NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
34033 |
1jaa   |
5108 | cing | 2-parsed | STAR | entry | full | 177 |
data_1jaa_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1jaa
_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_1jaa 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1jaa
_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 1jaa "Master copy" parsed_1jaa
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1jaa
_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 1jaa.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1jaa 1
1 1jaa.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1jaa 1
1 1jaa.mr . . DYANA/DIANA 3 distance NOE simple 79 parsed_1jaa 1
1 1jaa.mr . . DYANA/DIANA 4 distance "general distance" simple 10 parsed_1jaa 1
1 1jaa.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1jaa 1
1 1jaa.mr . . DYANA/DIANA 6 distance NOE simple 79 parsed_1jaa 1
1 1jaa.mr . . DYANA/DIANA 7 distance "general distance" simple 9 parsed_1jaa 1
1 1jaa.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1jaa 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_1jaa
_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 30-MAY-01 1JAA
*TITLE SOLUTION STRUCTURE OF LACTAM ANALOGUE (DAPE) OF HIV GP41
*TITLE 2 600-612 LOOP.
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: DAPE : (ACE)IWG(DAP)SGKLIETTA ANALOGUE OF HIV
*COMPND 3 GP41;
*COMPND 4 CHAIN: A;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: THE PARENT PEPTIDE (IWGCSGKLICTTA) OCCURS
*SOURCE 4 NATURALLY IN HIV GP41 GLYCOPROTEIN
*KEYWDS LACTAM BOND, CYCLIC PEPTIDE , PEPTIDOMIMETICS, GP41, HIV
*EXPDTA NMR, 50 STRUCTURES
*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 01-JUL-03 1JAA 0
;
save_
save_MR_file_comment_2
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1jaa
_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
;
NMR restraints used for the calculation of DAPE analogue structure
upper limit retraints
atom1 atom2 upper limit distance
;
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jaa
_Distance_constraint_list.ID 1
_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_1jaa 1
2 1 . . . parsed_1jaa 1
3 1 . . . parsed_1jaa 1
4 1 . . . parsed_1jaa 1
5 1 . . . parsed_1jaa 1
6 1 . . . parsed_1jaa 1
7 1 . . . parsed_1jaa 1
8 1 . . . parsed_1jaa 1
9 1 . . . parsed_1jaa 1
10 1 . . . parsed_1jaa 1
11 1 . . . parsed_1jaa 1
12 1 . . . parsed_1jaa 1
13 1 . . . parsed_1jaa 1
14 1 . . . parsed_1jaa 1
15 1 . . . parsed_1jaa 1
16 1 . . . parsed_1jaa 1
17 1 . . . parsed_1jaa 1
18 1 . . . parsed_1jaa 1
19 1 . . . parsed_1jaa 1
20 1 . . . parsed_1jaa 1
21 1 . . . parsed_1jaa 1
22 1 . . . parsed_1jaa 1
23 1 . . . parsed_1jaa 1
24 1 . . . parsed_1jaa 1
25 1 . . . parsed_1jaa 1
26 1 . . . parsed_1jaa 1
27 1 . . . parsed_1jaa 1
28 1 . . . parsed_1jaa 1
29 1 . . . parsed_1jaa 1
30 1 . . . parsed_1jaa 1
31 1 . . . parsed_1jaa 1
32 1 . . . parsed_1jaa 1
33 1 . . . parsed_1jaa 1
34 1 . . . parsed_1jaa 1
35 1 . . . parsed_1jaa 1
36 1 . . . parsed_1jaa 1
37 1 . . . parsed_1jaa 1
