NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
582267 |
2mfv   |
19573 | cing | 2-parsed | STAR | entry | full | 105 |
data_2mfv_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mfv
_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_2mfv 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mfv
_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 2mfv "Master copy" parsed_2mfv
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mfv
_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 2mfv.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mfv 1
1 2mfv.mr . . DYANA/DIANA 2 distance "general distance" simple 8 parsed_2mfv 1
1 2mfv.mr . . DYANA/DIANA 3 distance NOE simple 97 parsed_2mfv 1
1 2mfv.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mfv 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_2mfv
_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 UNKNOWN FUNCTION 23-OCT-13 2MFV
*TITLE STRUCTURE OF LASSO PEPTIDE XANTHOMONIN II
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: XANTHOMONIN II;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: UNP RESIDUES 29-42;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS GARDNERI;
*SOURCE 3 ORGANISM_TAXID: 925777;
*SOURCE 4 STRAIN: ATCC 19865;
*SOURCE 5 GENE: XGAA2, XGA_4059;
*SOURCE 6 EXPRESSION_SYSTEM: XANTHOMONAS GARDNERI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 90270;
*SOURCE 8 EXPRESSION_SYSTEM_STRAIN: DSM19127;
*SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET41A
*KEYWDS LASSO PEPTIDE, SEVEN-RESIDUE LASSO RING, UNKNOWN FUNCTION
*EXPDTA SOLUTION NMR
*NUMMDL 15
*AUTHOR J.D.HEGEMANN, M.ZIMMERMANN, K.HARMS, X.XIE, M.A.MARAHIEL
*REVDAT 1 29-OCT-14 2MFV 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mfv
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_2mfv 1
2 1 . . . parsed_2mfv 1
3 1 . . . parsed_2mfv 1
4 1 . . . parsed_2mfv 1
5 1 . . . parsed_2mfv 1
6 1 . . . parsed_2mfv 1
7 1 . . . parsed_2mfv 1
8 1 . . . parsed_2mfv 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 GLY N parsed_2mfv 1
1 1 2 . . . . . . . . . 7 GLUP CD parsed_2mfv 1
2 1 1 . . . . . . . . . 1 GLY N parsed_2mfv 1
2 1 2 . . . . . . . . . 7 GLUP OE parsed_2mfv 1
3 1 1 . . . . . . . . . 1 GLY N parsed_2mfv 1
3 1 2 . . . . . . . . . 7 GLUP CD parsed_2mfv 1
4 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 1
4 1 2 . . . . . . . . . 7 GLUP CD parsed_2mfv 1
5 1 1 . . . . . . . . . 1 GLY CA parsed_2mfv 1
5 1 2 . . . . . . . . . 7 GLUP CD parsed_2mfv 1
6 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 1
6 1 2 . . . . . . . . . 1 GLY CA parsed_2mfv 1
7 1 1 . . . . . . . . . 1 GLY CA parsed_2mfv 1
7 1 2 . . . . . . . . . 7 GLUP OE parsed_2mfv 1
8 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 1
8 1 2 . . . . . . . . . 7 GLUP OE parsed_2mfv 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 . . . . . . . 1.33 parsed_2mfv 1
2 1 . . . . . . . 2.26 parsed_2mfv 1
3 1 . . . . . . . 2.41 parsed_2mfv 1
4 1 . . . . . . . 2.06 parsed_2mfv 1
