NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
33633 |
1im7   |
cing | 2-parsed | STAR | entry | full | 166 |
data_1im7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1im7
_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_1im7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1im7
_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 1im7 "Master copy" parsed_1im7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1im7
_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 1im7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1im7 1
1 1im7.mr . . DYANA/DIANA 2 distance NOE simple 80 parsed_1im7 1
1 1im7.mr . . DYANA/DIANA 3 distance "disulfide bond" simple 3 parsed_1im7 1
1 1im7.mr . . DYANA/DIANA 4 distance NOE simple 80 parsed_1im7 1
1 1im7.mr . . DYANA/DIANA 5 distance "disulfide bond" simple 3 parsed_1im7 1
1 1im7.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1im7 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_1im7
_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 VIRUS/VIRAL PROTEIN 10-MAY-01 1IM7
*TITLE SOLUTION STRUCTURE OF SYNTHETIC CYCLIC PEPTIDE MIMICKING
*TITLE 2 THE LOOP OF HIV-1 GP41 GLYCOPROTEIN ENVELOPE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: GP41-PARENT PEPTIDE ACE-ILE-TRP-GLY-CYS-SER-GLY-
*COMPND 3 LYS-LEU-ILE-CYS-THR-THR-ALA;
*COMPND 4 CHAIN: A;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMAN
*SOURCE 4 IMMUNODEFICIENCY VIRUS TYPE 1
*KEYWDS CYCLIC PEPTIDE
*EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE
*AUTHOR A.PHAN CHAN DU, D.LIMAL, V.SEMETEY, H.DALI, M.JOLIVET,
*AUTHOR 2 C.DESGRANGES, M.T.CUNG, J.P.BRIAND, M.C.PETIT, S.MULLER
*REVDAT 1 23-OCT-02 1IM7 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1im7
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1im7 1
2 1 . . . parsed_1im7 1
3 1 . . . parsed_1im7 1
4 1 . . . parsed_1im7 1
5 1 . . . parsed_1im7 1
6 1 . . . parsed_1im7 1
7 1 . . . parsed_1im7 1
8 1 . . . parsed_1im7 1
9 1 . . . parsed_1im7 1
10 1 . . . parsed_1im7 1
11 1 . . . parsed_1im7 1
12 1 . . . parsed_1im7 1
13 1 . . . parsed_1im7 1
14 1 . . . parsed_1im7 1
15 1 . . . parsed_1im7 1
16 1 . . . parsed_1im7 1
17 1 . . . parsed_1im7 1
18 1 . . . parsed_1im7 1
19 1 . . . parsed_1im7 1
20 1 . . . parsed_1im7 1
21 1 . . . parsed_1im7 1
22 1 . . . parsed_1im7 1
23 1 . . . parsed_1im7 1
24 1 . . . parsed_1im7 1
25 1 . . . parsed_1im7 1
26 1 . . . parsed_1im7 1
27 1 . . . parsed_1im7 1
28 1 . . . parsed_1im7 1
29 1 . . . parsed_1im7 1
30 1 . . . parsed_1im7 1
31 1 . . . parsed_1im7 1
32 1 . . . parsed_1im7 1
33 1 . . . parsed_1im7 1
34 1 . . . parsed_1im7 1
35 1 . . . parsed_1im7 1
36 1 . . . parsed_1im7 1
37 1 . . . parsed_1im7 1
38 1 . . . parsed_1im7 1
39 1 . . . parsed_1im7 1
40 1 . . . parsed_1im7 1
41 1 . . . parsed_1im7 1
42 1 . . . parsed_1im7 1
43 1 . . . parsed_1im7 1
44 1 . . . parsed_1im7 1
45 1 . . . parsed_1im7 1
46 1 . . . parsed_1im7 1
47 1 . . . parsed_1im7 1
48 1 . . . parsed_1im7 1
49 1 . . . parsed_1im7 1
50 1 . . . parsed_1im7 1
51 1 . . . parsed_1im7 1
52 1 . . . parsed_1im7 1
53 1 . . . parsed_1im7 1
54 1 . . . parsed_1im7 1
55 1 . . . parsed_1im7 1
56 1 . . . parsed_1im7 1
57 1 . . . parsed_1im7 1
58 1 . . . parsed_1im7 1
59 1 . . . parsed_1im7 1
60 1 . . . parsed_1im7 1
61 1 . . . parsed_1im7 1
62 1 . . . parsed_1im7 1
63 1 . . . parsed_1im7 1
64 1 . . . parsed_1im7 1
65 1 . . . parsed_1im7 1
66 1 . . . parsed_1im7 1
67 1 . . . parsed_1im7 1
68 1 . . . parsed_1im7 1
69 1 . . . parsed_1im7 1
70 1 . . . parsed_1im7 1
71 1 . . . parsed_1im7 1
72 1 . . . parsed_1im7 1
73 1 . . . parsed_1im7 1
74 1 . . . parsed_1im7 1
75 1 . . . parsed_1im7 1
76 1 . . . parsed_1im7 1
77 1 . . . parsed_1im7 1
78 1 . . . parsed_1im7 1
79 1 . . . parsed_1im7 1
80 1 . . . parsed_1im7 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 . . . . . . . . . 2 ILE HN parsed_1im7 1
1 1 2 . . . . . . . . . 2 ILE HB parsed_1im7 1
2 1 1 . . . . . . . . . 2 ILE HN parsed_1im7 1
2 1 2 . . . . . . . . . 2 ILE QG1 parsed_1im7 1
3 1 1 . . . . . . . . . 2 ILE HN parsed_1im7 1
3 1 2 . . . . . . . . . 2 ILE QD1 parsed_1im7 1
4 1 1 . . . . . . . . . 2 ILE HN parsed_1im7 1
4 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 1
5 1 1 . . . . . . . . . 2 ILE HA parsed_1im7 1
5 1 2 . . . . . . . . . 2 ILE QD1 parsed_1im7 1
6 1 1 . . . . . . . . . 2 ILE HA parsed_1im7 1
6 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 1
7 1 1 . . . . . . . . . 2 ILE HA parsed_1im7 1
