NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype item_count
30955 1dmd cing 2-parsed STAR entry full 203


data_1dmd_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1dmd 
    _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_1dmd   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1dmd 
    _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   1dmd   "Master copy"    parsed_1dmd   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1dmd 
    _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   1dmd.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_1dmd   1   
        1   1dmd.mr   .   .    n/a           2    comment                  "Not applicable"    "Not applicable"      0   parsed_1dmd   1   
        1   1dmd.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     36   parsed_1dmd   1   
        1   1dmd.mr   .   .    n/a           4    comment                  "Not applicable"    "Not applicable"      0   parsed_1dmd   1   
        1   1dmd.mr   .   .    XPLOR/CNS     5    distance                  NOE                 simple             167   parsed_1dmd   1   
        1   1dmd.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1dmd   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_1dmd 
    _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   METALLOTHIONEIN                         22-NOV-94   1DMD    
*COMPND   CD-6 METALLOTHIONEIN-1 (CD-6 MT) (ALPHA DOMAIN)             
*COMPND  2 (NMR, 18 STRUCTURES)                                       
*SOURCE   CRAB (CALLINECTES SAPIDUS)                                  
*AUTHOR   S.S.NARULA,M.BROUWER,Y.HUA,I.M.ARMITAGE                     
*REVDAT  1   07-FEB-95 1DMD    0                                      

!ct_dihe.tbl, numbered 1,2, 3 etc.

!Dihedral angle of Lys 38 and Ala 40 is changed from -120+-40 to -20+-140 
!to consider type I and II turn, July 15
!Dihedral angles for C-terminal cluster, Feb 18, 1993
!The force constant is 2 
!The range of the side chain angles is +-30 
!The Values are based on the following arguments:
!
! for J> 9.0 Hz, phi= -120+-30;
!
! for J between 9.0 and 8.0 Hz, phi= -120+-40;
!
! for J between 8.0 and 5.0 Hz, phi= -105+-55;
!
! for J less than 5 Hz, phi= -60+-30
!
! For all Gly and Pro, phi= -105+-55; (Maximum Range).
!
;

save_


save_MR_file_comment_2
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_1dmd 
    _Org_constr_file_comment.ID                  2 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            2 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
set message=off echo=off end
!set message=on echo=on end
restraints dihedral reset ! Changed for XPLOR3.1, May 26
;

save_


save_CNS/XPLOR_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_1dmd 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            3 
    _Torsion_angle_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Torsion_angle_constraint.ID 
        _Torsion_angle_constraint.Torsion_angle_name 
        _Torsion_angle_constraint.Assembly_atom_ID_1 
        _Torsion_angle_constraint.Entity_assembly_ID_1 
        _Torsion_angle_constraint.Entity_ID_1 
        _Torsion_angle_constraint.Comp_index_ID_1 
        _Torsion_angle_constraint.Seq_ID_1 
        _Torsion_angle_constraint.Comp_ID_1 
        _Torsion_angle_constraint.Atom_ID_1 
        _Torsion_angle_constraint.Resonance_ID_1 
        _Torsion_angle_constraint.Assembly_atom_ID_2 
        _Torsion_angle_constraint.Entity_assembly_ID_2 
        _Torsion_angle_constraint.Entity_ID_2 
        _Torsion_angle_constraint.Comp_index_ID_2 
        _Torsion_angle_constraint.Seq_ID_2 
        _Torsion_angle_constraint.Comp_ID_2 
        _Torsion_angle_constraint.Atom_ID_2 
        _Torsion_angle_constraint.Resonance_ID_2 
        _Torsion_angle_constraint.Assembly_atom_ID_3 
        _Torsion_angle_constraint.Entity_assembly_ID_3 
        _Torsion_angle_constraint.Entity_ID_3 
        _Torsion_angle_constraint.Comp_index_ID_3 
        _Torsion_angle_constraint.Seq_ID_3 
        _Torsion_angle_constraint.Comp_ID_3 
        _Torsion_angle_constraint.Atom_ID_3 
        _Torsion_angle_constraint.Resonance_ID_3 
        _Torsion_angle_constraint.Assembly_atom_ID_4 
        _Torsion_angle_constraint.Entity_assembly_ID_4 
        _Torsion_angle_constraint.Entity_ID_4 
        _Torsion_angle_constraint.Comp_index_ID_4 
        _Torsion_angle_constraint.Seq_ID_4 
        _Torsion_angle_constraint.Comp_ID_4 
        _Torsion_angle_constraint.Atom_ID_4 
        _Torsion_angle_constraint.Resonance_ID_4 
        _Torsion_angle_constraint.Angle_lower_bound_val 
        _Torsion_angle_constraint.Angle_upper_bound_val 
        _Torsion_angle_constraint.Source_experiment_ID 
        _Torsion_angle_constraint.Auth_asym_ID_1 
        _Torsion_angle_constraint.Auth_seq_ID_1 
        _Torsion_angle_constraint.Auth_comp_ID_1 
        _Torsion_angle_constraint.Auth_atom_ID_1 
        _Torsion_angle_constraint.Auth_asym_ID_2 
        _Torsion_angle_constraint.Auth_seq_ID_2 
        _Torsion_angle_constraint.Auth_comp_ID_2 
        _Torsion_angle_constraint.Auth_atom_ID_2 
        _Torsion_angle_constraint.Auth_asym_ID_3 
        _Torsion_angle_constraint.Auth_seq_ID_3 
        _Torsion_angle_constraint.Auth_comp_ID_3 
        _Torsion_angle_constraint.Auth_atom_ID_3 
        _Torsion_angle_constraint.Auth_asym_ID_4 
        _Torsion_angle_constraint.Auth_seq_ID_4 
        _Torsion_angle_constraint.Auth_comp_ID_4 
        _Torsion_angle_constraint.Auth_atom_ID_4 
        _Torsion_angle_constraint.Entry_ID 
        _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 

         1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .    1   .   c   .    2   .   n    .    2   .   ca   .    2   .   c    parsed_1dmd   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .    2   .   c   .    3   .   n    .    3   .   ca   .    3   .   c    parsed_1dmd   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    3   .   c   .    4   .   n    .    4   .   ca   .    4   .   c    parsed_1dmd   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .    4   .   c   .    5   .   n    .    5   .   ca   .    5   .   c    parsed_1dmd   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0   -90.0   .   .    5   .   c   .    6   .   n    .    6   .   ca   .    6   .   c    parsed_1dmd   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .    6   .   c   .    7   .   n    .    7   .   ca   .    7   .   c    parsed_1dmd   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0   -90.0   .   .    7   .   c   .    8   .   n    .    8   .   ca   .    8   .   c    parsed_1dmd   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0   -90.0   .   .    8   .   c   .    9   .   n    .    9   .   ca   .    9   .   c    parsed_1dmd   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .    9   .   c   .   10   .   n    .   10   .   ca   .   10   .   c    parsed_1dmd   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   120.0   .   .   10   .   c   .   11   .   n    .   11   .   ca   .   11   .   c    parsed_1dmd   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   11   .   c   .   12   .   n    .   12   .   ca   .   12   .   c    parsed_1dmd   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   120.0   .   .   12   .   c   .   13   .   n    .   13   .   ca   .   13   .   c    parsed_1dmd   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   13   .   c   .   14   .   n    .   14   .   ca   .   14   .   c    parsed_1dmd   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   14   .   c   .   15   .   n    .   15   .   ca   .   15   .   c    parsed_1dmd   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   15   .   c   .   16   .   n    .   16   .   ca   .   16   .   c    parsed_1dmd   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   16   .   c   .   17   .   n    .   17   .   ca   .   17   .   c    parsed_1dmd   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   17   .   c   .   18   .   n    .   18   .   ca   .   18   .   c    parsed_1dmd   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   18   .   c   .   19   .   n    .   19   .   ca   .   19   .   c    parsed_1dmd   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   19   .   c   .   20   .   n    .   20   .   ca   .   20   .   c    parsed_1dmd   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   20   .   c   .   21   .   n    .   21   .   ca   .   21   .   c    parsed_1dmd   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.0   -90.0   .   .   21   .   c   .   22   .   n    .   22   .   ca   .   22   .   c    parsed_1dmd   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   22   .   c   .   23   .   n    .   23   .   ca   .   23   .   c    parsed_1dmd   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   23   .   c   .   24   .   n    .   24   .   ca   .   24   .   c    parsed_1dmd   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   24   .   c   .   25   .   n    .   25   .   ca   .   25   .   c    parsed_1dmd   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   25   .   c   .   26   .   n    .   26   .   ca   .   26   .   c    parsed_1dmd   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   26   .   c   .   27   .   n    .   27   .   ca   .   27   .   c    parsed_1dmd   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   27   .   c   .   28   .   n    .   28   .   ca   .   28   .   c    parsed_1dmd   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   28   .   c   .   29   .   n    .   29   .   ca   .   29   .   c    parsed_1dmd   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   29   .   c   .   30   .   n    .   30   .   ca   .   30   .   c    parsed_1dmd   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -50.0   .   .   30   .   c   .   31   .   n    .   31   .   ca   .   31   .   c    parsed_1dmd   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0    90.0   .   .    3   .   n   .    3   .   ca   .    3   .   cb   .    3   .   sg   parsed_1dmd   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    6   .   n   .    6   .   ca   .    6   .   cb   .    6   .   sg   parsed_1dmd   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .   18   .   n   .   18   .   ca   .   18   .   cb   .   18   .   sg   parsed_1dmd   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   22   .   n   .   22   .   ca   .   22   .   cb   .   22   .   sg   parsed_1dmd   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   26   .   n   .   26   .   ca   .   26   .   cb   .   26   .   sg   parsed_1dmd   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   29   .   n   .   29   .   ca   .   29   .   cb   .   29   .   sg   parsed_1dmd   1   
    stop_