5 1 . . . . . . . 2.42 parsed_2mfv 1
6 1 . . . . . . . 2.09 parsed_2mfv 1
7 1 . . . . . . . 2.78 parsed_2mfv 1
8 1 . . . . . . . 3.17 parsed_2mfv 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 "CYANA Upper Limit File for molecule named: xanii14dm7p.upl" 1 1 1 62 parsed_2mfv 1
2 "based on NOESY 100 ms in DMSO-d6 at 305 K" 2 1 2 45 parsed_2mfv 1
3 "Atom names according to the convention of cyana.lib" 3 1 3 54 parsed_2mfv 1
4 "Upper limit distances produced by CYANA "caliba bb=1.64E+10"" 4 1 4 62 parsed_2mfv 1
5 "bb calculated manually by checking all the methylene peaks" 5 1 5 60 parsed_2mfv 1
6 "Partial stereo specific assignment to methylene protons" 6 1 6 57 parsed_2mfv 1
7 "done manually" 7 1 7 15 parsed_2mfv 1
8 "The stereo specific not assigned methylene protons are" 8 1 8 56 parsed_2mfv 1
9 "adjusted with the command "distance modify"" 9 1 9 45 parsed_2mfv 1
10 "Use the modified residue GLUP (side chain with a single OE" 10 1 10 60 parsed_2mfv 1
11 "for the -C=O) in the library cyana.lib edit by Xie" 11 1 11 52 parsed_2mfv 1
12 "Manual Input for proper geometry" 13 1 13 36 parsed_2mfv 1
13 "of side-chain/backbone peptide bond" 14 1 14 38 parsed_2mfv 1
14 "END Manual Input" 23 1 23 18 parsed_2mfv 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mfv
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_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_2mfv 2
2 1 . . . parsed_2mfv 2
3 1 . . . parsed_2mfv 2
4 1 . . . parsed_2mfv 2
5 1 . . . parsed_2mfv 2
6 1 . . . parsed_2mfv 2
7 1 . . . parsed_2mfv 2
8 1 . . . parsed_2mfv 2
9 1 . . . parsed_2mfv 2
10 1 . . . parsed_2mfv 2
11 1 . . . parsed_2mfv 2
12 1 . . . parsed_2mfv 2
13 1 . . . parsed_2mfv 2
14 1 . . . parsed_2mfv 2
15 1 . . . parsed_2mfv 2
16 1 . . . parsed_2mfv 2
17 1 . . . parsed_2mfv 2
18 1 . . . parsed_2mfv 2
19 1 . . . parsed_2mfv 2
20 1 . . . parsed_2mfv 2
21 1 . . . parsed_2mfv 2
22 1 . . . parsed_2mfv 2
23 1 . . . parsed_2mfv 2
24 1 . . . parsed_2mfv 2
25 1 . . . parsed_2mfv 2
26 1 . . . parsed_2mfv 2
27 1 . . . parsed_2mfv 2
28 1 . . . parsed_2mfv 2
29 1 . . . parsed_2mfv 2
30 1 . . . parsed_2mfv 2
31 1 . . . parsed_2mfv 2
32 1 . . . parsed_2mfv 2
33 1 . . . parsed_2mfv 2
34 1 . . . parsed_2mfv 2
35 1 . . . parsed_2mfv 2
36 1 . . . parsed_2mfv 2
37 1 . . . parsed_2mfv 2
38 1 . . . parsed_2mfv 2
39 1 . . . parsed_2mfv 2
40 1 . . . parsed_2mfv 2
41 1 . . . parsed_2mfv 2
42 1 . . . parsed_2mfv 2
43 1 . . . parsed_2mfv 2
44 1 . . . parsed_2mfv 2
45 1 . . . parsed_2mfv 2
46 1 . . . parsed_2mfv 2
47 1 . . . parsed_2mfv 2
48 1 . . . parsed_2mfv 2
49 1 . . . parsed_2mfv 2
50 1 . . . parsed_2mfv 2
51 1 . . . parsed_2mfv 2
52 1 . . . parsed_2mfv 2
53 1 . . . parsed_2mfv 2
54 1 . . . parsed_2mfv 2
55 1 . . . parsed_2mfv 2
56 1 . . . parsed_2mfv 2
57 1 . . . parsed_2mfv 2
58 1 . . . parsed_2mfv 2
59 1 . . . parsed_2mfv 2
60 1 . . . parsed_2mfv 2
61 1 . . . parsed_2mfv 2
62 1 . . . parsed_2mfv 2
63 1 . . . parsed_2mfv 2
64 1 . . . parsed_2mfv 2
65 1 . . . parsed_2mfv 2