38 1 . . . parsed_1jaa 1
39 1 . . . parsed_1jaa 1
40 1 . . . parsed_1jaa 1
41 1 . . . parsed_1jaa 1
42 1 . . . parsed_1jaa 1
43 1 . . . parsed_1jaa 1
44 1 . . . parsed_1jaa 1
45 1 . . . parsed_1jaa 1
46 1 . . . parsed_1jaa 1
47 1 . . . parsed_1jaa 1
48 1 . . . parsed_1jaa 1
49 1 . . . parsed_1jaa 1
50 1 . . . parsed_1jaa 1
51 1 . . . parsed_1jaa 1
52 1 . . . parsed_1jaa 1
53 1 . . . parsed_1jaa 1
54 1 . . . parsed_1jaa 1
55 1 . . . parsed_1jaa 1
56 1 . . . parsed_1jaa 1
57 1 . . . parsed_1jaa 1
58 1 . . . parsed_1jaa 1
59 1 . . . parsed_1jaa 1
60 1 . . . parsed_1jaa 1
61 1 . . . parsed_1jaa 1
62 1 . . . parsed_1jaa 1
63 1 . . . parsed_1jaa 1
64 1 . . . parsed_1jaa 1
65 1 . . . parsed_1jaa 1
66 1 . . . parsed_1jaa 1
67 1 . . . parsed_1jaa 1
68 1 . . . parsed_1jaa 1
69 1 . . . parsed_1jaa 1
70 1 . . . parsed_1jaa 1
71 1 . . . parsed_1jaa 1
72 1 . . . parsed_1jaa 1
73 1 . . . parsed_1jaa 1
74 1 . . . parsed_1jaa 1
75 1 . . . parsed_1jaa 1
76 1 . . . parsed_1jaa 1
77 1 . . . parsed_1jaa 1
78 1 . . . parsed_1jaa 1
79 1 . . . parsed_1jaa 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_1jaa 1
1 1 2 . . . . . . . . . 2 ILE HA parsed_1jaa 1
2 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 1
2 1 2 . . . . . . . . . 2 ILE HB parsed_1jaa 1
3 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 1
3 1 2 . . . . . . . . . 2 ILE QG2 parsed_1jaa 1
4 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 1
4 1 2 . . . . . . . . . 2 ILE QG1 parsed_1jaa 1
5 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 1
5 1 2 . . . . . . . . . 2 ILE QD1 parsed_1jaa 1
6 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 1
6 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 1
7 1 1 . . . . . . . . . 2 ILE HA parsed_1jaa 1
7 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 1
8 1 1 . . . . . . . . . 2 ILE HA parsed_1jaa 1
8 1 2 . . . . . . . . . 3 TRP HD1 parsed_1jaa 1
9 1 1 . . . . . . . . . 2 ILE HB parsed_1jaa 1
9 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 1
10 1 1 . . . . . . . . . 2 ILE QG1 parsed_1jaa 1
10 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 1
11 1 1 . . . . . . . . . 2 ILE QD1 parsed_1jaa 1
11 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 1
12 1 1 . . . . . . . . . 3 TRP HN parsed_1jaa 1
12 1 2 . . . . . . . . . 3 TRP HA parsed_1jaa 1
13 1 1 . . . . . . . . . 3 TRP HN parsed_1jaa 1
13 1 2 . . . . . . . . . 3 TRP QB parsed_1jaa 1
14 1 1 . . . . . . . . . 3 TRP HN parsed_1jaa 1
14 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 1
15 1 1 . . . . . . . . . 3 TRP HA parsed_1jaa 1
15 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 1
16 1 1 . . . . . . . . . 3 TRP QB parsed_1jaa 1
16 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 1
17 1 1 . . . . . . . . . 3 TRP HD1 parsed_1jaa 1
17 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 1
18 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jaa 1
18 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 1
19 1 1 . . . . . . . . . 4 GLY HN parsed_1jaa 1
