3   1   
        43   1   .   .   .   .   .   .   .   5.04   parsed_6ey3   1   
        44   1   .   .   .   .   .   .   .   4.28   parsed_6ey3   1   
        45   1   .   .   .   .   .   .   .   3.42   parsed_6ey3   1   
        46   1   .   .   .   .   .   .   .   3.39   parsed_6ey3   1   
        47   1   .   .   .   .   .   .   .   3.29   parsed_6ey3   1   
        48   1   .   .   .   .   .   .   .   2.23   parsed_6ey3   1   
        49   1   .   .   .   .   .   .   .   3.85   parsed_6ey3   1   
        50   1   .   .   .   .   .   .   .   4.14   parsed_6ey3   1   
        51   1   .   .   .   .   .   .   .   2.96   parsed_6ey3   1   
        52   1   .   .   .   .   .   .   .   3.22   parsed_6ey3   1   
        53   1   .   .   .   .   .   .   .   3.22   parsed_6ey3   1   
        54   1   .   .   .   .   .   .   .   3.29   parsed_6ey3   1   
        55   1   .   .   .   .   .   .   .   4.44   parsed_6ey3   1   
        56   1   .   .   .   .   .   .   .   4.90   parsed_6ey3   1   
        57   1   .   .   .   .   .   .   .   4.55   parsed_6ey3   1   
        58   1   .   .   .   .   .   .   .   4.57   parsed_6ey3   1   
        59   1   .   .   .   .   .   .   .   3.19   parsed_6ey3   1   
        60   1   .   .   .   .   .   .   .   3.55   parsed_6ey3   1   
        61   1   .   .   .   .   .   .   .   3.53   parsed_6ey3   1   
        62   1   .   .   .   .   .   .   .   3.45   parsed_6ey3   1   
        63   1   .   .   .   .   .   .   .   3.42   parsed_6ey3   1   
        64   1   .   .   .   .   .   .   .   3.69   parsed_6ey3   1   
        65   1   .   .   .   .   .   .   .   2.20   parsed_6ey3   1   
        66   1   .   .   .   .   .   .   .   4.04   parsed_6ey3   1   
        67   1   .   .   .   .   .   .   .   3.49   parsed_6ey3   1   
        68   1   .   .   .   .   .   .   .   4.34   parsed_6ey3   1   
        69   1   .   .   .   .   .   .   .   2.86   parsed_6ey3   1   
        70   1   .   .   .   .   .   .   .   3.22   parsed_6ey3   1   
        71   1   .   .   .   .   .   .   .   2.93   parsed_6ey3   1   
        72   1   .   .   .   .   .   .   .   4.36   parsed_6ey3   1   
        73   1   .   .   .   .   .   .   .   4.27   parsed_6ey3   1   
        74   1   .   .   .   .   .   .   .   2.99   parsed_6ey3   1   
        75   1   .   .   .   .   .   .   .   4.77   parsed_6ey3   1   
        76   1   .   .   .   .   .   .   .   3.78   parsed_6ey3   1   
        77   1   .   .   .   .   .   .   .   3.65   parsed_6ey3   1   
        78   1   .   .   .   .   .   .   .   3.26   parsed_6ey3   1   
        79   1   .   .   .   .   .   .   .   4.08   parsed_6ey3   1   
        80   1   .   .   .   .   .   .   .   3.49   parsed_6ey3   1   
        81   1   .   .   .   .   .   .   .   3.52   parsed_6ey3   1   
        82   1   .   .   .   .   .   .   .   2.20   parsed_6ey3   1   
        83   1   .   .   .   .   .   .   .   4.36   parsed_6ey3   1   
        84   1   .   .   .   .   .   .   .   3.55   parsed_6ey3   1   
        85   1   .   .   .   .   .   .   .   3.48   parsed_6ey3   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   "Restraints file 1: ciclo1new4.upl"     1    1    1   35   parsed_6ey3   1   
         2   "peak   156"                            2   49    2   59   parsed_6ey3   1   
         3   "peak   143"                            3   49    3   59   parsed_6ey3   1   
         4   "peak   154"                            4   49    4   59   parsed_6ey3   1   
         5   "peak   142"                            5   49    5   59   parsed_6ey3   1   
         6   "peak    93"                            6   49    6   59   parsed_6ey3   1   
         7   "peak    36"                            7   49    7   59   parsed_6ey3   1   
         8   "peak   138"                            8   49    8   59   parsed_6ey3   1   
         9   "peak   144"                            9   49    9   59   parsed_6ey3   1   
        10   "peak   300"                           10   49   10   59   parsed_6ey3   1   
        11   "peak    94"                           11   49   11   59   parsed_6ey3   1   
        12   "peak    37"                           12   49   12   59   parsed_6ey3   1   
        13   "peak    53"                           13   49   13   59   parsed_6ey3   1   
        14   "peak   190"                           14   49   14   59   parsed_6ey3   1   
        15   "peak   110"                           15   49   15   59   parsed_6ey3   1   
        16   "peak    12"                           16   49   16   59   parsed_6ey3   1   
        17   "peak    90"                           17   49   17   60   parsed_6ey3   1   
        18   "peak    91"                           18   49   18   59   parsed_6ey3   1   
        19   "peak    95"                           19   49   19   59   parsed_6ey3   1   
        20   "peak   354"                           20   49   20   59   parsed_6ey3   1   
        21   "peak    49"                           21   49   21   59   parsed_6ey3   1   
        22   "peak   355"                           22   49   22   59   parsed_6ey3   1   
        23   "peak   302"                           23   49   23   59   parsed_6ey3   1   
        24   "peak    15"                           24   49   24   59   parsed_6ey3   1   
        25   "peak   301"                           25   49   25   60   parsed_6ey3   1   
        26   "peak    28"                           26   49   26   59   parsed_6ey3   1   