66 1 . . . parsed_2mfv 2
67 1 . . . parsed_2mfv 2
68 1 . . . parsed_2mfv 2
69 1 . . . parsed_2mfv 2
70 1 . . . parsed_2mfv 2
71 1 . . . parsed_2mfv 2
72 1 . . . parsed_2mfv 2
73 1 . . . parsed_2mfv 2
74 1 . . . parsed_2mfv 2
75 1 . . . parsed_2mfv 2
76 1 . . . parsed_2mfv 2
77 1 . . . parsed_2mfv 2
78 1 . . . parsed_2mfv 2
79 1 . . . parsed_2mfv 2
80 1 . . . parsed_2mfv 2
81 1 . . . parsed_2mfv 2
82 1 . . . parsed_2mfv 2
83 1 . . . parsed_2mfv 2
84 1 . . . parsed_2mfv 2
85 1 . . . parsed_2mfv 2
86 1 . . . parsed_2mfv 2
87 1 . . . parsed_2mfv 2
88 1 . . . parsed_2mfv 2
89 1 . . . parsed_2mfv 2
90 1 . . . parsed_2mfv 2
91 1 . . . parsed_2mfv 2
92 1 . . . parsed_2mfv 2
93 1 . . . parsed_2mfv 2
94 1 . . . parsed_2mfv 2
95 1 . . . parsed_2mfv 2
96 1 . . . parsed_2mfv 2
97 1 . . . parsed_2mfv 2
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 GLY H parsed_2mfv 2
1 1 2 . . . . . . . . . 2 GLY H parsed_2mfv 2
2 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 2
2 1 2 . . . . . . . . . 7 GLUP QB parsed_2mfv 2
3 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 2
3 1 2 . . . . . . . . . 7 GLUP QG parsed_2mfv 2
4 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 2
4 1 2 . . . . . . . . . 11 GLY H parsed_2mfv 2
5 1 1 . . . . . . . . . 1 GLY H parsed_2mfv 2
5 1 2 . . . . . . . . . 11 GLY HA2 parsed_2mfv 2
6 1 1 . . . . . . . . . 1 GLY HA2 parsed_2mfv 2
6 1 2 . . . . . . . . . 2 GLY H parsed_2mfv 2
7 1 1 . . . . . . . . . 1 GLY HA3 parsed_2mfv 2
7 1 2 . . . . . . . . . 2 GLY H parsed_2mfv 2
8 1 1 . . . . . . . . . 2 GLY H parsed_2mfv 2
8 1 2 . . . . . . . . . 11 GLY H parsed_2mfv 2
9 1 1 . . . . . . . . . 2 GLY HA2 parsed_2mfv 2
9 1 2 . . . . . . . . . 12 ILE QG2 parsed_2mfv 2
10 1 1 . . . . . . . . . 2 GLY HA3 parsed_2mfv 2
10 1 2 . . . . . . . . . 3 PRO HD2 parsed_2mfv 2
11 1 1 . . . . . . . . . 2 GLY HA3 parsed_2mfv 2
11 1 2 . . . . . . . . . 3 PRO HD3 parsed_2mfv 2
12 1 1 . . . . . . . . . 3 PRO HA parsed_2mfv 2
12 1 2 . . . . . . . . . 4 LEU H parsed_2mfv 2
13 1 1 . . . . . . . . . 3 PRO HG2 parsed_2mfv 2
13 1 2 . . . . . . . . . 4 LEU H parsed_2mfv 2
14 1 1 . . . . . . . . . 3 PRO HG2 parsed_2mfv 2
14 1 2 . . . . . . . . . 4 LEU QB parsed_2mfv 2
15 1 1 . . . . . . . . . 3 PRO HG2 parsed_2mfv 2
15 1 2 . . . . . . . . . 4 LEU HG parsed_2mfv 2
16 1 1 . . . . . . . . . 3 PRO HG2 parsed_2mfv 2
16 1 2 . . . . . . . . . 12 ILE HG13 parsed_2mfv 2
17 1 1 . . . . . . . . . 3 PRO HD2 parsed_2mfv 2
17 1 2 . . . . . . . . . 4 LEU H parsed_2mfv 2
18 1 1 . . . . . . . . . 3 PRO HD2 parsed_2mfv 2
18 1 2 . . . . . . . . . 12 ILE HA parsed_2mfv 2
19 1 1 . . . . . . . . . 3 PRO HD2 parsed_2mfv 2
19 1 2 . . . . . . . . . 12 ILE QG2 parsed_2mfv 2
20 1 1 . . . . . . . . . 3 PRO HD2 parsed_2mfv 2
20 1 2 . . . . . . . . . 12 ILE HG13 parsed_2mfv 2
21 1 1 . . . . . . . . . 3 PRO HD3 parsed_2mfv 2
21 1 2 . . . . . . . . . 4 LEU H parsed_2mfv 2
22 1 1 . . . . . . . . . 3 PRO HD3 parsed_2mfv 2
22 1 2 . . . . . . . . . 12 ILE QG2 parsed_2mfv 2