    loop_
        _TA_constraint_comment_org.ID 
        _TA_constraint_comment_org.Comment_text 
        _TA_constraint_comment_org.Comment_begin_line 
        _TA_constraint_comment_org.Comment_begin_column 
        _TA_constraint_comment_org.Comment_end_line 
        _TA_constraint_comment_org.Comment_end_column 
        _TA_constraint_comment_org.Entry_ID 
        _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 

         1   "!    29, Pro,"                                                                                     1     1    2   18   parsed_1dmd   1   
         2   "Cys 30, 7.7"                                                                                       4     1    4   13   parsed_1dmd   1   
         3   "Glu 31, 5?"                                                                                        6     1    6   12   parsed_1dmd   1   
         4   "Lys 32, 7.8"                                                                                       8     1    8   13   parsed_1dmd   1   
         5   "Cys 33, 9.6"                                                                                      10     1   10   13   parsed_1dmd   1   
         6   "Thr 34, 5.9"                                                                                      12     1   12   13   parsed_1dmd   1   
         7   "Ser 35, 9.1"                                                                                      14     1   14   13   parsed_1dmd   1   
         8   "Gly 36, 9.3"                                                                                      16     1   16   13   parsed_1dmd   1   
         9   "Cys 37, 6.8"                                                                                      18     1   18   13   parsed_1dmd   1   
        10   "Lys 38, 8.4, value changed from -120+-40 to -20+-140 to consider type I and II turn together."    20     1   20   95   parsed_1dmd   1   
        11   "Cys39, 7.0"                                                                                       22     1   22   12   parsed_1dmd   1   
        12   "Ala 40, 6.5, value changed from -105+-55 to -20+-140 to consider type I and II turn together."    24     1   24   95   parsed_1dmd   1   
        13   "Thr 41, 8.4"                                                                                      26     1   26   13   parsed_1dmd   1   
        14   "Lys 42, 3.9"                                                                                      28     1   28   13   parsed_1dmd   1   
        15   "Glu 43, 6.8"                                                                                      30     1   30   13   parsed_1dmd   1   
        16   "Glu 44, 6.4"                                                                                      32     1   32   13   parsed_1dmd   1   
        17   "Cys 45, 4.1"                                                                                      34     1   34   13   parsed_1dmd   1   
        18   "Ser 46, 4.1"                                                                                      36     1   36   13   parsed_1dmd   1   
        19   "Lys 47, 8.0"                                                                                      38     1   38   13   parsed_1dmd   1   
        20   "Thr 48, could not be measured"                                                                    40     1   40   31   parsed_1dmd   1   
        21   "Cys 49, 9.0"                                                                                      42     1   42   13   parsed_1dmd   1   
        22   "Thr 50, 5.5"                                                                                      44     1   44   13   parsed_1dmd   1   
        23   "Lys 51, 6.5"                                                                                      46     1   46   13   parsed_1dmd   1   
        24   "Pro 52,"                                                                                          48     1   48    9   parsed_1dmd   1   
        25   "Cys 53, 7.0"                                                                                      50     1   50   13   parsed_1dmd   1   
        26   "Ser 54, 3.6"                                                                                      52     1   52   13   parsed_1dmd   1   
        27   "Cys 55, 7.2"                                                                                      54     1   54   13   parsed_1dmd   1   
        28   "Cys 56, 5.9"                                                                                      56     1   56   13   parsed_1dmd   1   
        29   "Pro 57"                                                                                           58     1   58    8   parsed_1dmd   1   
        30   "Lys 58, 7.0"                                                                                      60     1   60   13   parsed_1dmd   1   
        31   
;
Chi angles around Calpha-Cbeta bond
Bridged Cys are Cys 33, Cys 49 and Cys 56; Feb. 18, 1993
! Cys 30, terminal
;
   62     1   65   20   parsed_1dmd   1   
        32   "! Cys 33, bridged"                                                                                67     1   67   19   parsed_1dmd   1   
        33   
;
March 1, July 15
Cys 37, terminal, could not be determined.
Cys 39, terminal, could not be determined
!Cys 45, terminal
;
   68   117   71   19   parsed_1dmd   1   
        34   "Cys 49, bridged,"                                                                                 73     1   73   19   parsed_1dmd   1   
        35   
;
July 19, Sunday
! Cys 53, terminal
;
   74   121   75   20   parsed_1dmd   1   
        36   
;
Cys 55, terminal, could not be determined
Cys 56, bridged
;
   77     1   78   17   parsed_1dmd   1   
    stop_

save_


save_MR_file_comment_4
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_1dmd 
    _Org_constr_file_comment.ID                  3 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            4 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
end
set message=on echo=on end
----------
X-Sun-Data-Type: default
X-Sun-Data-Name: ct_noe.tbl.a
X-Sun-Content-Lines: 196

!ct_noe.tbl; July 9,1993, numbered 1,2, 3 etc.
!Some of the NOEs are corrected Feb 23, 24, 26, July 8,9
!For C-terminal metal cluster
!Reference for NOE is JMB 196, 611-39 (1987).
!
! Strong NOEs have range 1.8 0.0 0.9
! Medium NOEs have range 1.8 0.0 1.4
! Weak   NOEs have range 1.8 0.0 1.8
! Very weak NOEs have range 1.8 0.0 2.7 (Those appearing in higher mixing time
! NOESY spectra.
! Add 2.4 for Val methyl groups.
set message=off echo=off end
!set message=on echo=on end
!
;