7 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 1
8 1 1 . . . . . . . . . 2 ILE HB parsed_1im7 1
8 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 1
9 1 1 . . . . . . . . . 2 ILE QD1 parsed_1im7 1
9 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 1
10 1 1 . . . . . . . . . 2 ILE QD1 parsed_1im7 1
10 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 1
11 1 1 . . . . . . . . . 3 TRP HN parsed_1im7 1
11 1 2 . . . . . . . . . 3 TRP QB parsed_1im7 1
12 1 1 . . . . . . . . . 3 TRP HN parsed_1im7 1
12 1 2 . . . . . . . . . 3 TRP HD1 parsed_1im7 1
13 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 1
13 1 2 . . . . . . . . . 3 TRP HD1 parsed_1im7 1
14 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 1
14 1 2 . . . . . . . . . 3 TRP HE3 parsed_1im7 1
15 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 1
15 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 1
16 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 1
16 1 2 . . . . . . . . . 4 GLY QA parsed_1im7 1
17 1 1 . . . . . . . . . 3 TRP QB parsed_1im7 1
17 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 1
18 1 1 . . . . . . . . . 3 TRP HD1 parsed_1im7 1
18 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 1
19 1 1 . . . . . . . . . 3 TRP HE3 parsed_1im7 1
19 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 1
20 1 1 . . . . . . . . . 4 GLY HN parsed_1im7 1
20 1 2 . . . . . . . . . 4 GLY QA parsed_1im7 1
21 1 1 . . . . . . . . . 4 GLY HN parsed_1im7 1
21 1 2 . . . . . . . . . 6 SER HN parsed_1im7 1
22 1 1 . . . . . . . . . 4 GLY QA parsed_1im7 1
22 1 2 . . . . . . . . . 5 CYSS HN parsed_1im7 1
23 1 1 . . . . . . . . . 4 GLY QA parsed_1im7 1
23 1 2 . . . . . . . . . 5 CYSS HA parsed_1im7 1
24 1 1 . . . . . . . . . 4 GLY QA parsed_1im7 1
24 1 2 . . . . . . . . . 6 SER HN parsed_1im7 1
25 1 1 . . . . . . . . . 5 CYSS HN parsed_1im7 1
25 1 2 . . . . . . . . . 5 CYSS QB parsed_1im7 1
26 1 1 . . . . . . . . . 5 CYSS HN parsed_1im7 1
26 1 2 . . . . . . . . . 6 SER HN parsed_1im7 1
27 1 1 . . . . . . . . . 5 CYSS HA parsed_1im7 1
27 1 2 . . . . . . . . . 6 SER HN parsed_1im7 1
28 1 1 . . . . . . . . . 5 CYSS HA parsed_1im7 1
28 1 2 . . . . . . . . . 6 SER QB parsed_1im7 1
29 1 1 . . . . . . . . . 5 CYSS QB parsed_1im7 1
29 1 2 . . . . . . . . . 6 SER HN parsed_1im7 1
30 1 1 . . . . . . . . . 6 SER HN parsed_1im7 1
30 1 2 . . . . . . . . . 6 SER HA parsed_1im7 1
31 1 1 . . . . . . . . . 6 SER HN parsed_1im7 1
31 1 2 . . . . . . . . . 6 SER HG parsed_1im7 1
32 1 1 . . . . . . . . . 6 SER HN parsed_1im7 1
32 1 2 . . . . . . . . . 7 GLY HN parsed_1im7 1
33 1 1 . . . . . . . . . 6 SER HN parsed_1im7 1
33 1 2 . . . . . . . . . 8 LYS QZ parsed_1im7 1
34 1 1 . . . . . . . . . 6 SER HA parsed_1im7 1
34 1 2 . . . . . . . . . 7 GLY HN parsed_1im7 1
35 1 1 . . . . . . . . . 6 SER HA parsed_1im7 1
35 1 2 . . . . . . . . . 8 LYS HN parsed_1im7 1
36 1 1 . . . . . . . . . 7 GLY HN parsed_1im7 1
36 1 2 . . . . . . . . . 8 LYS HN parsed_1im7 1
37 1 1 . . . . . . . . . 7 GLY QA parsed_1im7 1
37 1 2 . . . . . . . . . 8 LYS HN parsed_1im7 1
38 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 1
38 1 2 . . . . . . . . . 8 LYS QB parsed_1im7 1
39 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 1
39 1 2 . . . . . . . . . 8 LYS QG parsed_1im7 1
40 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 1
40 1 2 . . . . . . . . . 8 LYS QD parsed_1im7 1
41 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 1
41 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 1
42 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 1
42 1 2 . . . . . . . . . 8 LYS QB parsed_1im7 1
43 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 1
43 1 2 . . . . . . . . . 8 LYS QD parsed_1im7 1
44 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 1
44 1 2 . . . . . . . . . 8 LYS QE parsed_1im7 1
45 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 1
45 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 1
46 1 1 . . . . . . . . . 8 LYS QB parsed_1im7 1
46 1 2 . . . . . . . . . 8 LYS QE parsed_1im7 1
47 1 1 . . . . . . . . . 8 LYS QB parsed_1im7 1
47 1 2 . . . . . . . . . 10 ILE HN parsed_1im7 1
48 1 1 . . . . . . . . . 8 LYS QB parsed_1im7 1
48 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 1
49 1 1 . . . . . . . . . 8 LYS QG parsed_1im7 1
49 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 1
50 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 1
50 1 2 . . . . . . . . . 10 ILE QG1 parsed_1im7 1