23 1 1 . . . . . . . . . 4 LEU H parsed_2mfv 2
23 1 2 . . . . . . . . . 4 LEU QB parsed_2mfv 2
24 1 1 . . . . . . . . . 4 LEU H parsed_2mfv 2
24 1 2 . . . . . . . . . 4 LEU QQD parsed_2mfv 2
25 1 1 . . . . . . . . . 4 LEU H parsed_2mfv 2
25 1 2 . . . . . . . . . 5 ALA H parsed_2mfv 2
26 1 1 . . . . . . . . . 4 LEU H parsed_2mfv 2
26 1 2 . . . . . . . . . 11 GLY H parsed_2mfv 2
27 1 1 . . . . . . . . . 4 LEU HA parsed_2mfv 2
27 1 2 . . . . . . . . . 4 LEU HG parsed_2mfv 2
28 1 1 . . . . . . . . . 4 LEU HA parsed_2mfv 2
28 1 2 . . . . . . . . . 4 LEU QQD parsed_2mfv 2
29 1 1 . . . . . . . . . 4 LEU HA parsed_2mfv 2
29 1 2 . . . . . . . . . 5 ALA H parsed_2mfv 2
30 1 1 . . . . . . . . . 4 LEU HA parsed_2mfv 2
30 1 2 . . . . . . . . . 12 ILE QG2 parsed_2mfv 2
31 1 1 . . . . . . . . . 4 LEU QB parsed_2mfv 2
31 1 2 . . . . . . . . . 5 ALA H parsed_2mfv 2
32 1 1 . . . . . . . . . 4 LEU QB parsed_2mfv 2
32 1 2 . . . . . . . . . 12 ILE HA parsed_2mfv 2
33 1 1 . . . . . . . . . 4 LEU QB parsed_2mfv 2
33 1 2 . . . . . . . . . 13 THR H parsed_2mfv 2
34 1 1 . . . . . . . . . 4 LEU QQD parsed_2mfv 2
34 1 2 . . . . . . . . . 5 ALA H parsed_2mfv 2
35 1 1 . . . . . . . . . 4 LEU QQD parsed_2mfv 2
35 1 2 . . . . . . . . . 12 ILE HA parsed_2mfv 2
36 1 1 . . . . . . . . . 5 ALA H parsed_2mfv 2
36 1 2 . . . . . . . . . 5 ALA QB parsed_2mfv 2
37 1 1 . . . . . . . . . 5 ALA H parsed_2mfv 2
37 1 2 . . . . . . . . . 13 THR H parsed_2mfv 2
38 1 1 . . . . . . . . . 5 ALA H parsed_2mfv 2
38 1 2 . . . . . . . . . 14 THR HA parsed_2mfv 2
39 1 1 . . . . . . . . . 5 ALA HA parsed_2mfv 2
39 1 2 . . . . . . . . . 6 GLY H parsed_2mfv 2
40 1 1 . . . . . . . . . 5 ALA HA parsed_2mfv 2
40 1 2 . . . . . . . . . 10 GLY QA parsed_2mfv 2
41 1 1 . . . . . . . . . 5 ALA QB parsed_2mfv 2
41 1 2 . . . . . . . . . 6 GLY H parsed_2mfv 2
42 1 1 . . . . . . . . . 5 ALA QB parsed_2mfv 2
42 1 2 . . . . . . . . . 6 GLY HA3 parsed_2mfv 2
43 1 1 . . . . . . . . . 5 ALA QB parsed_2mfv 2
43 1 2 . . . . . . . . . 14 THR HA parsed_2mfv 2
44 1 1 . . . . . . . . . 6 GLY H parsed_2mfv 2
44 1 2 . . . . . . . . . 8 GLU H parsed_2mfv 2
45 1 1 . . . . . . . . . 6 GLY HA2 parsed_2mfv 2
45 1 2 . . . . . . . . . 7 GLUP H parsed_2mfv 2
46 1 1 . . . . . . . . . 6 GLY HA3 parsed_2mfv 2
46 1 2 . . . . . . . . . 7 GLUP H parsed_2mfv 2
47 1 1 . . . . . . . . . 6 GLY HA3 parsed_2mfv 2
47 1 2 . . . . . . . . . 13 THR HB parsed_2mfv 2
48 1 1 . . . . . . . . . 6 GLY HA3 parsed_2mfv 2
48 1 2 . . . . . . . . . 13 THR QG2 parsed_2mfv 2
49 1 1 . . . . . . . . . 7 GLUP H parsed_2mfv 2
49 1 2 . . . . . . . . . 7 GLUP QB parsed_2mfv 2
50 1 1 . . . . . . . . . 7 GLUP H parsed_2mfv 2
50 1 2 . . . . . . . . . 7 GLUP QG parsed_2mfv 2
51 1 1 . . . . . . . . . 7 GLUP H parsed_2mfv 2
51 1 2 . . . . . . . . . 8 GLU H parsed_2mfv 2
52 1 1 . . . . . . . . . 7 GLUP H parsed_2mfv 2
52 1 2 . . . . . . . . . 11 GLY HA3 parsed_2mfv 2
53 1 1 . . . . . . . . . 7 GLUP HA parsed_2mfv 2
53 1 2 . . . . . . . . . 7 GLUP QG parsed_2mfv 2