save_


save_CNS/XPLOR_distance_constraints_5
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1dmd 
    _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_1dmd   1   
          2   1   .   .   .   parsed_1dmd   1   
          3   1   .   .   .   parsed_1dmd   1   
          4   1   .   .   .   parsed_1dmd   1   
          5   1   .   .   .   parsed_1dmd   1   
          6   1   .   .   .   parsed_1dmd   1   
          7   1   .   .   .   parsed_1dmd   1   
          8   1   .   .   .   parsed_1dmd   1   
          9   1   .   .   .   parsed_1dmd   1   
         10   1   .   .   .   parsed_1dmd   1   
         11   1   .   .   .   parsed_1dmd   1   
         12   1   .   .   .   parsed_1dmd   1   
         13   1   .   .   .   parsed_1dmd   1   
         14   1   .   .   .   parsed_1dmd   1   
         15   1   .   .   .   parsed_1dmd   1   
         16   1   .   .   .   parsed_1dmd   1   
         17   1   .   .   .   parsed_1dmd   1   
         18   1   .   .   .   parsed_1dmd   1   
         19   1   .   .   .   parsed_1dmd   1   
         20   1   .   .   .   parsed_1dmd   1   
         21   1   .   .   .   parsed_1dmd   1   
         22   1   .   .   .   parsed_1dmd   1   
         23   1   .   .   .   parsed_1dmd   1   
         24   1   .   .   .   parsed_1dmd   1   
         25   1   .   .   .   parsed_1dmd   1   
         26   1   .   .   .   parsed_1dmd   1   
         27   1   .   .   .   parsed_1dmd   1   
         28   1   .   .   .   parsed_1dmd   1   
         29   1   .   .   .   parsed_1dmd   1   
         30   1   .   .   .   parsed_1dmd   1   
         31   1   .   .   .   parsed_1dmd   1   
         32   1   .   .   .   parsed_1dmd   1   
         33   1   .   .   .   parsed_1dmd   1   
         34   1   .   .   .   parsed_1dmd   1   
         35   1   .   .   .   parsed_1dmd   1   
         36   1   .   .   .   parsed_1dmd   1   
         37   1   .   .   .   parsed_1dmd   1   
         38   1   .   .   .   parsed_1dmd   1   
         39   1   .   .   .   parsed_1dmd   1   
         40   1   .   .   .   parsed_1dmd   1   
         41   1   .   .   .   parsed_1dmd   1   
         42   1   .   .   .   parsed_1dmd   1   
         43   1   .   .   .   parsed_1dmd   1   
         44   1   .   .   .   parsed_1dmd   1   
         45   1   .   .   .   parsed_1dmd   1   
         46   1   .   .   .   parsed_1dmd   1   
         47   1   .   .   .   parsed_1dmd   1   
         48   1   .   .   .   parsed_1dmd   1   
         49   1   .   .   .   parsed_1dmd   1   
         50   1   .   .   .   parsed_1dmd   1   
         51   1   .   .   .   parsed_1dmd   1   
         52   1   .   .   .   parsed_1dmd   1   
         53   1   .   .   .   parsed_1dmd   1   
         54   1   .   .   .   parsed_1dmd   1   
         55   1   .   .   .   parsed_1dmd   1   
         56   1   .   .   .   parsed_1dmd   1   
         57   1   .   .   .   parsed_1dmd   1   
         58   1   .   .   .   parsed_1dmd   1   
         59   1   .   .   .   parsed_1dmd   1   
         60   1   .   .   .   parsed_1dmd   1   
         61   1   .   .   .   parsed_1dmd   1   
         62   1   .   .   .   parsed_1dmd   1   
         63   1   .   .   .   parsed_1dmd   1   
         64   1   .   .   .   parsed_1dmd   1   
         65   1   .   .   .   parsed_1dmd   1   
         66   1   .   .   .   parsed_1dmd   1   
         67   1   .   .   .   parsed_1dmd   1   
         68   1   .   .   .   parsed_1dmd   1   
         69   1   .   .   .   parsed_1dmd   1   
         70   1   .   .   .   parsed_1dmd   1   
         71   1   .   .   .   parsed_1dmd   1   
         72   1   .   .   .   parsed_1dmd   1   
         73   1   .   .   .   parsed_1dmd   1   
         74   1   .   .   .   parsed_1dmd   1   
         75   1   .   .   .   parsed_1dmd   1   
         76   1   .   .   .   parsed_1dmd   1   
         77   1   .   .   .   parsed_1dmd   1   
         78   1   .   .   .   parsed_1dmd   1   
         79   1   .   .   .   parsed_1dmd   1   
         80   1   .   .   .   parsed_1dmd   1   
         81   1   .   .   .   parsed_1dmd   1   
         82   1   .   .   .   parsed_1dmd   1   
         83   1   .   .   .   parsed_1dmd   1   
         84   1   .   .   .   parsed_1dmd   1   
         85   1   .   .   .   parsed_1dmd   1   
         86   1   .   .   .   parsed_1dmd   1   
         87   1   .   .   .   parsed_1dmd   1   
         88   1   .   .   .   parsed_1dmd   1   
         89   1   .   .   .   parsed_1dmd   1   
         90   1   .   .   .   parsed_1dmd   1   
         91   1   .   .   .   parsed_1dmd   1   
         92   1   .   .   .   parsed_1dmd   1   
         93   1   .   .   .   parsed_1dmd   1   
         94   1   .   .   .   parsed_1dmd   1   
         95   1   .   .   .   parsed_1dmd   1   
         96   1   .   .   .   parsed_1dmd   1   
         97   1   .   .   .   parsed_1dmd   1   
         98   1   .   .   .   parsed_1dmd   1   
         99   1   .   .   .   parsed_1dmd   1   
        100   1   .   .   .   parsed_1dmd   1   
        101   1   .   .   .   parsed_1dmd   1   
        102   1   .   .   .   parsed_1dmd   1   
        103   1   .   .   .   parsed_1dmd   1   
        104   1   .   .   .   parsed_1dmd   1   
        105   1   .   .   .   parsed_1dmd   1   
        106   1   .   .   .   parsed_1dmd   1   
        107   1   .   .   .   parsed_1dmd   1   
        108   1   .   .   .   parsed_1dmd   1   
        109   1   .   .   .   parsed_1dmd   1   
        110   1   .   .   .   parsed_1dmd   1   
        111   1   .   .   .   parsed_1dmd   1   
        112   1   .   .   .   parsed_1dmd   1   
        113   1   .   .   .   parsed_1dmd   1   
        114   1   .   .   .   parsed_1dmd   1   
        115   1   .   .   .   parsed_1dmd   1   
        116   1   .   .   .   parsed_1dmd   1   
        117   1   .   .   .   parsed_1dmd   1   
        118   1   .   .   .   parsed_1dmd   1   
        119   1   .   .   .   parsed_1dmd   1   
        120   1   .   .   .   parsed_1dmd   1   
        121   1   .   .   .   parsed_1dmd   1   
        122   1   .   .   .   parsed_1dmd   1   
        123   1   .   .   .   parsed_1dmd   1   
        124   1   .   .   .   parsed_1dmd   1   
        125   1   .   .   .   parsed_1dmd   1   
        126   1   .   .   .   parsed_1dmd   1   
        127   1   .   .   .   parsed_1dmd   1   
        128   1   .   .   .   parsed_1dmd   1   
        129   1   .   .   .   parsed_1dmd   1   
        130   1   .   .   .   parsed_1dmd   1   
        131   1   .   .   .   parsed_1dmd   1   
        132   1   .   .   .   parsed_1dmd   1   
        133   1   .   .   .   parsed_1dmd   1   
        134   1   .   .   .   parsed_1dmd   1   
        135   1   .   .   .   parsed_1dmd   1   
        136   1   .   .   .   parsed_1dmd   1   
        137   1   .   .   .   parsed_1dmd   1   
        138   1   .   .   .   parsed_1dmd   1   
        139   1   .   .   .   parsed_1dmd   1   
        140   1   .   .   .   parsed_1dmd   1   
        141   1   .   .   .   parsed_1dmd   1   
        142   1   .   .   .   parsed_1dmd   1   
        143   1   .   .   .   parsed_1dmd   1   
        144   1   .   .   .   parsed_1dmd   1   
        145   1   .   .   .   parsed_1dmd   1   
        146   1   .   .   .   parsed_1dmd   1   
        147   1   .   .   .   parsed_1dmd   1   
        148   1   .   .   .   parsed_1dmd   1   
        149   1   .   .   .   parsed_1dmd   1   
        150   1   .   .   .   parsed_1dmd   1   
        151   1   .   .   .   parsed_1dmd   1   
        152   1   .   .   .   parsed_1dmd   1   
        153   1   .   .   .   parsed_1dmd   1   
        154   1   .   .   .   parsed_1dmd   1   
        155   1   .   .   .   parsed_1dmd   1   
        156   1   .   .   .   parsed_1dmd   1   
        157   1   .   .   .   parsed_1dmd   1   
        158   1   .   .   .   parsed_1dmd   1   
        159   1   .   .   .   parsed_1dmd   1   
        160   1   .   .   .   parsed_1dmd   1   
        161   1   .   .   .   parsed_1dmd   1   
        162   1   .   .   .   parsed_1dmd   1   
        163   1   .   .   .   parsed_1dmd   1   
        164   1   .   .   .   parsed_1dmd   1   
        165   1   .   .   .   parsed_1dmd   1   
        166   1   .   .   .   parsed_1dmd   1   
        167   1   .   .   .   parsed_1dmd   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   .   HA    parsed_1dmd   1   
          1   1   2   .   .   .   .   .   .   .   .   .    2   .   HG#   parsed_1dmd   1   
          2   1   1   .   .   .   .   .   .   .   .   .    1   .   HA    parsed_1dmd   1   
          2   1   2   .   .   .   .   .   .   .   .   .    2   .   HG#   parsed_1dmd   1   
          3   1   1   .   .   .   .   .   .   .   .   .    1   .   HT#   parsed_1dmd   1   
          3   1   2   .   .   .   .   .   .   .   .   .    1   .   HB#   parsed_1dmd   1   
          4   1   1   .   .   .   .   .   .   .   .   .    2   .   HA    parsed_1dmd   1   
          4   1   2   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
          5   1   1   .   .   .   .   .   .   .   .   .    2   .   HB#   parsed_1dmd   1   
          5   1   2   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
          6   1   1   .   .   .   .   .   .   .   .   .    2   .   HA    parsed_1dmd   1   
          6   1   2   .   .   .   .   .   .   .   .   .    6   .   HB2   parsed_1dmd   1   
          7   1   1   .   .   .   .   .   .   .   .   .    2   .   HA    parsed_1dmd   1   
          7   1   2   .   .   .   .   .   .   .   .   .    6   .   HB1   parsed_1dmd   1   
          8   1   1   .   .   .   .   .   .   .   .   .    2   .   HA    parsed_1dmd   1   
          8   1   2   .   .   .   .   .   .   .   .   .   26   .   HA    parsed_1dmd   1   
          9   1   1   .   .   .   .   .   .   .   .   .    2   .   HA    parsed_1dmd   1   
          9   1   2   .   .   .   .   .   .   .   .   .   26   .   HB1   parsed_1dmd   1   
         10   1   1   .   .   .   .   .   .   .   .   .    2   .   HG#   parsed_1dmd   1   
         10   1   2   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
         11   1   1   .   .   .   .   .   .   .   .   .    3   .   HA    parsed_1dmd   1   
         11   1   2   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         12   1   1   .   .   .   .   .   .   .   .   .    3   .   HA    parsed_1dmd   1   
         12   1   2   .   .   .   .   .   .   .   .   .    4   .   HA    parsed_1dmd   1   
         13   1   1   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
         13   1   2   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         14   1   1   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
         14   1   2   .   .   .   .   .   .   .   .   .    3   .   HB1   parsed_1dmd   1   