51 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 1
51 1 2 . . . . . . . . . 10 ILE QD1 parsed_1im7 1
52 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 1
52 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 1
53 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 1
53 1 2 . . . . . . . . . 9 LEU HA parsed_1im7 1
54 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 1
54 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 1
55 1 1 . . . . . . . . . 10 ILE HA parsed_1im7 1
55 1 2 . . . . . . . . . 10 ILE QD1 parsed_1im7 1
56 1 1 . . . . . . . . . 10 ILE HA parsed_1im7 1
56 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 1
57 1 1 . . . . . . . . . 10 ILE HA parsed_1im7 1
57 1 2 . . . . . . . . . 12 THR HN parsed_1im7 1
58 1 1 . . . . . . . . . 10 ILE HB parsed_1im7 1
58 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 1
59 1 1 . . . . . . . . . 10 ILE QG1 parsed_1im7 1
59 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 1
60 1 1 . . . . . . . . . 10 ILE QD1 parsed_1im7 1
60 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 1
61 1 1 . . . . . . . . . 10 ILE QD1 parsed_1im7 1
61 1 2 . . . . . . . . . 12 THR HN parsed_1im7 1
62 1 1 . . . . . . . . . 9 LEU HN parsed_1im7 1
62 1 2 . . . . . . . . . 9 LEU QB parsed_1im7 1
63 1 1 . . . . . . . . . 9 LEU HN parsed_1im7 1
63 1 2 . . . . . . . . . 9 LEU QD1 parsed_1im7 1
64 1 1 . . . . . . . . . 9 LEU HA parsed_1im7 1
64 1 2 . . . . . . . . . 9 LEU QB parsed_1im7 1
65 1 1 . . . . . . . . . 9 LEU HA parsed_1im7 1
65 1 2 . . . . . . . . . 9 LEU QD1 parsed_1im7 1
66 1 1 . . . . . . . . . 11 CYSS HN parsed_1im7 1
66 1 2 . . . . . . . . . 11 CYSS QB parsed_1im7 1
67 1 1 . . . . . . . . . 11 CYSS HN parsed_1im7 1
67 1 2 . . . . . . . . . 12 THR HN parsed_1im7 1
68 1 1 . . . . . . . . . 11 CYSS HA parsed_1im7 1
68 1 2 . . . . . . . . . 12 THR HN parsed_1im7 1
69 1 1 . . . . . . . . . 11 CYSS QB parsed_1im7 1
69 1 2 . . . . . . . . . 12 THR HN parsed_1im7 1
70 1 1 . . . . . . . . . 12 THR HN parsed_1im7 1
70 1 2 . . . . . . . . . 12 THR HA parsed_1im7 1
71 1 1 . . . . . . . . . 12 THR HN parsed_1im7 1
71 1 2 . . . . . . . . . 12 THR HB parsed_1im7 1
72 1 1 . . . . . . . . . 12 THR HN parsed_1im7 1
72 1 2 . . . . . . . . . 12 THR QG2 parsed_1im7 1
73 1 1 . . . . . . . . . 12 THR HA parsed_1im7 1
73 1 2 . . . . . . . . . 12 THR HB parsed_1im7 1
74 1 1 . . . . . . . . . 12 THR HA parsed_1im7 1
74 1 2 . . . . . . . . . 13 THR HN parsed_1im7 1
75 1 1 . . . . . . . . . 12 THR HA parsed_1im7 1
75 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 1
76 1 1 . . . . . . . . . 13 THR HN parsed_1im7 1
76 1 2 . . . . . . . . . 13 THR HB parsed_1im7 1
77 1 1 . . . . . . . . . 13 THR HN parsed_1im7 1
77 1 2 . . . . . . . . . 13 THR QG2 parsed_1im7 1
78 1 1 . . . . . . . . . 13 THR HN parsed_1im7 1
78 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 1
79 1 1 . . . . . . . . . 13 THR HB parsed_1im7 1
79 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 1
80 1 1 . . . . . . . . . 13 THR QG2 parsed_1im7 1
80 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 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 . . . . . . . 3.80 parsed_1im7 1
2 1 . . . . . . . 5.50 parsed_1im7 1
3 1 . . . . . . . 5.50 parsed_1im7 1
4 1 . . . . . . . 5.50 parsed_1im7 1
5 1 . . . . . . . 5.50 parsed_1im7 1
6 1 . . . . . . . 2.80 parsed_1im7 1
7 1 . . . . . . . 5.50 parsed_1im7 1
8 1 . . . . . . . 5.50 parsed_1im7 1
9 1 . . . . . . . 5.50 parsed_1im7 1
10 1 . . . . . . . 5.50 parsed_1im7 1
11 1 . . . . . . . 3.80 parsed_1im7 1
12 1 . . . . . . . 5.50 parsed_1im7 1
13 1 . . . . . . . 5.50 parsed_1im7 1
14 1 . . . . . . . 5.50 parsed_1im7 1
15 1 . . . . . . . 2.80 parsed_1im7 1
16 1 . . . . . . . 5.50 parsed_1im7 1
17 1 . . . . . . . 5.50 parsed_1im7 1
18 1 . . . . . . . 5.50 parsed_1im7 1
19 1 . . . . . . . 5.50 parsed_1im7 1
20 1 . . . . . . . 2.80 parsed_1im7 1
21 1 . . . . . . . 5.50 parsed_1im7 1
22 1 . . . . . . . 2.80 parsed_1im7 1
23 1 . . . . . . . 5.50 parsed_1im7 1
24 1 . . . . . . . 5.50 parsed_1im7 1
25 1 . . . . . . . 3.80 parsed_1im7 1
26 1 . . . . . . . 5.50 parsed_1im7 1
27 1 . . . . . . . 2.80 parsed_1im7 1
28 1 . . . . . . . 5.50 parsed_1im7 1
29 1 . . . . . . . 5.50 parsed_1im7 1
30 1 . . . . . . . 3.80 parsed_1im7 1
31 1 . . . . . . . 5.50 parsed_1im7 1
32 1 . . . . . . . 3.80 parsed_1im7 1
33 1 . . . . . . . 5.50 parsed_1im7 1
34 1 . . . . . . . 2.80 parsed_1im7 1
35 1 . . . . . . . 5.50 parsed_1im7 1
36 1 . . . . . . . 3.80 parsed_1im7 1