54 1 1 . . . . . . . . . 7 GLUP HA parsed_2mfv 2
54 1 2 . . . . . . . . . 8 GLU H parsed_2mfv 2
55 1 1 . . . . . . . . . 7 GLUP HA parsed_2mfv 2
55 1 2 . . . . . . . . . 8 GLU QB parsed_2mfv 2
56 1 1 . . . . . . . . . 7 GLUP QG parsed_2mfv 2
56 1 2 . . . . . . . . . 9 MET H parsed_2mfv 2
57 1 1 . . . . . . . . . 7 GLUP QG parsed_2mfv 2
57 1 2 . . . . . . . . . 11 GLY HA2 parsed_2mfv 2
58 1 1 . . . . . . . . . 7 GLUP QG parsed_2mfv 2
58 1 2 . . . . . . . . . 12 ILE HA parsed_2mfv 2
59 1 1 . . . . . . . . . 8 GLU H parsed_2mfv 2
59 1 2 . . . . . . . . . 8 GLU HA parsed_2mfv 2
60 1 1 . . . . . . . . . 8 GLU H parsed_2mfv 2
60 1 2 . . . . . . . . . 8 GLU QB parsed_2mfv 2
61 1 1 . . . . . . . . . 8 GLU H parsed_2mfv 2
61 1 2 . . . . . . . . . 8 GLU QG parsed_2mfv 2
62 1 1 . . . . . . . . . 8 GLU H parsed_2mfv 2
62 1 2 . . . . . . . . . 9 MET H parsed_2mfv 2
63 1 1 . . . . . . . . . 8 GLU QB parsed_2mfv 2
63 1 2 . . . . . . . . . 9 MET H parsed_2mfv 2
64 1 1 . . . . . . . . . 8 GLU QG parsed_2mfv 2
64 1 2 . . . . . . . . . 9 MET H parsed_2mfv 2
65 1 1 . . . . . . . . . 9 MET H parsed_2mfv 2
65 1 2 . . . . . . . . . 9 MET HB2 parsed_2mfv 2
66 1 1 . . . . . . . . . 9 MET H parsed_2mfv 2
66 1 2 . . . . . . . . . 9 MET HB3 parsed_2mfv 2
67 1 1 . . . . . . . . . 9 MET H parsed_2mfv 2
67 1 2 . . . . . . . . . 10 GLY H parsed_2mfv 2
68 1 1 . . . . . . . . . 9 MET HA parsed_2mfv 2
68 1 2 . . . . . . . . . 9 MET HB3 parsed_2mfv 2
69 1 1 . . . . . . . . . 9 MET HA parsed_2mfv 2
69 1 2 . . . . . . . . . 10 GLY H parsed_2mfv 2
70 1 1 . . . . . . . . . 10 GLY H parsed_2mfv 2
70 1 2 . . . . . . . . . 10 GLY HA2 parsed_2mfv 2
71 1 1 . . . . . . . . . 10 GLY H parsed_2mfv 2
71 1 2 . . . . . . . . . 10 GLY HA3 parsed_2mfv 2
72 1 1 . . . . . . . . . 10 GLY H parsed_2mfv 2
72 1 2 . . . . . . . . . 10 GLY QA parsed_2mfv 2
73 1 1 . . . . . . . . . 10 GLY HA2 parsed_2mfv 2
73 1 2 . . . . . . . . . 11 GLY H parsed_2mfv 2
74 1 1 . . . . . . . . . 10 GLY HA3 parsed_2mfv 2
74 1 2 . . . . . . . . . 11 GLY H parsed_2mfv 2
75 1 1 . . . . . . . . . 10 GLY QA parsed_2mfv 2
75 1 2 . . . . . . . . . 11 GLY H parsed_2mfv 2
76 1 1 . . . . . . . . . 11 GLY HA2 parsed_2mfv 2
76 1 2 . . . . . . . . . 12 ILE H parsed_2mfv 2
77 1 1 . . . . . . . . . 11 GLY HA3 parsed_2mfv 2
77 1 2 . . . . . . . . . 12 ILE H parsed_2mfv 2
78 1 1 . . . . . . . . . 11 GLY HA3 parsed_2mfv 2
78 1 2 . . . . . . . . . 13 THR H parsed_2mfv 2
79 1 1 . . . . . . . . . 12 ILE H parsed_2mfv 2
79 1 2 . . . . . . . . . 12 ILE HA parsed_2mfv 2
80 1 1 . . . . . . . . . 12 ILE H parsed_2mfv 2
80 1 2 . . . . . . . . . 12 ILE HB parsed_2mfv 2
81 1 1 . . . . . . . . . 12 ILE H parsed_2mfv 2
81 1 2 . . . . . . . . . 12 ILE QG2 parsed_2mfv 2
82 1 1 . . . . . . . . . 12 ILE H parsed_2mfv 2
82 1 2 . . . . . . . . . 12 ILE HG12 parsed_2mfv 2
83 1 1 . . . . . . . . . 12 ILE H parsed_2mfv 2
83 1 2 . . . . . . . . . 12 ILE HG13 parsed_2mfv 2
84 1 1 . . . . . . . . . 12 ILE H parsed_2mfv 2
84 1 2 . . . . . . . . . 13 THR H parsed_2mfv 2