         15   1   1   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
         15   1   2   .   .   .   .   .   .   .   .   .    3   .   HB2   parsed_1dmd   1   
         16   1   1   .   .   .   .   .   .   .   .   .    3   .   HB1   parsed_1dmd   1   
         16   1   2   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         17   1   1   .   .   .   .   .   .   .   .   .    3   .   HB2   parsed_1dmd   1   
         17   1   2   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         18   1   1   .   .   .   .   .   .   .   .   .    3   .   HB1   parsed_1dmd   1   
         18   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         19   1   1   .   .   .   .   .   .   .   .   .    3   .   HB2   parsed_1dmd   1   
         19   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         20   1   1   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
         20   1   2   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         21   1   1   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
         21   1   2   .   .   .   .   .   .   .   .   .    6   .   HB1   parsed_1dmd   1   
         22   1   1   .   .   .   .   .   .   .   .   .    3   .   HN    parsed_1dmd   1   
         22   1   2   .   .   .   .   .   .   .   .   .    6   .   HB2   parsed_1dmd   1   
         23   1   1   .   .   .   .   .   .   .   .   .    3   .   HB2   parsed_1dmd   1   
         23   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         24   1   1   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         24   1   2   .   .   .   .   .   .   .   .   .    4   .   HB#   parsed_1dmd   1   
         25   1   1   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         25   1   2   .   .   .   .   .   .   .   .   .    4   .   HG#   parsed_1dmd   1   
         26   1   1   .   .   .   .   .   .   .   .   .    4   .   HA    parsed_1dmd   1   
         26   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         27   1   1   .   .   .   .   .   .   .   .   .    4   .   HN    parsed_1dmd   1   
         27   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         28   1   1   .   .   .   .   .   .   .   .   .    4   .   HB#   parsed_1dmd   1   
         28   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         29   1   1   .   .   .   .   .   .   .   .   .    4   .   HG#   parsed_1dmd   1   
         29   1   2   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         30   1   1   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         30   1   2   .   .   .   .   .   .   .   .   .    5   .   HB#   parsed_1dmd   1   
         31   1   1   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         31   1   2   .   .   .   .   .   .   .   .   .    5   .   HG#   parsed_1dmd   1   
         32   1   1   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         32   1   2   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         33   1   1   .   .   .   .   .   .   .   .   .    5   .   HA    parsed_1dmd   1   
         33   1   2   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         34   1   1   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         34   1   2   .   .   .   .   .   .   .   .   .    6   .   HB2   parsed_1dmd   1   
         35   1   1   .   .   .   .   .   .   .   .   .    5   .   HN    parsed_1dmd   1   
         35   1   2   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         36   1   1   .   .   .   .   .   .   .   .   .    5   .   HB#   parsed_1dmd   1   
         36   1   2   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         37   1   1   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         37   1   2   .   .   .   .   .   .   .   .   .    6   .   HB1   parsed_1dmd   1   
         38   1   1   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         38   1   2   .   .   .   .   .   .   .   .   .    6   .   HB2   parsed_1dmd   1   
         39   1   1   .   .   .   .   .   .   .   .   .    6   .   HN    parsed_1dmd   1   
         39   1   2   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         40   1   1   .   .   .   .   .   .   .   .   .    6   .   HA    parsed_1dmd   1   
         40   1   2   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         41   1   1   .   .   .   .   .   .   .   .   .    6   .   HB2   parsed_1dmd   1   
         41   1   2   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         42   1   1   .   .   .   .   .   .   .   .   .    6   .   HA    parsed_1dmd   1   
         42   1   2   .   .   .   .   .   .   .   .   .   10   .   HA    parsed_1dmd   1   
         43   1   1   .   .   .   .   .   .   .   .   .    6   .   HA    parsed_1dmd   1   
         43   1   2   .   .   .   .   .   .   .   .   .   11   .   HN    parsed_1dmd   1   
         44   1   1   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         44   1   2   .   .   .   .   .   .   .   .   .    8   .   HN    parsed_1dmd   1   
         45   1   1   .   .   .   .   .   .   .   .   .    7   .   HA    parsed_1dmd   1   
         45   1   2   .   .   .   .   .   .   .   .   .    8   .   HN    parsed_1dmd   1   
         46   1   1   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         46   1   2   .   .   .   .   .   .   .   .   .    7   .   HB    parsed_1dmd   1   
         47   1   1   .   .   .   .   .   .   .   .   .    7   .   HN    parsed_1dmd   1   
         47   1   2   .   .   .   .   .   .   .   .   .    7   .   HG#   parsed_1dmd   1   
         48   1   1   .   .   .   .   .   .   .   .   .    7   .   HA    parsed_1dmd   1   
         48   1   2   .   .   .   .   .   .   .   .   .    9   .   HN    parsed_1dmd   1   
         49   1   1   .   .   .   .   .   .   .   .   .    7   .   HG#   parsed_1dmd   1   
         49   1   2   .   .   .   .   .   .   .   .   .    8   .   HN    parsed_1dmd   1   
         50   1   1   .   .   .   .   .   .   .   .   .    8   .   HN    parsed_1dmd   1   
         50   1   2   .   .   .   .   .   .   .   .   .    9   .   HN    parsed_1dmd   1   
         51   1   1   .   .   .   .   .   .   .   .   .    8   .   HA    parsed_1dmd   1   
         51   1   2   .   .   .   .   .   .   .   .   .    9   .   HN    parsed_1dmd   1   
         52   1   1   .   .   .   .   .   .   .   .   .    8   .   HB#   parsed_1dmd   1   
         52   1   2   .   .   .   .   .   .   .   .   .    8   .   HN    parsed_1dmd   1   
         53   1   1   .   .   .   .   .   .   .   .   .    8   .   HB#   parsed_1dmd   1   
         53   1   2   .   .   .   .   .   .   .   .   .    9   .   HN    parsed_1dmd   1   
         54   1   1   .   .   .   .   .   .   .   .   .    9   .   HN    parsed_1dmd   1   
         54   1   2   .   .   .   .   .   .   .   .   .   10   .   HN    parsed_1dmd   1   
         55   1   1   .   .   .   .   .   .   .   .   .    9   .   HA#   parsed_1dmd   1   
         55   1   2   .   .   .   .   .   .   .   .   .   10   .   HN    parsed_1dmd   1   
         56   1   1   .   .   .   .   .   .   .   .   .   10   .   HN    parsed_1dmd   1   
         56   1   2   .   .   .   .   .   .   .   .   .   10   .   HB#   parsed_1dmd   1   
         57   1   1   .   .   .   .   .   .   .   .   .   10   .   HA    parsed_1dmd   1   
         57   1   2   .   .   .   .   .   .   .   .   .   11   .   HN    parsed_1dmd   1   
         58   1   1   .   .   .   .   .   .   .   .   .   10   .   HA    parsed_1dmd   1   
         58   1   2   .   .   .   .   .   .   .   .   .   12   .   HN    parsed_1dmd   1   
         59   1   1   .   .   .   .   .   .   .   .   .   11   .   HN    parsed_1dmd   1   
         59   1   2   .   .   .   .   .   .   .   .   .   11   .   HB#   parsed_1dmd   1   
         60   1   1   .   .   .   .   .   .   .   .   .   11   .   HN    parsed_1dmd   1   
         60   1   2   .   .   .   .   .   .   .   .   .   12   .   HN    parsed_1dmd   1   
         61   1   1   .   .   .   .   .   .   .   .   .   11   .   HA    parsed_1dmd   1   
         61   1   2   .   .   .   .   .   .   .   .   .   12   .   HN    parsed_1dmd   1   
         62   1   1   .   .   .   .   .   .   .   .   .   12   .   HN    parsed_1dmd   1   
         62   1   2   .   .   .   .   .   .   .   .   .   12   .   HB1   parsed_1dmd   1   
         63   1   1   .   .   .   .   .   .   .   .   .   12   .   HN    parsed_1dmd   1   
         63   1   2   .   .   .   .   .   .   .   .   .   12   .   HB2   parsed_1dmd   1   
         64   1   1   .   .   .   .   .   .   .   .   .   12   .   HA    parsed_1dmd   1   
         64   1   2   .   .   .   .   .   .   .   .   .   13   .   HN    parsed_1dmd   1   
         65   1   1   .   .   .   .   .   .   .   .   .   12   .   HB1   parsed_1dmd   1   
         65   1   2   .   .   .   .   .   .   .   .   .   13   .   HN    parsed_1dmd   1   
         66   1   1   .   .   .   .   .   .   .   .   .   12   .   HB1   parsed_1dmd   1   
         66   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
         67   1   1   .   .   .   .   .   .   .   .   .   12   .   HB2   parsed_1dmd   1   
         67   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
         68   1   1   .   .   .   .   .   .   .   .   .   12   .   HB1   parsed_1dmd   1   
         68   1   2   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
         69   1   1   .   .   .   .   .   .   .   .   .   12   .   HB2   parsed_1dmd   1   
         69   1   2   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
         70   1   1   .   .   .   .   .   .   .   .   .   12   .   HB2   parsed_1dmd   1   
         70   1   2   .   .   .   .   .   .   .   .   .   29   .   HA    parsed_1dmd   1   
         71   1   1   .   .   .   .   .   .   .   .   .   12   .   HB1   parsed_1dmd   1   
         71   1   2   .   .   .   .   .   .   .   .   .   30   .   HD#   parsed_1dmd   1   
         72   1   1   .   .   .   .   .   .   .   .   .   12   .   HB2   parsed_1dmd   1   
         72   1   2   .   .   .   .   .   .   .   .   .   30   .   HD#   parsed_1dmd   1   
         73   1   1   .   .   .   .   .   .   .   .   .   13   .   HN    parsed_1dmd   1   
         73   1   2   .   .   .   .   .   .   .   .   .   13   .   HB#   parsed_1dmd   1   
         74   1   1   .   .   .   .   .   .   .   .   .   13   .   HA    parsed_1dmd   1   
         74   1   2   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         75   1   1   .   .   .   .   .   .   .   .   .   13   .   HN    parsed_1dmd   1   
         75   1   2   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         76   1   1   .   .   .   .   .   .   .   .   .   13   .   HB#   parsed_1dmd   1   