37 1 . . . . . . . 3.80 parsed_1im7 1
38 1 . . . . . . . 3.80 parsed_1im7 1
39 1 . . . . . . . 5.50 parsed_1im7 1
40 1 . . . . . . . 5.50 parsed_1im7 1
41 1 . . . . . . . 3.80 parsed_1im7 1
42 1 . . . . . . . 3.80 parsed_1im7 1
43 1 . . . . . . . 5.50 parsed_1im7 1
44 1 . . . . . . . 5.50 parsed_1im7 1
45 1 . . . . . . . 2.80 parsed_1im7 1
46 1 . . . . . . . 5.50 parsed_1im7 1
47 1 . . . . . . . 3.80 parsed_1im7 1
48 1 . . . . . . . 5.50 parsed_1im7 1
49 1 . . . . . . . 5.50 parsed_1im7 1
50 1 . . . . . . . 5.50 parsed_1im7 1
51 1 . . . . . . . 5.50 parsed_1im7 1
52 1 . . . . . . . 3.80 parsed_1im7 1
53 1 . . . . . . . 3.80 parsed_1im7 1
54 1 . . . . . . . 3.80 parsed_1im7 1
55 1 . . . . . . . 5.50 parsed_1im7 1
56 1 . . . . . . . 2.80 parsed_1im7 1
57 1 . . . . . . . 3.80 parsed_1im7 1
58 1 . . . . . . . 5.50 parsed_1im7 1
59 1 . . . . . . . 5.50 parsed_1im7 1
60 1 . . . . . . . 5.50 parsed_1im7 1
61 1 . . . . . . . 5.50 parsed_1im7 1
62 1 . . . . . . . 2.80 parsed_1im7 1
63 1 . . . . . . . 5.50 parsed_1im7 1
64 1 . . . . . . . 2.80 parsed_1im7 1
65 1 . . . . . . . 5.50 parsed_1im7 1
66 1 . . . . . . . 3.80 parsed_1im7 1
67 1 . . . . . . . 3.80 parsed_1im7 1
68 1 . . . . . . . 2.80 parsed_1im7 1
69 1 . . . . . . . 4.80 parsed_1im7 1
70 1 . . . . . . . 3.80 parsed_1im7 1
71 1 . . . . . . . 3.80 parsed_1im7 1
72 1 . . . . . . . 5.50 parsed_1im7 1
73 1 . . . . . . . 3.80 parsed_1im7 1
74 1 . . . . . . . 2.80 parsed_1im7 1
75 1 . . . . . . . 5.50 parsed_1im7 1
76 1 . . . . . . . 3.80 parsed_1im7 1
77 1 . . . . . . . 5.50 parsed_1im7 1
78 1 . . . . . . . 3.80 parsed_1im7 1
79 1 . . . . . . . 5.50 parsed_1im7 1
80 1 . . . . . . . 5.50 parsed_1im7 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 "upper limit constraints file using DYQNA-1.5" 2 1 2 45 parsed_1im7 1
2 3.33 3 37 3 57 parsed_1im7 1
3 6.38 4 37 4 57 parsed_1im7 1
4 6.06 5 37 5 57 parsed_1im7 1
5 4.17 6 37 6 57 parsed_1im7 1
6 4.88 7 37 7 57 parsed_1im7 1
7 2.68 8 37 8 57 parsed_1im7 1
8 4.51 9 37 9 57 parsed_1im7 1
9 3.89 10 37 10 57 parsed_1im7 1
10 5.75 11 37 11 57 parsed_1im7 1
11 6.53 12 37 12 57 parsed_1im7 1
12 3.48 13 37 13 57 parsed_1im7 1
13 5.28 14 37 14 57 parsed_1im7 1
14 5.04 15 37 15 57 parsed_1im7 1
15 4.88 16 37 16 57 parsed_1im7 1
16 2.74 17 37 17 57 parsed_1im7 1
17 5.29 18 37 18 57 parsed_1im7 1
18 3.86 19 37 19 57 parsed_1im7 1
19 5.50 20 37 20 57 parsed_1im7 1
20 5.50 21 37 21 57 parsed_1im7 1
21 2.71 22 37 22 57 parsed_1im7 1
22 3.89 23 37 23 57 parsed_1im7 1
23 2.71 24 37 24 57 parsed_1im7 1
24 5.45 25 37 25 57 parsed_1im7 1
25 5.48 26 37 26 57 parsed_1im7 1
26 3.64 27 37 27 57 parsed_1im7 1
27 4.04 28 37 28 57 parsed_1im7 1
28 2.80 29 37 29 57 parsed_1im7 1
29 5.57 30 37 30 57 parsed_1im7 1
30 4.20 31 37 31 57 parsed_1im7 1
31 2.83 32 37 32 57 parsed_1im7 1
32 5.50 33 37 33 57 parsed_1im7 1
33 3.52 34 37 34 57 parsed_1im7 1
34 6.31 35 37 35 57 parsed_1im7 1
35 2.62 36 37 36 57 parsed_1im7 1
36 3.86 37 37 37 57 parsed_1im7 1
37 3.11 38 37 38 57 parsed_1im7 1
38 3.42 39 37 39 57 parsed_1im7 1
39 3.19 40 37 40 57 parsed_1im7 1
40 6.38 41 37 41 57 parsed_1im7 1
41 6.28 42 37 42 57 parsed_1im7 1
42 3.48 43 37 43 57 parsed_1im7 1
43 2.99 44 37 44 57 parsed_1im7 1
44 6.38 45 37 45 57 parsed_1im7 1
45 6.38 46 37 46 57 parsed_1im7 1
46 2.74 47 37 47 57 parsed_1im7 1
47 5.82 48 37 48 57 parsed_1im7 1
48 3.20 49 37 49 57 parsed_1im7 1
49 4.30 50 37 50 57 parsed_1im7 1
50 6.38 51 37 51 57 parsed_1im7 1
51 4.88 52 37 52 57 parsed_1im7 1
52 5.09 53 37 53 57 parsed_1im7 1
53 2.83 54 37 54 57 parsed_1im7 1
54 3.17 55 37 55 57 parsed_1im7 1
55 3.73 56 37 56 57 parsed_1im7 1
56 6.12 57 37 57 57 parsed_1im7 1
57 2.52 58 37 58 57 parsed_1im7 1
58 3.48 59 37 59 57 parsed_1im7 1
59 5.04 60 37 60 57 parsed_1im7 1
60 5.50 61 37 61 57 parsed_1im7 1
61 5.40 62 37 62 57 parsed_1im7 1
62 7.29 63 37 63 57 parsed_1im7 1
63 2.71 64 37 64 57 parsed_1im7 1
64 6.19 65 37 65 57 parsed_1im7 1
65 2.71 66 37 66 57 parsed_1im7 1
66 4.39 67 37 67 57 parsed_1im7 1
67 3.12 68 37 68 57 parsed_1im7 1
68 3.21 69 37 69 57 parsed_1im7 1
69 2.77 70 37 70 57 parsed_1im7 1
70 3.80#3.67 71 37 71 62 parsed_1im7 1
71 2.87 72 37 72 57 parsed_1im7 1
72 3.27 73 37 73 57 parsed_1im7 1
73 4.61 74 37 74 57 parsed_1im7 1
74 2.96 75 37 75 57 parsed_1im7 1
75 2.68 76 37 76 57 parsed_1im7 1
76 5.04 77 37 77 57 parsed_1im7 1
77 3.17 78 37 78 57 parsed_1im7 1
78 4.73 79 37 79 57 parsed_1im7 1
79 3.58 80 37 80 57 parsed_1im7 1