85 1 1 . . . . . . . . . 12 ILE HA parsed_2mfv 2
85 1 2 . . . . . . . . . 12 ILE HB parsed_2mfv 2
86 1 1 . . . . . . . . . 12 ILE HA parsed_2mfv 2
86 1 2 . . . . . . . . . 12 ILE QG2 parsed_2mfv 2
87 1 1 . . . . . . . . . 12 ILE HA parsed_2mfv 2
87 1 2 . . . . . . . . . 12 ILE HG13 parsed_2mfv 2
88 1 1 . . . . . . . . . 12 ILE HA parsed_2mfv 2
88 1 2 . . . . . . . . . 13 THR H parsed_2mfv 2
89 1 1 . . . . . . . . . 12 ILE HB parsed_2mfv 2
89 1 2 . . . . . . . . . 12 ILE HG12 parsed_2mfv 2
90 1 1 . . . . . . . . . 13 THR H parsed_2mfv 2
90 1 2 . . . . . . . . . 13 THR HB parsed_2mfv 2
91 1 1 . . . . . . . . . 13 THR H parsed_2mfv 2
91 1 2 . . . . . . . . . 13 THR QG2 parsed_2mfv 2
92 1 1 . . . . . . . . . 13 THR HA parsed_2mfv 2
92 1 2 . . . . . . . . . 13 THR HB parsed_2mfv 2
93 1 1 . . . . . . . . . 13 THR HA parsed_2mfv 2
93 1 2 . . . . . . . . . 14 THR H parsed_2mfv 2
94 1 1 . . . . . . . . . 13 THR HA parsed_2mfv 2
94 1 2 . . . . . . . . . 14 THR QG2 parsed_2mfv 2
95 1 1 . . . . . . . . . 13 THR HB parsed_2mfv 2
95 1 2 . . . . . . . . . 14 THR H parsed_2mfv 2
96 1 1 . . . . . . . . . 13 THR QG2 parsed_2mfv 2
96 1 2 . . . . . . . . . 14 THR H parsed_2mfv 2
97 1 1 . . . . . . . . . 14 THR H parsed_2mfv 2
97 1 2 . . . . . . . . . 14 THR QG2 parsed_2mfv 2
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 . . . . . . . 3.92 parsed_2mfv 2
2 1 . . . . . . . 4.24 parsed_2mfv 2
3 1 . . . . . . . 3.11 parsed_2mfv 2
4 1 . . . . . . . 3.42 parsed_2mfv 2
5 1 . . . . . . . 3.08 parsed_2mfv 2
6 1 . . . . . . . 2.40 parsed_2mfv 2
7 1 . . . . . . . 3.30 parsed_2mfv 2
8 1 . . . . . . . 3.17 parsed_2mfv 2
9 1 . . . . . . . 5.68 parsed_2mfv 2
10 1 . . . . . . . 2.40 parsed_2mfv 2
11 1 . . . . . . . 2.52 parsed_2mfv 2
12 1 . . . . . . . 3.08 parsed_2mfv 2
13 1 . . . . . . . 3.86 parsed_2mfv 2
14 1 . . . . . . . 4.49 parsed_2mfv 2
15 1 . . . . . . . 3.02 parsed_2mfv 2
16 1 . . . . . . . 2.56 parsed_2mfv 2
17 1 . . . . . . . 3.39 parsed_2mfv 2
18 1 . . . . . . . 4.23 parsed_2mfv 2
19 1 . . . . . . . 4.63 parsed_2mfv 2
20 1 . . . . . . . 5.50 parsed_2mfv 2
21 1 . . . . . . . 5.00 parsed_2mfv 2
22 1 . . . . . . . 5.59 parsed_2mfv 2
23 1 . . . . . . . 3.47 parsed_2mfv 2
24 1 . . . . . . . 5.94 parsed_2mfv 2
25 1 . . . . . . . 3.45 parsed_2mfv 2
26 1 . . . . . . . 2.62 parsed_2mfv 2
27 1 . . . . . . . 2.52 parsed_2mfv 2
28 1 . . . . . . . 3.41 parsed_2mfv 2
29 1 . . . . . . . 3.45 parsed_2mfv 2
30 1 . . . . . . . 4.07 parsed_2mfv 2
31 1 . . . . . . . 3.28 parsed_2mfv 2
32 1 . . . . . . . 3.81 parsed_2mfv 2
33 1 . . . . . . . 4.34 parsed_2mfv 2
34 1 . . . . . . . 5.11 parsed_2mfv 2
35 1 . . . . . . . 4.23 parsed_2mfv 2
36 1 . . . . . . . 3.98 parsed_2mfv 2
37 1 . . . . . . . 2.68 parsed_2mfv 2
38 1 . . . . . . . 3.58 parsed_2mfv 2
39 1 . . . . . . . 2.43 parsed_2mfv 2
40 1 . . . . . . . 3.38 parsed_2mfv 2
41 1 . . . . . . . 3.57 parsed_2mfv 2
42 1 . . . . . . . 4.41 parsed_2mfv 2
43 1 . . . . . . . 5.15 parsed_2mfv 2