         76   1   2   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         77   1   1   .   .   .   .   .   .   .   .   .   13   .   HN    parsed_1dmd   1   
         77   1   2   .   .   .   .   .   .   .   .   .   17   .   HB#   parsed_1dmd   1   
         78   1   1   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         78   1   2   .   .   .   .   .   .   .   .   .   14   .   HB#   parsed_1dmd   1   
         79   1   1   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         79   1   2   .   .   .   .   .   .   .   .   .   15   .   HN    parsed_1dmd   1   
         80   1   1   .   .   .   .   .   .   .   .   .   14   .   HA    parsed_1dmd   1   
         80   1   2   .   .   .   .   .   .   .   .   .   15   .   HN    parsed_1dmd   1   
         81   1   1   .   .   .   .   .   .   .   .   .   14   .   HA    parsed_1dmd   1   
         81   1   2   .   .   .   .   .   .   .   .   .   15   .   HA    parsed_1dmd   1   
         82   1   1   .   .   .   .   .   .   .   .   .   14   .   HB#   parsed_1dmd   1   
         82   1   2   .   .   .   .   .   .   .   .   .   15   .   HN    parsed_1dmd   1   
         83   1   1   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         83   1   2   .   .   .   .   .   .   .   .   .   17   .   HB#   parsed_1dmd   1   
         84   1   1   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         84   1   2   .   .   .   .   .   .   .   .   .   17   .   HG#   parsed_1dmd   1   
         85   1   1   .   .   .   .   .   .   .   .   .   14   .   HN    parsed_1dmd   1   
         85   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
         86   1   1   .   .   .   .   .   .   .   .   .   15   .   HN    parsed_1dmd   1   
         86   1   2   .   .   .   .   .   .   .   .   .   16   .   HN    parsed_1dmd   1   
         87   1   1   .   .   .   .   .   .   .   .   .   15   .   HA    parsed_1dmd   1   
         87   1   2   .   .   .   .   .   .   .   .   .   16   .   HN    parsed_1dmd   1   
         88   1   1   .   .   .   .   .   .   .   .   .   15   .   HA    parsed_1dmd   1   
         88   1   2   .   .   .   .   .   .   .   .   .   18   .   HB2   parsed_1dmd   1   
         89   1   1   .   .   .   .   .   .   .   .   .   15   .   HA    parsed_1dmd   1   
         89   1   2   .   .   .   .   .   .   .   .   .   18   .   HB1   parsed_1dmd   1   
         90   1   1   .   .   .   .   .   .   .   .   .   15   .   HN    parsed_1dmd   1   
         90   1   2   .   .   .   .   .   .   .   .   .   15   .   HB#   parsed_1dmd   1   
         91   1   1   .   .   .   .   .   .   .   .   .   15   .   HN    parsed_1dmd   1   
         91   1   2   .   .   .   .   .   .   .   .   .   15   .   HG#   parsed_1dmd   1   
         92   1   1   .   .   .   .   .   .   .   .   .   15   .   HA    parsed_1dmd   1   
         92   1   2   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
         93   1   1   .   .   .   .   .   .   .   .   .   16   .   HN    parsed_1dmd   1   
         93   1   2   .   .   .   .   .   .   .   .   .   16   .   HB#   parsed_1dmd   1   
         94   1   1   .   .   .   .   .   .   .   .   .   16   .   HN    parsed_1dmd   1   
         94   1   2   .   .   .   .   .   .   .   .   .   16   .   HG#   parsed_1dmd   1   
         95   1   1   .   .   .   .   .   .   .   .   .   16   .   HN    parsed_1dmd   1   
         95   1   2   .   .   .   .   .   .   .   .   .   17   .   HN    parsed_1dmd   1   
         96   1   1   .   .   .   .   .   .   .   .   .   16   .   HB#   parsed_1dmd   1   
         96   1   2   .   .   .   .   .   .   .   .   .   17   .   HN    parsed_1dmd   1   
         97   1   1   .   .   .   .   .   .   .   .   .   17   .   HN    parsed_1dmd   1   
         97   1   2   .   .   .   .   .   .   .   .   .   17   .   HB#   parsed_1dmd   1   
         98   1   1   .   .   .   .   .   .   .   .   .   17   .   HN    parsed_1dmd   1   
         98   1   2   .   .   .   .   .   .   .   .   .   17   .   HG#   parsed_1dmd   1   
         99   1   1   .   .   .   .   .   .   .   .   .   17   .   HN    parsed_1dmd   1   
         99   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        100   1   1   .   .   .   .   .   .   .   .   .   17   .   HA    parsed_1dmd   1   
        100   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        101   1   1   .   .   .   .   .   .   .   .   .   17   .   HB#   parsed_1dmd   1   
        101   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        102   1   1   .   .   .   .   .   .   .   .   .   17   .   HG#   parsed_1dmd   1   
        102   1   2   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        103   1   1   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        103   1   2   .   .   .   .   .   .   .   .   .   18   .   HB1   parsed_1dmd   1   
        104   1   1   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        104   1   2   .   .   .   .   .   .   .   .   .   18   .   HB2   parsed_1dmd   1   
        105   1   1   .   .   .   .   .   .   .   .   .   18   .   HN    parsed_1dmd   1   
        105   1   2   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        106   1   1   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
        106   1   2   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        107   1   1   .   .   .   .   .   .   .   .   .   18   .   HB1   parsed_1dmd   1   
        107   1   2   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        108   1   1   .   .   .   .   .   .   .   .   .   18   .   HB2   parsed_1dmd   1   
        108   1   2   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        109   1   1   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
        109   1   2   .   .   .   .   .   .   .   .   .   21   .   HN    parsed_1dmd   1   
        110   1   1   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
        110   1   2   .   .   .   .   .   .   .   .   .   21   .   HG#   parsed_1dmd   1   
        111   1   1   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
        111   1   2   .   .   .   .   .   .   .   .   .   21   .   HN    parsed_1dmd   1   
        112   1   1   .   .   .   .   .   .   .   .   .   18   .   HA    parsed_1dmd   1   
        112   1   2   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        113   1   1   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        113   1   2   .   .   .   .   .   .   .   .   .   19   .   HB#   parsed_1dmd   1   
        114   1   1   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        114   1   2   .   .   .   .   .   .   .   .   .   20   .   HB#   parsed_1dmd   1   
        115   1   1   .   .   .   .   .   .   .   .   .   19   .   HN    parsed_1dmd   1   
        115   1   2   .   .   .   .   .   .   .   .   .   20   .   HN    parsed_1dmd   1   
        116   1   1   .   .   .   .   .   .   .   .   .   19   .   HB#   parsed_1dmd   1   
        116   1   2   .   .   .   .   .   .   .   .   .   20   .   HN    parsed_1dmd   1   
        117   1   1   .   .   .   .   .   .   .   .   .   20   .   HN    parsed_1dmd   1   
        117   1   2   .   .   .   .   .   .   .   .   .   20   .   HB#   parsed_1dmd   1   
        118   1   1   .   .   .   .   .   .   .   .   .   20   .   HN    parsed_1dmd   1   
        118   1   2   .   .   .   .   .   .   .   .   .   20   .   HG#   parsed_1dmd   1   
        119   1   1   .   .   .   .   .   .   .   .   .   20   .   HN    parsed_1dmd   1   
        119   1   2   .   .   .   .   .   .   .   .   .   21   .   HN    parsed_1dmd   1   
        120   1   1   .   .   .   .   .   .   .   .   .   20   .   HA    parsed_1dmd   1   
        120   1   2   .   .   .   .   .   .   .   .   .   21   .   HN    parsed_1dmd   1   
        121   1   1   .   .   .   .   .   .   .   .   .   20   .   HA    parsed_1dmd   1   
        121   1   2   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        122   1   1   .   .   .   .   .   .   .   .   .   21   .   HN    parsed_1dmd   1   
        122   1   2   .   .   .   .   .   .   .   .   .   21   .   HB#   parsed_1dmd   1   
        123   1   1   .   .   .   .   .   .   .   .   .   21   .   HN    parsed_1dmd   1   
        123   1   2   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        124   1   1   .   .   .   .   .   .   .   .   .   21   .   HA    parsed_1dmd   1   
        124   1   2   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        125   1   1   .   .   .   .   .   .   .   .   .   21   .   HB#   parsed_1dmd   1   
        125   1   2   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        126   1   1   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        126   1   2   .   .   .   .   .   .   .   .   .   22   .   HB1   parsed_1dmd   1   
        127   1   1   .   .   .   .   .   .   .   .   .   22   .   HN    parsed_1dmd   1   
        127   1   2   .   .   .   .   .   .   .   .   .   22   .   HB2   parsed_1dmd   1   
        128   1   1   .   .   .   .   .   .   .   .   .   22   .   HA    parsed_1dmd   1   
        128   1   2   .   .   .   .   .   .   .   .   .   23   .   HN    parsed_1dmd   1   
        129   1   1   .   .   .   .   .   .   .   .   .   22   .   HB1   parsed_1dmd   1   
        129   1   2   .   .   .   .   .   .   .   .   .   23   .   HN    parsed_1dmd   1   
        130   1   1   .   .   .   .   .   .   .   .   .   22   .   HB2   parsed_1dmd   1   
        130   1   2   .   .   .   .   .   .   .   .   .   23   .   HN    parsed_1dmd   1   
        131   1   1   .   .   .   .   .   .   .   .   .   22   .   HB1   parsed_1dmd   1   
        131   1   2   .   .   .   .   .   .   .   .   .   24   .   HN    parsed_1dmd   1   
        132   1   1   .   .   .   .   .   .   .   .   .   22   .   HB2   parsed_1dmd   1   
        132   1   2   .   .   .   .   .   .   .   .   .   24   .   HN    parsed_1dmd   1   
        133   1   1   .   .   .   .   .   .   .   .   .   23   .   HN    parsed_1dmd   1   
        133   1   2   .   .   .   .   .   .   .   .   .   23   .   HB    parsed_1dmd   1   
        134   1   1   .   .   .   .   .   .   .   .   .   23   .   HN    parsed_1dmd   1   
        134   1   2   .   .   .   .   .   .   .   .   .   23   .   HG#   parsed_1dmd   1   
        135   1   1   .   .   .   .   .   .   .   .   .   23   .   HN    parsed_1dmd   1   
        135   1   2   .   .   .   .   .   .   .   .   .   24   .   HN    parsed_1dmd   1   
        136   1   1   .   .   .   .   .   .   .   .   .   23   .   HA    parsed_1dmd   1   
        136   1   2   .   .   .   .   .   .   .   .   .   24   .   HN    parsed_1dmd   1   
        137   1   1   .   .   .   .   .   .   .   .   .   23   .   HB    parsed_1dmd   1   
        137   1   2   .   .   .   .   .   .   .   .   .   24   .   HN    parsed_1dmd   1   