        27   "peak   337"                           27   49   27   59   parsed_6ey3   1   
        28   "peak    16"                           28   49   28   59   parsed_6ey3   1   
        29   "peak   338"                           29   49   29   59   parsed_6ey3   1   
        30   "peak    14"                           30   49   30   59   parsed_6ey3   1   
        31   "peak   233"                           31   49   31   59   parsed_6ey3   1   
        32   "peak    11"                           32   49   32   59   parsed_6ey3   1   
        33   "peak   231"                           33   49   33   59   parsed_6ey3   1   
        34   "peak   230"                           34   49   34   59   parsed_6ey3   1   
        35   "peak   131"                           35   49   35   59   parsed_6ey3   1   
        36   "peak   175"                           36   49   36   59   parsed_6ey3   1   
        37   "peak    86"                           37   49   37   59   parsed_6ey3   1   
        38   "peak    44"                           38   49   38   59   parsed_6ey3   1   
        39   "peak   350"                           39   49   39   59   parsed_6ey3   1   
        40   "peak    30"                           40   49   40   59   parsed_6ey3   1   
        41   "peak   126"                           41   49   41   59   parsed_6ey3   1   
        42   "peak   174"                           42   49   42   59   parsed_6ey3   1   
        43   "peak   172"                           43   49   43   60   parsed_6ey3   1   
        44   "peak   351"                           44   49   44   61   parsed_6ey3   1   
        45   "peak   171"                           45   49   45   60   parsed_6ey3   1   
        46   "peak   173"                           46   49   46   59   parsed_6ey3   1   
        47   "peak   177"                           47   49   47   60   parsed_6ey3   1   
        48   "peak   323"                           48   49   48   59   parsed_6ey3   1   
        49   "peak    42"                           49   49   49   59   parsed_6ey3   1   
        50   "peak    81"                           50   49   50   59   parsed_6ey3   1   
        51   "peak    83"                           51   49   51   59   parsed_6ey3   1   
        52   "peak    48"                           52   49   52   59   parsed_6ey3   1   
        53   "peak    27"                           53   49   53   59   parsed_6ey3   1   
        54   "peak    41"                           54   49   54   59   parsed_6ey3   1   
        55   "peak    47"                           55   49   55   59   parsed_6ey3   1   
        56   "peak   352"                           56   49   56   59   parsed_6ey3   1   
        57   "peak    32"                           57   49   57   59   parsed_6ey3   1   
        58   "peak    77"                           58   49   58   59   parsed_6ey3   1   
        59   "peak    71"                           59   49   59   59   parsed_6ey3   1   
        60   "peak   332"                           60   49   60   59   parsed_6ey3   1   
        61   "peak   277"                           61   49   61   59   parsed_6ey3   1   
        62   "peak   328"                           62   49   62   59   parsed_6ey3   1   
        63   "peak   366"                           63   49   63   59   parsed_6ey3   1   
        64   "peak   278"                           64   49   64   59   parsed_6ey3   1   
        65   "peak   224"                           65   49   65   59   parsed_6ey3   1   
        66   "peak   222"                           66   49   66   59   parsed_6ey3   1   
        67   "peak   102"                           67   49   67   59   parsed_6ey3   1   
        68   "peak   257"                           68   50   68   62   parsed_6ey3   1   
        69   "peak   202"                           69   49   69   59   parsed_6ey3   1   
        70   "peak   256"                           70   49   70   59   parsed_6ey3   1   
        71   "peak   305"                           71   49   71   59   parsed_6ey3   1   
        72   "peak   344"                           72   49   72   59   parsed_6ey3   1   
        73   "peak   294"                           73   49   73   59   parsed_6ey3   1   
        74   "peak   241"                           74   49   74   59   parsed_6ey3   1   
        75   "peak   265"                           75   49   75   59   parsed_6ey3   1   
        76   "peak   262"                           76   49   76   59   parsed_6ey3   1   
        77   "peak   311"                           77   49   77   59   parsed_6ey3   1   
        78   "peak   209"                           78   49   78   59   parsed_6ey3   1   
        79   "peak   169"                           79   49   79   59   parsed_6ey3   1   
        80   "peak   309"                           80   49   80   59   parsed_6ey3   1   
        81   "peak   308"                           81   49   81   59   parsed_6ey3   1   
        82   "peak   215"                           82   49   82   59   parsed_6ey3   1   
        83   "peak   167"                           83   49   83   59   parsed_6ey3   1   
        84   "peak   212"                           84   49   84   59   parsed_6ey3   1   
        85   "peak   211"                           85   49   85   59   parsed_6ey3   1   
        86   "peak   214"                           86   49   86   59   parsed_6ey3   1   
    stop_

save_





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