80 3.89 81 37 81 57 parsed_1im7 1
81 5.78 82 37 82 57 parsed_1im7 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1im7
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "disulfide bond"
_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_1im7 2
2 1 . . . parsed_1im7 2
3 1 . . . parsed_1im7 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 . . . . . . . . . 5 CYSS CB parsed_1im7 2
1 1 2 . . . . . . . . . 11 CYSS SG parsed_1im7 2
2 1 1 . . . . . . . . . 5 CYSS SG parsed_1im7 2
2 1 2 . . . . . . . . . 11 CYSS CB parsed_1im7 2
3 1 1 . . . . . . . . . 5 CYSS SG parsed_1im7 2
3 1 2 . . . . . . . . . 11 CYSS SG parsed_1im7 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 . . . . . . . 3.10 parsed_1im7 2
2 1 . . . . . . . 3.10 parsed_1im7 2
3 1 . . . . . . . 2.10 parsed_1im7 2
stop_
save_
save_DYANA/DIANA_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1im7
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_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_1im7 3
2 1 . . . parsed_1im7 3
3 1 . . . parsed_1im7 3
4 1 . . . parsed_1im7 3
5 1 . . . parsed_1im7 3
6 1 . . . parsed_1im7 3
7 1 . . . parsed_1im7 3
8 1 . . . parsed_1im7 3
9 1 . . . parsed_1im7 3
10 1 . . . parsed_1im7 3
11 1 . . . parsed_1im7 3
12 1 . . . parsed_1im7 3
13 1 . . . parsed_1im7 3
14 1 . . . parsed_1im7 3
15 1 . . . parsed_1im7 3
16 1 . . . parsed_1im7 3
17 1 . . . parsed_1im7 3
18 1 . . . parsed_1im7 3
19 1 . . . parsed_1im7 3
20 1 . . . parsed_1im7 3
21 1 . . . parsed_1im7 3
22 1 . . . parsed_1im7 3
23 1 . . . parsed_1im7 3
24 1 . . . parsed_1im7 3
25 1 . . . parsed_1im7 3
26 1 . . . parsed_1im7 3
27 1 . . . parsed_1im7 3
28 1 . . . parsed_1im7 3
29 1 . . . parsed_1im7 3
30 1 . . . parsed_1im7 3
31 1 . . . parsed_1im7 3
32 1 . . . parsed_1im7 3
33 1 . . . parsed_1im7 3
34 1 . . . parsed_1im7 3
35 1 . . . parsed_1im7 3
36 1 . . . parsed_1im7 3
37 1 . . . parsed_1im7 3
38 1 . . . parsed_1im7 3
39 1 . . . parsed_1im7 3
40 1 . . . parsed_1im7 3
41 1 . . . parsed_1im7 3
42 1 . . . parsed_1im7 3
43 1 . . . parsed_1im7 3
44 1 . . . parsed_1im7 3
45 1 . . . parsed_1im7 3
46 1 . . . parsed_1im7 3
47 1 . . . parsed_1im7 3
48 1 . . . parsed_1im7 3
49 1 . . . parsed_1im7 3
50 1 . . . parsed_1im7 3
51 1 . . . parsed_1im7 3
52 1 . . . parsed_1im7 3
53 1 . . . parsed_1im7 3
54 1 . . . parsed_1im7 3
55 1 . . . parsed_1im7 3
56 1 . . . parsed_1im7 3
57 1 . . . parsed_1im7 3
58 1 . . . parsed_1im7 3
59 1 . . . parsed_1im7 3
60 1 . . . parsed_1im7 3
61 1 . . . parsed_1im7 3
62 1 . . . parsed_1im7 3
63 1 . . . parsed_1im7 3
64 1 . . . parsed_1im7 3
65 1 . . . parsed_1im7 3
66 1 . . . parsed_1im7 3
67 1 . . . parsed_1im7 3
68 1 . . . parsed_1im7 3
69 1 . . . parsed_1im7 3
70 1 . . . parsed_1im7 3
71 1 . . . parsed_1im7 3
72 1 . . . parsed_1im7 3
73 1 . . . parsed_1im7 3
74 1 . . . parsed_1im7 3
75 1 . . . parsed_1im7 3
76 1 . . . parsed_1im7 3
77 1 . . . parsed_1im7 3
78 1 . . . parsed_1im7 3
79 1 . . . parsed_1im7 3
80 1 . . . parsed_1im7 3
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 . . . . . . . . . 2 ILE HN parsed_1im7 3
1 1 2 . . . . . . . . . 2 ILE HB parsed_1im7 3
2 1 1 . . . . . . . . . 2 ILE HN parsed_1im7 3
2 1 2 . . . . . . . . . 2 ILE QG1 parsed_1im7 3
3 1 1 . . . . . . . . . 2 ILE HN parsed_1im7 3
3 1 2 . . . . . . . . . 2 ILE QD1 parsed_1im7 3
4 1 1 . . . . . . . . . 2 ILE HN parsed_1im7 3
4 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 3
5 1 1 . . . . . . . . . 2 ILE HA parsed_1im7 3
5 1 2 . . . . . . . . . 2 ILE QD1 parsed_1im7 3
6 1 1 . . . . . . . . . 2 ILE HA parsed_1im7 3
6 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 3
7 1 1 . . . . . . . . . 2 ILE HA parsed_1im7 3
7 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 3
8 1 1 . . . . . . . . . 2 ILE HB parsed_1im7 3
8 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 3
9 1 1 . . . . . . . . . 2 ILE QD1 parsed_1im7 3
9 1 2 . . . . . . . . . 3 TRP HN parsed_1im7 3
10 1 1 . . . . . . . . . 2 ILE QD1 parsed_1im7 3
10 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 3
11 1 1 . . . . . . . . . 3 TRP HN parsed_1im7 3
11 1 2 . . . . . . . . . 3 TRP QB parsed_1im7 3
12 1 1 . . . . . . . . . 3 TRP HN parsed_1im7 3
12 1 2 . . . . . . . . . 3 TRP HD1 parsed_1im7 3
13 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 3
13 1 2 . . . . . . . . . 3 TRP HD1 parsed_1im7 3
14 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 3
14 1 2 . . . . . . . . . 3 TRP HE3 parsed_1im7 3
15 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 3