        138   1   1   .   .   .   .   .   .   .   .   .   23   .   HG#   parsed_1dmd   1   
        138   1   2   .   .   .   .   .   .   .   .   .   24   .   HN    parsed_1dmd   1   
        139   1   1   .   .   .   .   .   .   .   .   .   24   .   HA    parsed_1dmd   1   
        139   1   2   .   .   .   .   .   .   .   .   .   25   .   HD#   parsed_1dmd   1   
        140   1   1   .   .   .   .   .   .   .   .   .   25   .   HA    parsed_1dmd   1   
        140   1   2   .   .   .   .   .   .   .   .   .   26   .   HN    parsed_1dmd   1   
        141   1   1   .   .   .   .   .   .   .   .   .   25   .   HA    parsed_1dmd   1   
        141   1   2   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
        142   1   1   .   .   .   .   .   .   .   .   .   25   .   HA    parsed_1dmd   1   
        142   1   2   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        143   1   1   .   .   .   .   .   .   .   .   .   26   .   HN    parsed_1dmd   1   
        143   1   2   .   .   .   .   .   .   .   .   .   26   .   HB1   parsed_1dmd   1   
        144   1   1   .   .   .   .   .   .   .   .   .   26   .   HN    parsed_1dmd   1   
        144   1   2   .   .   .   .   .   .   .   .   .   26   .   HB2   parsed_1dmd   1   
        145   1   1   .   .   .   .   .   .   .   .   .   26   .   HA    parsed_1dmd   1   
        145   1   2   .   .   .   .   .   .   .   .   .   27   .   HN    parsed_1dmd   1   
        146   1   1   .   .   .   .   .   .   .   .   .   26   .   HB1   parsed_1dmd   1   
        146   1   2   .   .   .   .   .   .   .   .   .   27   .   HN    parsed_1dmd   1   
        147   1   1   .   .   .   .   .   .   .   .   .   26   .   HB2   parsed_1dmd   1   
        147   1   2   .   .   .   .   .   .   .   .   .   27   .   HN    parsed_1dmd   1   
        148   1   1   .   .   .   .   .   .   .   .   .   26   .   HN    parsed_1dmd   1   
        148   1   2   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        149   1   1   .   .   .   .   .   .   .   .   .   26   .   HN    parsed_1dmd   1   
        149   1   2   .   .   .   .   .   .   .   .   .   29   .   HB2   parsed_1dmd   1   
        150   1   1   .   .   .   .   .   .   .   .   .   26   .   HB1   parsed_1dmd   1   
        150   1   2   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        151   1   1   .   .   .   .   .   .   .   .   .   26   .   HB2   parsed_1dmd   1   
        151   1   2   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        152   1   1   .   .   .   .   .   .   .   .   .   26   .   HB1   parsed_1dmd   1   
        152   1   2   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
        153   1   1   .   .   .   .   .   .   .   .   .   26   .   HB2   parsed_1dmd   1   
        153   1   2   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
        154   1   1   .   .   .   .   .   .   .   .   .   27   .   HN    parsed_1dmd   1   
        154   1   2   .   .   .   .   .   .   .   .   .   27   .   HB#   parsed_1dmd   1   
        155   1   1   .   .   .   .   .   .   .   .   .   27   .   HA    parsed_1dmd   1   
        155   1   2   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
        156   1   1   .   .   .   .   .   .   .   .   .   27   .   HN    parsed_1dmd   1   
        156   1   2   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
        157   1   1   .   .   .   .   .   .   .   .   .   28   .   HA    parsed_1dmd   1   
        157   1   2   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        158   1   1   .   .   .   .   .   .   .   .   .   28   .   HN    parsed_1dmd   1   
        158   1   2   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        159   1   1   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        159   1   2   .   .   .   .   .   .   .   .   .   29   .   HB1   parsed_1dmd   1   
        160   1   1   .   .   .   .   .   .   .   .   .   29   .   HN    parsed_1dmd   1   
        160   1   2   .   .   .   .   .   .   .   .   .   29   .   HB2   parsed_1dmd   1   
        161   1   1   .   .   .   .   .   .   .   .   .   29   .   HA    parsed_1dmd   1   
        161   1   2   .   .   .   .   .   .   .   .   .   30   .   HD#   parsed_1dmd   1   
        162   1   1   .   .   .   .   .   .   .   .   .   29   .   HA    parsed_1dmd   1   
        162   1   2   .   .   .   .   .   .   .   .   .   30   .   HA    parsed_1dmd   1   
        163   1   1   .   .   .   .   .   .   .   .   .   29   .   HB2   parsed_1dmd   1   
        163   1   2   .   .   .   .   .   .   .   .   .   30   .   HG#   parsed_1dmd   1   
        164   1   1   .   .   .   .   .   .   .   .   .   29   .   HB2   parsed_1dmd   1   
        164   1   2   .   .   .   .   .   .   .   .   .   30   .   HD#   parsed_1dmd   1   
        165   1   1   .   .   .   .   .   .   .   .   .   30   .   HA    parsed_1dmd   1   
        165   1   2   .   .   .   .   .   .   .   .   .   31   .   HN    parsed_1dmd   1   
        166   1   1   .   .   .   .   .   .   .   .   .   30   .   HB#   parsed_1dmd   1   
        166   1   2   .   .   .   .   .   .   .   .   .   31   .   HN    parsed_1dmd   1   
        167   1   1   .   .   .   .   .   .   .   .   .   31   .   HN    parsed_1dmd   1   
        167   1   2   .   .   .   .   .   .   .   .   .   31   .   HB#   parsed_1dmd   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   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
          2   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
          3   1   .   .   .   .   .   1.8   1.8   3.4   parsed_1dmd   1   
          4   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
          5   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
          6   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
          7   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
          8   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
          9   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         10   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
         11   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         12   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         13   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         14   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         15   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         16   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         17   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         18   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         19   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         20   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         21   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         22   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         23   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         24   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         25   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         26   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         27   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         28   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         29   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
         30   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         31   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         32   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         33   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         34   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         35   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         36   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         37   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         38   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         39   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         40   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         41   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         42   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         43   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         44   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         45   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         46   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         47   1   .   .   .   .   .   1.8   1.8   4.7   parsed_1dmd   1   
         48   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         49   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
         50   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         51   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         52   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         53   1   .   .   .   .   .   1.8   1.8   5.5   parsed_1dmd   1   
         54   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         55   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         56   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         57   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         58   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         59   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         60   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         61   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         62   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         63   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         64   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         65   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         66   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         67   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         68   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         69   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         70   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         71   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         72   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         73   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         74   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         75   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         76   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         77   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