44 1 . . . . . . . 4.72 parsed_2mfv 2
45 1 . . . . . . . 3.02 parsed_2mfv 2
46 1 . . . . . . . 3.08 parsed_2mfv 2
47 1 . . . . . . . 3.89 parsed_2mfv 2
48 1 . . . . . . . 5.15 parsed_2mfv 2
49 1 . . . . . . . 4.09 parsed_2mfv 2
50 1 . . . . . . . 2.85 parsed_2mfv 2
51 1 . . . . . . . 3.52 parsed_2mfv 2
52 1 . . . . . . . 2.77 parsed_2mfv 2
53 1 . . . . . . . 3.56 parsed_2mfv 2
54 1 . . . . . . . 2.62 parsed_2mfv 2
55 1 . . . . . . . 3.53 parsed_2mfv 2
56 1 . . . . . . . 3.14 parsed_2mfv 2
57 1 . . . . . . . 3.90 parsed_2mfv 2
58 1 . . . . . . . 4.47 parsed_2mfv 2
59 1 . . . . . . . 2.74 parsed_2mfv 2
60 1 . . . . . . . 3.28 parsed_2mfv 2
61 1 . . . . . . . 4.86 parsed_2mfv 2
62 1 . . . . . . . 2.87 parsed_2mfv 2
63 1 . . . . . . . 3.78 parsed_2mfv 2
64 1 . . . . . . . 4.49 parsed_2mfv 2
65 1 . . . . . . . 3.14 parsed_2mfv 2
66 1 . . . . . . . 3.73 parsed_2mfv 2
67 1 . . . . . . . 3.98 parsed_2mfv 2
68 1 . . . . . . . 2.87 parsed_2mfv 2
69 1 . . . . . . . 2.40 parsed_2mfv 2
70 1 . . . . . . . 2.93 parsed_2mfv 2
71 1 . . . . . . . 2.93 parsed_2mfv 2
72 1 . . . . . . . 2.32 parsed_2mfv 2
73 1 . . . . . . . 2.65 parsed_2mfv 2
74 1 . . . . . . . 2.65 parsed_2mfv 2
75 1 . . . . . . . 2.23 parsed_2mfv 2
76 1 . . . . . . . 2.40 parsed_2mfv 2
77 1 . . . . . . . 2.40 parsed_2mfv 2
78 1 . . . . . . . 3.36 parsed_2mfv 2
79 1 . . . . . . . 2.68 parsed_2mfv 2
80 1 . . . . . . . 3.64 parsed_2mfv 2
81 1 . . . . . . . 5.00 parsed_2mfv 2
82 1 . . . . . . . 2.80 parsed_2mfv 2
83 1 . . . . . . . 3.30 parsed_2mfv 2
84 1 . . . . . . . 2.40 parsed_2mfv 2
85 1 . . . . . . . 2.40 parsed_2mfv 2
86 1 . . . . . . . 3.67 parsed_2mfv 2
87 1 . . . . . . . 2.46 parsed_2mfv 2
88 1 . . . . . . . 2.87 parsed_2mfv 2
89 1 . . . . . . . 2.87 parsed_2mfv 2
90 1 . . . . . . . 2.99 parsed_2mfv 2
91 1 . . . . . . . 4.50 parsed_2mfv 2
92 1 . . . . . . . 2.59 parsed_2mfv 2
93 1 . . . . . . . 2.40 parsed_2mfv 2
94 1 . . . . . . . 5.50 parsed_2mfv 2
95 1 . . . . . . . 3.27 parsed_2mfv 2
96 1 . . . . . . . 4.26 parsed_2mfv 2
97 1 . . . . . . . 4.78 parsed_2mfv 2
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 "peak 162" 1 49 1 59 parsed_2mfv 2
2 "peak 197" 2 49 2 59 parsed_2mfv 2
3 "peak 192" 3 49 3 59 parsed_2mfv 2
4 "peak 172" 4 49 4 59 parsed_2mfv 2
5 "peak 130" 5 49 5 59 parsed_2mfv 2
6 "peak 141" 6 49 6 59 parsed_2mfv 2
7 "peak 160" 7 49 7 59 parsed_2mfv 2
8 "peak 42" 8 49 8 59 parsed_2mfv 2
9 "peak 203" 9 49 9 59 parsed_2mfv 2
10 "peak 66" 10 49 10 59 parsed_2mfv 2
11 "peak 113" 11 49 11 59 parsed_2mfv 2
12 "peak 177" 12 49 12 59 parsed_2mfv 2
13 "peak 155" 13 49 13 59 parsed_2mfv 2
14 "peak 101" 14 49 14 59 parsed_2mfv 2
15 "peak 147" 15 49 15 59 parsed_2mfv 2
16 "peak 107" 16 49 16 59 parsed_2mfv 2
17 "peak 190" 17 49 17 59 parsed_2mfv 2
18 "peak 174" 18 49 18 59 parsed_2mfv 2
19 "peak 79" 19 49 19 59 parsed_2mfv 2
20 "peak 189" 20 49 20 59 parsed_2mfv 2
21 "peak 158" 21 49 21 59 parsed_2mfv 2
22 "peak 202" 22 49 22 59 parsed_2mfv 2
23 "peak 123" 23 49 23 59 parsed_2mfv 2