15 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 3
16 1 1 . . . . . . . . . 3 TRP HA parsed_1im7 3
16 1 2 . . . . . . . . . 4 GLY QA parsed_1im7 3
17 1 1 . . . . . . . . . 3 TRP QB parsed_1im7 3
17 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 3
18 1 1 . . . . . . . . . 3 TRP HD1 parsed_1im7 3
18 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 3
19 1 1 . . . . . . . . . 3 TRP HE3 parsed_1im7 3
19 1 2 . . . . . . . . . 4 GLY HN parsed_1im7 3
20 1 1 . . . . . . . . . 4 GLY HN parsed_1im7 3
20 1 2 . . . . . . . . . 4 GLY QA parsed_1im7 3
21 1 1 . . . . . . . . . 4 GLY HN parsed_1im7 3
21 1 2 . . . . . . . . . 6 SER HN parsed_1im7 3
22 1 1 . . . . . . . . . 4 GLY QA parsed_1im7 3
22 1 2 . . . . . . . . . 5 CYSS HN parsed_1im7 3
23 1 1 . . . . . . . . . 4 GLY QA parsed_1im7 3
23 1 2 . . . . . . . . . 5 CYSS HA parsed_1im7 3
24 1 1 . . . . . . . . . 4 GLY QA parsed_1im7 3
24 1 2 . . . . . . . . . 6 SER HN parsed_1im7 3
25 1 1 . . . . . . . . . 5 CYSS HN parsed_1im7 3
25 1 2 . . . . . . . . . 5 CYSS QB parsed_1im7 3
26 1 1 . . . . . . . . . 5 CYSS HN parsed_1im7 3
26 1 2 . . . . . . . . . 6 SER HN parsed_1im7 3
27 1 1 . . . . . . . . . 5 CYSS HA parsed_1im7 3
27 1 2 . . . . . . . . . 6 SER HN parsed_1im7 3
28 1 1 . . . . . . . . . 5 CYSS HA parsed_1im7 3
28 1 2 . . . . . . . . . 6 SER QB parsed_1im7 3
29 1 1 . . . . . . . . . 5 CYSS QB parsed_1im7 3
29 1 2 . . . . . . . . . 6 SER HN parsed_1im7 3
30 1 1 . . . . . . . . . 6 SER HN parsed_1im7 3
30 1 2 . . . . . . . . . 6 SER HA parsed_1im7 3
31 1 1 . . . . . . . . . 6 SER HN parsed_1im7 3
31 1 2 . . . . . . . . . 6 SER HG parsed_1im7 3
32 1 1 . . . . . . . . . 6 SER HN parsed_1im7 3
32 1 2 . . . . . . . . . 7 GLY HN parsed_1im7 3
33 1 1 . . . . . . . . . 6 SER HN parsed_1im7 3
33 1 2 . . . . . . . . . 8 LYS QZ parsed_1im7 3
34 1 1 . . . . . . . . . 6 SER HA parsed_1im7 3
34 1 2 . . . . . . . . . 7 GLY HN parsed_1im7 3
35 1 1 . . . . . . . . . 6 SER HA parsed_1im7 3
35 1 2 . . . . . . . . . 8 LYS HN parsed_1im7 3
36 1 1 . . . . . . . . . 7 GLY HN parsed_1im7 3
36 1 2 . . . . . . . . . 8 LYS HN parsed_1im7 3
37 1 1 . . . . . . . . . 7 GLY QA parsed_1im7 3
37 1 2 . . . . . . . . . 8 LYS HN parsed_1im7 3
38 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 3
38 1 2 . . . . . . . . . 8 LYS QB parsed_1im7 3
39 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 3
39 1 2 . . . . . . . . . 8 LYS QG parsed_1im7 3
40 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 3
40 1 2 . . . . . . . . . 8 LYS QD parsed_1im7 3
41 1 1 . . . . . . . . . 8 LYS HN parsed_1im7 3
41 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 3
42 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 3
42 1 2 . . . . . . . . . 8 LYS QB parsed_1im7 3
43 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 3
43 1 2 . . . . . . . . . 8 LYS QD parsed_1im7 3
44 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 3
44 1 2 . . . . . . . . . 8 LYS QE parsed_1im7 3
45 1 1 . . . . . . . . . 8 LYS HA parsed_1im7 3
45 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 3
46 1 1 . . . . . . . . . 8 LYS QB parsed_1im7 3
46 1 2 . . . . . . . . . 8 LYS QE parsed_1im7 3
47 1 1 . . . . . . . . . 8 LYS QB parsed_1im7 3
47 1 2 . . . . . . . . . 10 ILE HN parsed_1im7 3
48 1 1 . . . . . . . . . 8 LYS QB parsed_1im7 3
48 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 3
49 1 1 . . . . . . . . . 8 LYS QG parsed_1im7 3
49 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 3
50 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 3
50 1 2 . . . . . . . . . 10 ILE QG1 parsed_1im7 3
51 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 3
51 1 2 . . . . . . . . . 10 ILE QD1 parsed_1im7 3
52 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 3
52 1 2 . . . . . . . . . 9 LEU HN parsed_1im7 3
53 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 3
53 1 2 . . . . . . . . . 9 LEU HA parsed_1im7 3
54 1 1 . . . . . . . . . 10 ILE HN parsed_1im7 3
54 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 3
55 1 1 . . . . . . . . . 10 ILE HA parsed_1im7 3
55 1 2 . . . . . . . . . 10 ILE QD1 parsed_1im7 3
56 1 1 . . . . . . . . . 10 ILE HA parsed_1im7 3
56 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 3
57 1 1 . . . . . . . . . 10 ILE HA parsed_1im7 3
57 1 2 . . . . . . . . . 12 THR HN parsed_1im7 3
58 1 1 . . . . . . . . . 10 ILE HB parsed_1im7 3
58 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 3