19 1 2 . . . . . . . . . 4 GLY QA parsed_1jaa 1
20 1 1 . . . . . . . . . 4 GLY HN parsed_1jaa 1
20 1 2 . . . . . . . . . 5 DAP HN parsed_1jaa 1
21 1 1 . . . . . . . . . 4 GLY QA parsed_1jaa 1
21 1 2 . . . . . . . . . 5 DAP HN parsed_1jaa 1
22 1 1 . . . . . . . . . 5 DAP HN parsed_1jaa 1
22 1 2 . . . . . . . . . 5 DAP HA parsed_1jaa 1
23 1 1 . . . . . . . . . 5 DAP HN parsed_1jaa 1
23 1 2 . . . . . . . . . 5 DAP QB parsed_1jaa 1
24 1 1 . . . . . . . . . 5 DAP HA parsed_1jaa 1
24 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 1
25 1 1 . . . . . . . . . 5 DAP HA parsed_1jaa 1
25 1 2 . . . . . . . . . 6 SER HN parsed_1jaa 1
26 1 1 . . . . . . . . . 5 DAP QB parsed_1jaa 1
26 1 2 . . . . . . . . . 6 SER HN parsed_1jaa 1
27 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 1
27 1 2 . . . . . . . . . 6 SER HN parsed_1jaa 1
28 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 1
28 1 2 . . . . . . . . . 11 GLU HA parsed_1jaa 1
29 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 1
29 1 2 . . . . . . . . . 11 GLU QB parsed_1jaa 1
30 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 1
30 1 2 . . . . . . . . . 11 GLU QG parsed_1jaa 1
31 1 1 . . . . . . . . . 6 SER HN parsed_1jaa 1
31 1 2 . . . . . . . . . 6 SER HA parsed_1jaa 1
32 1 1 . . . . . . . . . 6 SER HN parsed_1jaa 1
32 1 2 . . . . . . . . . 7 GLY HN parsed_1jaa 1
33 1 1 . . . . . . . . . 6 SER HA parsed_1jaa 1
33 1 2 . . . . . . . . . 7 GLY HN parsed_1jaa 1
34 1 1 . . . . . . . . . 6 SER QB parsed_1jaa 1
34 1 2 . . . . . . . . . 7 GLY HN parsed_1jaa 1
35 1 1 . . . . . . . . . 7 GLY HN parsed_1jaa 1
35 1 2 . . . . . . . . . 7 GLY QA parsed_1jaa 1
36 1 1 . . . . . . . . . 7 GLY HN parsed_1jaa 1
36 1 2 . . . . . . . . . 8 LYS HN parsed_1jaa 1
37 1 1 . . . . . . . . . 7 GLY QA parsed_1jaa 1
37 1 2 . . . . . . . . . 8 LYS HN parsed_1jaa 1
38 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 1
38 1 2 . . . . . . . . . 8 LYS HA parsed_1jaa 1
39 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 1
39 1 2 . . . . . . . . . 8 LYS QB parsed_1jaa 1
40 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 1
40 1 2 . . . . . . . . . 8 LYS QG parsed_1jaa 1
41 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 1
41 1 2 . . . . . . . . . 8 LYS QD parsed_1jaa 1
42 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 1
42 1 2 . . . . . . . . . 8 LYS QE parsed_1jaa 1
43 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 1
43 1 2 . . . . . . . . . 9 LEU HN parsed_1jaa 1
44 1 1 . . . . . . . . . 8 LYS HA parsed_1jaa 1
44 1 2 . . . . . . . . . 9 LEU HN parsed_1jaa 1
45 1 1 . . . . . . . . . 8 LYS HA parsed_1jaa 1
45 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 1
46 1 1 . . . . . . . . . 8 LYS QB parsed_1jaa 1
46 1 2 . . . . . . . . . 9 LEU HN parsed_1jaa 1
47 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 1
47 1 2 . . . . . . . . . 9 LEU HA parsed_1jaa 1
48 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 1
48 1 2 . . . . . . . . . 9 LEU QB parsed_1jaa 1
49 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 1