24 "peak 154" 24 49 24 59 parsed_2mfv 2
25 "peak 163" 25 49 25 59 parsed_2mfv 2
26 "peak 49" 26 49 26 59 parsed_2mfv 2
27 "peak 182" 27 49 27 59 parsed_2mfv 2
28 "peak 76" 28 49 28 59 parsed_2mfv 2
29 "peak 183" 29 49 29 59 parsed_2mfv 2
30 "peak 54" 30 49 30 59 parsed_2mfv 2
31 "peak 118" 31 49 31 59 parsed_2mfv 2
32 "peak 71" 32 49 32 59 parsed_2mfv 2
33 "peak 125" 33 49 33 59 parsed_2mfv 2
34 "peak 204" 34 49 34 59 parsed_2mfv 2
35 "peak 51" 35 49 35 59 parsed_2mfv 2
36 "peak 31" 36 49 36 59 parsed_2mfv 2
37 "peak 47" 37 49 37 59 parsed_2mfv 2
38 "peak 184" 38 49 38 59 parsed_2mfv 2
39 "peak 22" 39 49 39 59 parsed_2mfv 2
40 "peak 178" 40 49 40 59 parsed_2mfv 2
41 "peak 124" 41 49 41 59 parsed_2mfv 2
42 "peak 75" 42 49 42 59 parsed_2mfv 2
43 "peak 57" 43 49 43 59 parsed_2mfv 2
44 "peak 165" 44 49 44 59 parsed_2mfv 2
45 "peak 12" 45 49 45 59 parsed_2mfv 2
46 "peak 14" 46 49 46 59 parsed_2mfv 2
47 "peak 176" 47 49 47 59 parsed_2mfv 2
48 "peak 173" 48 49 48 59 parsed_2mfv 2
49 "peak 9" 49 49 49 59 parsed_2mfv 2
50 "peak 195" 50 49 50 59 parsed_2mfv 2
51 "peak 164" 51 49 51 59 parsed_2mfv 2
52 "peak 136" 52 49 52 59 parsed_2mfv 2
53 "peak 61" 53 49 53 59 parsed_2mfv 2
54 "peak 131" 54 49 54 59 parsed_2mfv 2
55 "peak 86" 55 49 55 59 parsed_2mfv 2
56 "peak 37" 56 49 56 59 parsed_2mfv 2
57 "peak 64" 57 49 57 59 parsed_2mfv 2
58 "peak 98" 58 49 58 59 parsed_2mfv 2
59 "peak 140" 59 49 59 59 parsed_2mfv 2
60 "peak 28" 60 49 60 59 parsed_2mfv 2
61 "peak 193" 61 49 61 59 parsed_2mfv 2
62 "peak 48" 62 49 62 59 parsed_2mfv 2
63 "peak 116" 63 49 63 59 parsed_2mfv 2
64 "peak 191" 64 49 64 59 parsed_2mfv 2
65 "peak 198" 65 49 65 59 parsed_2mfv 2
66 "peak 169" 66 49 66 59 parsed_2mfv 2
67 "peak 152" 67 49 67 59 parsed_2mfv 2
68 "peak 91" 68 49 68 59 parsed_2mfv 2
69 "peak 138" 69 49 69 59 parsed_2mfv 2
70 "peak 144" 70 49 70 59 parsed_2mfv 2
71 "peak 139" 71 49 71 59 parsed_2mfv 2
72 "peak 144" 72 49 72 59 parsed_2mfv 2
73 "peak 128" 73 49 73 59 parsed_2mfv 2
74 "peak 127" 74 49 74 59 parsed_2mfv 2
75 "peak 127" 75 49 75 59 parsed_2mfv 2
76 "peak 142" 76 49 76 59 parsed_2mfv 2
77 "peak 135" 77 49 77 59 parsed_2mfv 2
78 "peak 6" 78 49 78 59 parsed_2mfv 2
79 "peak 133" 79 49 79 59 parsed_2mfv 2
80 "peak 156" 80 49 80 59 parsed_2mfv 2
81 "peak 19" 81 49 81 59 parsed_2mfv 2
82 "peak 18" 82 49 82 59 parsed_2mfv 2
83 "peak 16" 83 49 83 59 parsed_2mfv 2
84 "peak 46" 84 49 84 59 parsed_2mfv 2
85 "peak 87" 85 49 85 59 parsed_2mfv 2
86 "peak 73" 86 49 86 59 parsed_2mfv 2
87 "peak 55" 87 49 87 59 parsed_2mfv 2
88 "peak 137" 88 49 88 59 parsed_2mfv 2
89 "peak 102" 89 49 89 59 parsed_2mfv 2
90 "peak 4" 90 49 90 59 parsed_2mfv 2
91 "peak 8" 91 49 91 59 parsed_2mfv 2
92 "peak 68" 92 49 92 59 parsed_2mfv 2
93 "peak 132" 93 49 93 59 parsed_2mfv 2
94 "peak 199" 94 49 94 59 parsed_2mfv 2
95 "peak 159" 95 49 95 59 parsed_2mfv 2
96 "peak 120" 96 49 96 59 parsed_2mfv 2
97 "peak 121" 97 49 97 59 parsed_2mfv 2
stop_
save_
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