59 1 1 . . . . . . . . . 10 ILE QG1 parsed_1im7 3
59 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 3
60 1 1 . . . . . . . . . 10 ILE QD1 parsed_1im7 3
60 1 2 . . . . . . . . . 11 CYSS HN parsed_1im7 3
61 1 1 . . . . . . . . . 10 ILE QD1 parsed_1im7 3
61 1 2 . . . . . . . . . 12 THR HN parsed_1im7 3
62 1 1 . . . . . . . . . 9 LEU HN parsed_1im7 3
62 1 2 . . . . . . . . . 9 LEU QB parsed_1im7 3
63 1 1 . . . . . . . . . 9 LEU HN parsed_1im7 3
63 1 2 . . . . . . . . . 9 LEU QD1 parsed_1im7 3
64 1 1 . . . . . . . . . 9 LEU HA parsed_1im7 3
64 1 2 . . . . . . . . . 9 LEU QB parsed_1im7 3
65 1 1 . . . . . . . . . 9 LEU HA parsed_1im7 3
65 1 2 . . . . . . . . . 9 LEU QD1 parsed_1im7 3
66 1 1 . . . . . . . . . 11 CYSS HN parsed_1im7 3
66 1 2 . . . . . . . . . 11 CYSS QB parsed_1im7 3
67 1 1 . . . . . . . . . 11 CYSS HN parsed_1im7 3
67 1 2 . . . . . . . . . 12 THR HN parsed_1im7 3
68 1 1 . . . . . . . . . 11 CYSS HA parsed_1im7 3
68 1 2 . . . . . . . . . 12 THR HN parsed_1im7 3
69 1 1 . . . . . . . . . 11 CYSS QB parsed_1im7 3
69 1 2 . . . . . . . . . 12 THR HN parsed_1im7 3
70 1 1 . . . . . . . . . 12 THR HN parsed_1im7 3
70 1 2 . . . . . . . . . 12 THR HA parsed_1im7 3
71 1 1 . . . . . . . . . 12 THR HN parsed_1im7 3
71 1 2 . . . . . . . . . 12 THR HB parsed_1im7 3
72 1 1 . . . . . . . . . 12 THR HN parsed_1im7 3
72 1 2 . . . . . . . . . 12 THR QG2 parsed_1im7 3
73 1 1 . . . . . . . . . 12 THR HA parsed_1im7 3
73 1 2 . . . . . . . . . 12 THR HB parsed_1im7 3
74 1 1 . . . . . . . . . 12 THR HA parsed_1im7 3
74 1 2 . . . . . . . . . 13 THR HN parsed_1im7 3
75 1 1 . . . . . . . . . 12 THR HA parsed_1im7 3
75 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 3
76 1 1 . . . . . . . . . 13 THR HN parsed_1im7 3
76 1 2 . . . . . . . . . 13 THR HB parsed_1im7 3
77 1 1 . . . . . . . . . 13 THR HN parsed_1im7 3
77 1 2 . . . . . . . . . 13 THR QG2 parsed_1im7 3
78 1 1 . . . . . . . . . 13 THR HN parsed_1im7 3
78 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 3
79 1 1 . . . . . . . . . 13 THR HB parsed_1im7 3
79 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 3
80 1 1 . . . . . . . . . 13 THR QG2 parsed_1im7 3
80 1 2 . . . . . . . . . 14 ALA HN parsed_1im7 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 2.80 . parsed_1im7 3
2 1 . . . . . . 3.80 . parsed_1im7 3
3 1 . . . . . . 3.80 . parsed_1im7 3
4 1 . . . . . . 3.80 . parsed_1im7 3
5 1 . . . . . . 3.80 . parsed_1im7 3
6 1 . . . . . . 1.80 . parsed_1im7 3
7 1 . . . . . . 3.80 . parsed_1im7 3
8 1 . . . . . . 3.80 . parsed_1im7 3
9 1 . . . . . . 3.80 . parsed_1im7 3
10 1 . . . . . . 3.80 . parsed_1im7 3
11 1 . . . . . . 2.80 . parsed_1im7 3
12 1 . . . . . . 3.80 . parsed_1im7 3
13 1 . . . . . . 3.80 . parsed_1im7 3
14 1 . . . . . . 3.80 . parsed_1im7 3
15 1 . . . . . . 1.80 . parsed_1im7 3
16 1 . . . . . . 3.80 . parsed_1im7 3
17 1 . . . . . . 3.80 . parsed_1im7 3
18 1 . . . . . . 3.80 . parsed_1im7 3
19 1 . . . . . . 3.80 . parsed_1im7 3
20 1 . . . . . . 1.80 . parsed_1im7 3
21 1 . . . . . . 3.80 . parsed_1im7 3
22 1 . . . . . . 1.80 . parsed_1im7 3
23 1 . . . . . . 3.80 . parsed_1im7 3
24 1 . . . . . . 3.80 . parsed_1im7 3
25 1 . . . . . . 2.80 . parsed_1im7 3
26 1 . . . . . . 3.80 . parsed_1im7 3
27 1 . . . . . . 1.80 . parsed_1im7 3
28 1 . . . . . . 3.80 . parsed_1im7 3
29 1 . . . . . . 3.80 . parsed_1im7 3
30 1 . . . . . . 2.80 . parsed_1im7 3
31 1 . . . . . . 3.80 . parsed_1im7 3
32 1 . . . . . . 2.80 . parsed_1im7 3
33 1 . . . . . . 3.80 . parsed_1im7 3
34 1 . . . . . . 1.80 . parsed_1im7 3
35 1 . . . . . . 3.80 . parsed_1im7 3
36 1 . . . . . . 2.80 . parsed_1im7 3
37 1 . . . . . . 2.80 . parsed_1im7 3
38 1 . . . . . . 2.80 . parsed_1im7 3
39 1 . . . . . . 3.80 . parsed_1im7 3
40 1 . . . . . . 3.80 . parsed_1im7 3
41 1 . . . . . . 2.80 . parsed_1im7 3
42 1 . . . . . . 2.80 . parsed_1im7 3
43 1 . . . . . . 3.80 . parsed_1im7 3
44 1 . . . . . . 3.80 . parsed_1im7 3
45 1 . . . . . . 1.80 . parsed_1im7 3
46 1 . . . . . . 3.80 . parsed_1im7 3
47 1 . . . . . . 2.80 . parsed_1im7 3
48 1 . . . . . . 3.80 . parsed_1im7 3
49 1 . . . . . . 3.80 . parsed_1im7 3
50 1 . . . . . . 3.80 . parsed_1im7 3
51 1 . . . . . . 3.80 . parsed_1im7 3
52 1 . . . . . . 2.80 . parsed_1im7 3
53 1 . . . . . . 2.80 . parsed_1im7 3
54 1 . . . . . . 2.80 . parsed_1im7 3
55 1 . . . . . . 3.80 . parsed_1im7 3
56 1 . . . . . . 1.80 . parsed_1im7 3
57 1 . . . . . . 2.80 . parsed_1im7 3
58 1 . . . . . . 3.80 . parsed_1im7 3
59 1 . . . . . . 3.80 . parsed_1im7 3