49 1 2 . . . . . . . . . 9 LEU HG parsed_1jaa 1
50 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 1
50 1 2 . . . . . . . . . 9 LEU QQD parsed_1jaa 1
51 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 1
51 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 1
52 1 1 . . . . . . . . . 9 LEU QB parsed_1jaa 1
52 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 1
53 1 1 . . . . . . . . . 9 LEU HG parsed_1jaa 1
53 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 1
54 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 1
54 1 2 . . . . . . . . . 10 ILE HA parsed_1jaa 1
55 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 1
55 1 2 . . . . . . . . . 10 ILE HB parsed_1jaa 1
56 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 1
56 1 2 . . . . . . . . . 10 ILE QG1 parsed_1jaa 1
57 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 1
57 1 2 . . . . . . . . . 10 ILE QD1 parsed_1jaa 1
58 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 1
58 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 1
59 1 1 . . . . . . . . . 10 ILE HA parsed_1jaa 1
59 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 1
60 1 1 . . . . . . . . . 10 ILE QG2 parsed_1jaa 1
60 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 1
61 1 1 . . . . . . . . . 10 ILE QG1 parsed_1jaa 1
61 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 1
62 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jaa 1
62 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 1
63 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jaa 1
63 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 1
64 1 1 . . . . . . . . . 11 GLU HN parsed_1jaa 1
64 1 2 . . . . . . . . . 11 GLU HA parsed_1jaa 1
65 1 1 . . . . . . . . . 11 GLU HN parsed_1jaa 1
65 1 2 . . . . . . . . . 11 GLU QG parsed_1jaa 1
66 1 1 . . . . . . . . . 11 GLU HN parsed_1jaa 1
66 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 1
67 1 1 . . . . . . . . . 11 GLU HA parsed_1jaa 1
67 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 1
68 1 1 . . . . . . . . . 11 GLU QB parsed_1jaa 1
68 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 1
69 1 1 . . . . . . . . . 11 GLU QG parsed_1jaa 1
69 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 1
70 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 1
70 1 2 . . . . . . . . . 12 THR HA parsed_1jaa 1
71 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 1
71 1 2 . . . . . . . . . 12 THR HB parsed_1jaa 1
72 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 1
72 1 2 . . . . . . . . . 12 THR QG2 parsed_1jaa 1
73 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 1
73 1 2 . . . . . . . . . 13 THR HN parsed_1jaa 1
74 1 1 . . . . . . . . . 12 THR HA parsed_1jaa 1
74 1 2 . . . . . . . . . 13 THR HN parsed_1jaa 1
75 1 1 . . . . . . . . . 13 THR HN parsed_1jaa 1
75 1 2 . . . . . . . . . 13 THR HA parsed_1jaa 1
76 1 1 . . . . . . . . . 13 THR HN parsed_1jaa 1
76 1 2 . . . . . . . . . 13 THR HB parsed_1jaa 1
77 1 1 . . . . . . . . . 13 THR HN parsed_1jaa 1