         78   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         79   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         80   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         81   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         82   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
         83   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         84   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
         85   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         86   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         87   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
         88   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         89   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
         90   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         91   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         92   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
         93   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         94   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
         95   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
         96   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         97   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         98   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
         99   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        100   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        101   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        102   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
        103   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        104   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        105   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        106   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        107   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        108   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        109   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        110   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
        111   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        112   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        113   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        114   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        115   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        116   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        117   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
        118   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
        119   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        120   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        121   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        122   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
        123   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        124   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        125   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
        126   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        127   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        128   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        129   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        130   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        131   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        132   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        133   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        134   1   .   .   .   .   .   1.8   1.8   4.2   parsed_1dmd   1   
        135   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        136   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        137   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        138   1   .   .   .   .   .   1.8   1.8   4.6   parsed_1dmd   1   
        139   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        140   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        141   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        142   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        143   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        144   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        145   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        146   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        147   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        148   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        149   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        150   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        151   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        152   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        153   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        154   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        155   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        156   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        157   1   .   .   .   .   .   1.8   1.8   3.6   parsed_1dmd   1   
        158   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        159   1   .   .   .   .   .   1.8   1.8   3.2   parsed_1dmd   1   
        160   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        161   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        162   1   .   .   .   .   .   1.8   1.8   4.5   parsed_1dmd   1   
        163   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        164   1   .   .   .   .   .   1.8   1.8   5.5   parsed_1dmd   1   
        165   1   .   .   .   .   .   1.8   1.8   2.7   parsed_1dmd   1   
        166   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   1   
        167   1   .   .   .   .   .   1.8   1.8   3.7   parsed_1dmd   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   "July 9"                                                                                                                                                                                                      1   76     1    84   parsed_1dmd   1   
         2   "July 8"                                                                                                                                                                                                      2   76     2    84   parsed_1dmd   1   
         3   "0.6 added"                                                                                                                                                                                                   3   77     3    87   parsed_1dmd   1   
         4   "1.4 to 1.8 23 24,July 8"                                                                                                                                                                                     6   77     6   101   parsed_1dmd   1   
         5   
;
19 24, July 8
assign (resid    2 and  name HD#   )(resid   19 and  name HA   ) 1.8 0.0 2.8 !Careful
;
                                                                                                         7   77     8    87   parsed_1dmd   1   
         6                                                                                                      19     9   77     9    80   parsed_1dmd   1   
         7   
;
0.9 to 1.4 23
assign (resid    2 and  name HA   )(resid   27 and  name HN  ) 1.8 0.0 1.8 ! Feb 20, 23,July 9
;
                                                                                                        10   78    11    96   parsed_1dmd   1   
         8   "July 9, D to G"                                                                                                                                                                                             12   77    12    93   parsed_1dmd   1   
         9                                                                                                      19    14   76    14    79   parsed_1dmd   1   
        10   "July 8"                                                                                                                                                                                                     16   77    16    85   parsed_1dmd   1   
        11   "July 8"                                                                                                                                                                                                     17   77    17    86   parsed_1dmd   1   
        12                                                                                                      19    20   77    20    80   parsed_1dmd   1   
        13                                                                                                      19    21   77    21    80   parsed_1dmd   1   
        14                                                                                                      19    23   77    23    80   parsed_1dmd   1   
        15   
;
0.9 to 1.4 26, July 8
assign (resid    3 and  name HA   )(resid   16 and  name HN  ) 1.8 0.0 1.4 ! Feb 20,23, July 9
assign (resid    3 and  name HA   )(resid   17 and  name HN  ) 1.8 0.0 1.8 ! Feb 20, July 9
;
                                                                                                        24   77    26    93   parsed_1dmd   1   
        16   "July 8"                                                                                                                                                                                                     27   76    27    84   parsed_1dmd   1   
        17   "July 8"                                                                                                                                                                                                     32   76    32    84   parsed_1dmd   1   
        18   "July 8"                                                                                                                                                                                                     33   76    33    84   parsed_1dmd   1   
        19                                                                                                      19    38   77    38    80   parsed_1dmd   1   
        20   "July 8"                                                                                                                                                                                                     40   76    40    84   parsed_1dmd   1   