60 1 . . . . . . 3.80 . parsed_1im7 3
61 1 . . . . . . 3.80 . parsed_1im7 3
62 1 . . . . . . 1.80 . parsed_1im7 3
63 1 . . . . . . 3.80 . parsed_1im7 3
64 1 . . . . . . 1.80 . parsed_1im7 3
65 1 . . . . . . 3.80 . parsed_1im7 3
66 1 . . . . . . 2.80 . parsed_1im7 3
67 1 . . . . . . 2.80 . parsed_1im7 3
68 1 . . . . . . 1.80 . parsed_1im7 3
69 1 . . . . . . 3.80 . parsed_1im7 3
70 1 . . . . . . 2.80 . parsed_1im7 3
71 1 . . . . . . 2.80 . parsed_1im7 3
72 1 . . . . . . 3.80 . parsed_1im7 3
73 1 . . . . . . 2.80 . parsed_1im7 3
74 1 . . . . . . 1.80 . parsed_1im7 3
75 1 . . . . . . 3.80 . parsed_1im7 3
76 1 . . . . . . 2.80 . parsed_1im7 3
77 1 . . . . . . 3.80 . parsed_1im7 3
78 1 . . . . . . 2.80 . parsed_1im7 3
79 1 . . . . . . 3.80 . parsed_1im7 3
80 1 . . . . . . 3.80 . parsed_1im7 3
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 "lower limit contraints using DYANA-1.5" 2 1 2 39 parsed_1im7 3
2 3.33 3 37 3 57 parsed_1im7 3
3 6.38 4 37 4 57 parsed_1im7 3
4 6.06 5 37 5 57 parsed_1im7 3
5 4.17 6 37 6 57 parsed_1im7 3
6 4.88 7 37 7 57 parsed_1im7 3
7 2.68 8 37 8 57 parsed_1im7 3
8 4.51 9 37 9 57 parsed_1im7 3
9 3.89 10 37 10 57 parsed_1im7 3
10 5.75 11 37 11 57 parsed_1im7 3
11 6.53 12 37 12 57 parsed_1im7 3
12 3.48 13 37 13 57 parsed_1im7 3
13 5.28 14 37 14 57 parsed_1im7 3
14 5.04 15 37 15 57 parsed_1im7 3
15 4.88 16 37 16 57 parsed_1im7 3
16 2.74 17 37 17 57 parsed_1im7 3
17 5.29 18 37 18 57 parsed_1im7 3
18 3.86 19 37 19 57 parsed_1im7 3
19 5.50 20 37 20 57 parsed_1im7 3
20 5.50 21 37 21 57 parsed_1im7 3
21 2.71 22 37 22 57 parsed_1im7 3
22 3.89 23 37 23 57 parsed_1im7 3
23 2.71 24 37 24 57 parsed_1im7 3
24 5.45 25 37 25 57 parsed_1im7 3
25 5.48 26 37 26 57 parsed_1im7 3
26 3.64 27 37 27 57 parsed_1im7 3
27 4.04 28 37 28 57 parsed_1im7 3
28 2.80 29 37 29 57 parsed_1im7 3
29 5.57 30 37 30 57 parsed_1im7 3
30 4.20 31 37 31 57 parsed_1im7 3
31 2.83 32 37 32 57 parsed_1im7 3
32 5.50 33 37 33 57 parsed_1im7 3
33 3.52 34 37 34 57 parsed_1im7 3
34 6.31 35 37 35 57 parsed_1im7 3
35 2.62 36 37 36 57 parsed_1im7 3
36 3.86 37 37 37 57 parsed_1im7 3
37 3.11 38 37 38 57 parsed_1im7 3
38 3.42 39 37 39 57 parsed_1im7 3
39 3.19 40 37 40 57 parsed_1im7 3
40 6.38 41 37 41 57 parsed_1im7 3
41 6.28 42 37 42 57 parsed_1im7 3
42 3.48 43 37 43 57 parsed_1im7 3
43 2.99 44 37 44 57 parsed_1im7 3
44 6.38 45 37 45 57 parsed_1im7 3
45 6.38 46 37 46 57 parsed_1im7 3
46 2.74 47 37 47 57 parsed_1im7 3
47 5.82 48 37 48 57 parsed_1im7 3
48 3.20 49 37 49 57 parsed_1im7 3
49 4.30 50 37 50 57 parsed_1im7 3
50 6.38 51 37 51 42 parsed_1im7 3
51 4.88 52 37 52 57 parsed_1im7 3
52 5.09 53 37 53 57 parsed_1im7 3
53 2.83 54 37 54 57 parsed_1im7 3
54 3.17 55 37 55 57 parsed_1im7 3
55 3.73 56 37 56 57 parsed_1im7 3
56 6.12 57 37 57 57 parsed_1im7 3
57 2.52 58 37 58 57 parsed_1im7 3
58 3.48 59 37 59 57 parsed_1im7 3
59 5.04 60 37 60 57 parsed_1im7 3
60 5.50 61 37 61 57 parsed_1im7 3
61 5.40 62 37 62 57 parsed_1im7 3
62 7.29 63 37 63 57 parsed_1im7 3
63 2.71 64 37 64 57 parsed_1im7 3
64 6.19 65 37 65 57 parsed_1im7 3
65 2.71 66 37 66 57 parsed_1im7 3
66 4.39 67 37 67 57 parsed_1im7 3
67 3.12 68 37 68 57 parsed_1im7 3
68 3.21 69 37 69 57 parsed_1im7 3
69 2.77 70 37 70 57 parsed_1im7 3
70 2.80#3.67 71 37 71 62 parsed_1im7 3
71 2.87 72 37 72 57 parsed_1im7 3
72 3.27 73 37 73 57 parsed_1im7 3
73 4.61 74 37 74 57 parsed_1im7 3
74 2.96 75 37 75 57 parsed_1im7 3
75 2.68 76 37 76 57 parsed_1im7 3
76 5.04 77 37 77 57 parsed_1im7 3
77 3.17 78 37 78 57 parsed_1im7 3
78 4.73 79 37 79 57 parsed_1im7 3
79 3.58 80 37 80 57 parsed_1im7 3
80 3.89 81 37 81 57 parsed_1im7 3
81 5.78 82 37 82 57 parsed_1im7 3
stop_
save_
save_DYANA/DIANA_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1im7
_Distance_constraint_list.ID 4
_Distance_constraint_list.Constraint_type "disulfide bond"
_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_1im7 4
2 1 . . . parsed_1im7 4
3 1 . . . parsed_1im7 4
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 . . . . . . . . . 5 CYSS CB parsed_1im7 4
1 1 2 . . . . . . . . . 11 CYSS SG parsed_1im7 4
2 1 1 . . . . . . . . . 5 CYSS SG parsed_1im7 4
2 1 2 . . . . . . . . . 11 CYSS CB parsed_1im7 4
3 1 1 . . . . . . . . . 5 CYSS SG parsed_1im7 4
3 1 2 . . . . . . . . . 11 CYSS SG parsed_1im7 4
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 . . . . . . . 3.10 parsed_1im7 4
2 1 . . . . . . . 3.10 parsed_1im7 4
3 1 . . . . . . . 2.10 parsed_1im7 4
stop_
save_
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