77 1 2 . . . . . . . . . 13 THR QG2 parsed_1jaa 1
78 1 1 . . . . . . . . . 14 ALA HN parsed_1jaa 1
78 1 2 . . . . . . . . . 14 ALA HA parsed_1jaa 1
79 1 1 . . . . . . . . . 14 ALA HN parsed_1jaa 1
79 1 2 . . . . . . . . . 14 ALA QB parsed_1jaa 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_1jaa 1
2 1 . . . . . . . 3.80 parsed_1jaa 1
3 1 . . . . . . . 5.50 parsed_1jaa 1
4 1 . . . . . . . 5.50 parsed_1jaa 1
5 1 . . . . . . . 5.50 parsed_1jaa 1
6 1 . . . . . . . 4.80 parsed_1jaa 1
7 1 . . . . . . . 2.80 parsed_1jaa 1
8 1 . . . . . . . 5.50 parsed_1jaa 1
9 1 . . . . . . . 4.80 parsed_1jaa 1
10 1 . . . . . . . 5.50 parsed_1jaa 1
11 1 . . . . . . . 5.50 parsed_1jaa 1
12 1 . . . . . . . 3.80 parsed_1jaa 1
13 1 . . . . . . . 4.04 parsed_1jaa 1
14 1 . . . . . . . 3.80 parsed_1jaa 1
15 1 . . . . . . . 3.20 parsed_1jaa 1
16 1 . . . . . . . 4.59 parsed_1jaa 1
17 1 . . . . . . . 5.50 parsed_1jaa 1
18 1 . . . . . . . 5.50 parsed_1jaa 1
19 1 . . . . . . . 3.61 parsed_1jaa 1
20 1 . . . . . . . 3.80 parsed_1jaa 1
21 1 . . . . . . . 3.48 parsed_1jaa 1
22 1 . . . . . . . 3.80 parsed_1jaa 1
23 1 . . . . . . . 3.80 parsed_1jaa 1
24 1 . . . . . . . 5.50 parsed_1jaa 1
25 1 . . . . . . . 3.20 parsed_1jaa 1
26 1 . . . . . . . 4.63 parsed_1jaa 1
27 1 . . . . . . . 4.80 parsed_1jaa 1
28 1 . . . . . . . 4.80 parsed_1jaa 1
29 1 . . . . . . . 5.50 parsed_1jaa 1
30 1 . . . . . . . 5.13 parsed_1jaa 1
31 1 . . . . . . . 3.80 parsed_1jaa 1
32 1 . . . . . . . 5.50 parsed_1jaa 1
33 1 . . . . . . . 3.20 parsed_1jaa 1
34 1 . . . . . . . 5.50 parsed_1jaa 1
35 1 . . . . . . . 3.20 parsed_1jaa 1
36 1 . . . . . . . 3.80 parsed_1jaa 1
37 1 . . . . . . . 3.80 parsed_1jaa 1
38 1 . . . . . . . 3.80 parsed_1jaa 1
39 1 . . . . . . . 5.50 parsed_1jaa 1
40 1 . . . . . . . 5.50 parsed_1jaa 1
41 1 . . . . . . . 5.50 parsed_1jaa 1
42 1 . . . . . . . 5.50 parsed_1jaa 1
43 1 . . . . . . . 3.80 parsed_1jaa 1
44 1 . . . . . . . 2.80 parsed_1jaa 1
45 1 . . . . . . . 5.50 parsed_1jaa 1
46 1 . . . . . . . 5.50 parsed_1jaa 1
47 1 . . . . . . . 3.80 parsed_1jaa 1
48 1 . . . . . . . 5.50 parsed_1jaa 1
49 1 . . . . . . . 3.80 parsed_1jaa 1
50 1 . . . . . . . 5.50 parsed_1jaa 1
51 1 . . . . . . . 5.50 parsed_1jaa 1
52 1 . . . . . . . 5.50 parsed_1jaa 1
53 1 . . . . . . . 5.50 parsed_1jaa 1
54 1 . . . . . . . 3.80 parsed_1jaa 1
55 1 . . . . . . . 3.80 parsed_1jaa 1
56 1 . . . . . . . 5.50 parsed_1jaa 1
57 1 . . . . . . . 5.50 parsed_1jaa 1
58 1 . . . . . . . 3.80 parsed_1jaa 1
59 1 . . . . . . . 2.80 parsed_1jaa 1
60 1 . . . . . . . 5.50 parsed_1jaa 1
61 1 . . . . . . . 5.50 parsed_1jaa 1
62 1 . . . . . . . 5.50 parsed_1jaa 1
63 1 . . . . . . . 5.50 parsed_1jaa 1
64 1 . . . . . . . 3.80 parsed_1jaa 1
65 1 . . . . . . . 4.66 parsed_1jaa 1
66 1 . . . . . . . 3.80 parsed_1jaa 1
67 1 . . . . . . . 3.80 parsed_1jaa 1
68 1 . . . . . . . 5.50 parsed_1jaa 1
69 1 . . . . . . . 5.50 parsed_1jaa 1
70 1 . . . . . . . 3.80 parsed_1jaa 1
71 1 . . . . . . . 3.80 parsed_1jaa 1
72 1 . . . . . . . 5.50 parsed_1jaa 1
73 1 . . . . . . . 3.80 parsed_1jaa 1