        21   "1.4 to 1.8 26"                                                                                                                                                                                              45   77    45    91   parsed_1dmd   1   
        22                                                                                                      19    46   77    46    80   parsed_1dmd   1   
        23   "Feb 20, July 8"                                                                                                                                                                                             47   76    47    92   parsed_1dmd   1   
        24   "(0.5 added)"                                                                                                                                                                                                51   77    51    89   parsed_1dmd   1   
        25   "assign (resid    7 and  name HN   )(resid   13 and  name HA   ) 1.8 0.0 2.7 !19 , 23"                                                                                                                       53    1    53    86   parsed_1dmd   1   
        26   "July 8"                                                                                                                                                                                                     54   77    54    85   parsed_1dmd   1   
        27   
;
assign (resid    10 and  name HB#   )(resid   28 and  name HA   ) 1.8 0.0 2.7 !19, 23, July 9
assign (resid    10 and  name HB#   )(resid   19 and  name HA   ) 1.8 0.0 3.7 !19, 23
;
                                                                                                        64    1    65    87   parsed_1dmd   1   
        28   "19, 1.4 to 1.8 23, July 8"                                                                                                                                                                                  73   79    73   105   parsed_1dmd   1   
        29   "19,23, July 8"                                                                                                                                                                                              74   79    74    93   parsed_1dmd   1   
        30   "19, 9 to 1.4 23"                                                                                                                                                                                            75   79    75    95   parsed_1dmd   1   
        31   
;
19
assign (resid    12 and  name HB1   )(resid   29 and  name HA   ) 1.8 0.0 2.7 !19, could be SD, July 9
;
                                                                                                        76   79    77   104   parsed_1dmd   1   
        32                                                                                                      19    78   79    78    82   parsed_1dmd   1   
        33                                                                                                      19    79   80    79    83   parsed_1dmd   1   
        34                                                                                                      19    80   80    80    83   parsed_1dmd   1   
        35                                                                                                      19    85   79    85    82   parsed_1dmd   1   
        36                                                                                                      19    89   78    89    81   parsed_1dmd   1   
        37                                                                                                      19    91   79    91    82   parsed_1dmd   1   
        38                                                                                                      19    92   79    92    82   parsed_1dmd   1   
        39                                                                                                      19    96   79    96    82   parsed_1dmd   1   
        40                                                                                                      19    97   79    97    82   parsed_1dmd   1   
        41   "19, corrected 23"                                                                                                                                                                                          100   78   100    95   parsed_1dmd   1   
        42                                                                                                      19   102   78   102    81   parsed_1dmd   1   
        43                                                                                                      19   106   79   106    82   parsed_1dmd   1   
        44                                                                                                      19   110   79   110    82   parsed_1dmd   1   
        45   "0.9 to 1.4 24"                                                                                                                                                                                             115   79   115    93   parsed_1dmd   1   
        46   "assign (resid    18 and  name HA   )(resid   21 and  name HA   ) 1.8 0.0 1.4 !Careful, July 9"                                                                                                             117    1   117    95   parsed_1dmd   1   
        47   "July 8"                                                                                                                                                                                                    118   78   118    86   parsed_1dmd   1   
        48                                                                                                      19   119   79   119    82   parsed_1dmd   1   
        49   "July 8"                                                                                                                                                                                                    120   78   120    86   parsed_1dmd   1   
        50                                                                                                      19   123   79   123    82   parsed_1dmd   1   
        51                                                                                                      19   127   79   127    82   parsed_1dmd   1   
        52   
;
23, July 8
assign (resid    20 and  name HN   )(resid   22 and  name HN  ) 1.8 0.0 1.8 ! Feb 20, July 8
;
                                                                                                       130   78   131    94   parsed_1dmd   1   
        53   "0.9 to 1.4 24"                                                                                                                                                                                             133   78   133    92   parsed_1dmd   1   
        54                                                                                                      19   141   79   141    82   parsed_1dmd   1   
        55                                                                                                      19   142   79   142    82   parsed_1dmd   1   
        56   
;
assign (resid    23 and  name HA   )(resid   26 and  name HN   ) 1.8 0.0 2.7 !19, SD?
assign (resid    23 and  name HN   )(resid   29 and  name HN   ) 1.8 0.0 2.7 !careful, 23
;
                                                                                                       149    1   150    91   parsed_1dmd   1   
        57   "assign (resid    25 and  name HA   )(resid   27 and  name HN   ) 1.8 0.0 1.8 ! careful"                                                                                                                    153    1   153    88   parsed_1dmd   1   
        58                                                                                                      19   154   78   154    81   parsed_1dmd   1   
        59                                                                                                      19   155   78   155    81   parsed_1dmd   1   
        60   "0.9 to 1.4 23"                                                                                                                                                                                             158   78   158    92   parsed_1dmd   1   
        61   "0.9 to 1.8 23"                                                                                                                                                                                             159   79   159    93   parsed_1dmd   1   
        62   "19, 9 to 1.4 23"                                                                                                                                                                                           162   79   162    95   parsed_1dmd   1   
        63                                                                                                      19   163   79   163    82   parsed_1dmd   1   
        64                                                                                                      19   164   79   164    83   parsed_1dmd   1   
        65   "Feb 20"                                                                                                                                                                                                    165   78   165    86   parsed_1dmd   1   
        66   "Feb 20"                                                                                                                                                                                                    166   78   166    87   parsed_1dmd   1   
        67   "assign (resid    29 and  name HA   )(resid   30 and  name HG#   ) 1.8 0.0 1.9 !19 (or 3.7) Careful"                                                                                                        174    1   174   100   parsed_1dmd   1   
        68                                                                                                      19   176   78   176    81   parsed_1dmd   1   
        69                                                                                                      19   177   80   177    83   parsed_1dmd   1   
        70                                                                                                      19   178   80   178    83   parsed_1dmd   1   
    stop_

save_





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