74 1 . . . . . . . 3.80 parsed_1jaa 1
75 1 . . . . . . . 3.80 parsed_1jaa 1
76 1 . . . . . . . 3.80 parsed_1jaa 1
77 1 . . . . . . . 4.80 parsed_1jaa 1
78 1 . . . . . . . 3.80 parsed_1jaa 1
79 1 . . . . . . . 5.50 parsed_1jaa 1
stop_
save_
save_DYANA/DIANA_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jaa
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "general distance"
_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_1jaa 2
2 1 . . . parsed_1jaa 2
3 1 . . . parsed_1jaa 2
4 1 . . . parsed_1jaa 2
5 1 . . . parsed_1jaa 2
6 1 . . . parsed_1jaa 2
7 1 . . . parsed_1jaa 2
8 1 . . . parsed_1jaa 2
9 1 . . . parsed_1jaa 2
10 1 . . . parsed_1jaa 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 . . . . . . . . . 11 GLU CD parsed_1jaa 2
1 1 2 . . . . . . . . . 5 DAP NG parsed_1jaa 2
2 1 1 . . . . . . . . . 11 GLU OD1 parsed_1jaa 2
2 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 2
3 1 1 . . . . . . . . . 11 GLU CG parsed_1jaa 2
3 1 2 . . . . . . . . . 5 DAP NG parsed_1jaa 2
4 1 1 . . . . . . . . . 11 GLU OD1 parsed_1jaa 2
4 1 2 . . . . . . . . . 5 DAP NG parsed_1jaa 2
5 1 1 . . . . . . . . . 11 GLU CD parsed_1jaa 2
5 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 2
6 1 1 . . . . . . . . . 11 GLU CD parsed_1jaa 2
6 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 2
7 1 1 . . . . . . . . . 11 GLU CD parsed_1jaa 2
7 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 2
8 1 1 . . . . . . . . . 11 GLU CG parsed_1jaa 2
8 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 2
9 1 1 . . . . . . . . . 11 GLU OD1 parsed_1jaa 2
9 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 2
10 1 1 . . . . . . . . . 11 GLU CG parsed_1jaa 2
10 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 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 . . . . . . . 1.34 parsed_1jaa 2
2 1 . . . . . . . 3.1 parsed_1jaa 2
3 1 . . . . . . . 2.36 parsed_1jaa 2
4 1 . . . . . . . 2.24 parsed_1jaa 2
5 1 . . . . . . . 2.43 parsed_1jaa 2
6 1 . . . . . . . 2.43 parsed_1jaa 2
7 1 . . . . . . . 2.06 parsed_1jaa 2
8 1 . . . . . . . 2.46 parsed_1jaa 2
9 1 . . . . . . . 2.71 parsed_1jaa 2
10 1 . . . . . . . 3.76 parsed_1jaa 2
stop_
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1jaa
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 5
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
Lower limit restraints
atom1 atom2 lower limit distance
;
save_
save_DYANA/DIANA_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jaa
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 6
_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_1jaa 3
2 1 . . . parsed_1jaa 3
3 1 . . . parsed_1jaa 3
4 1 . . . parsed_1jaa 3
5 1 . . . parsed_1jaa 3
6 1 . . . parsed_1jaa 3
7 1 . . . parsed_1jaa 3
8 1 . . . parsed_1jaa 3
9 1 . . . parsed_1jaa 3
10 1 . . . parsed_1jaa 3
11 1 . . . parsed_1jaa 3
12 1 . . . parsed_1jaa 3
13 1 . . . parsed_1jaa 3
14 1 . . . parsed_1jaa 3
15 1 . . . parsed_1jaa 3
16 1 . . . parsed_1jaa 3
17 1 . . . parsed_1jaa 3
18 1 . . . parsed_1jaa 3
19 1 . . . parsed_1jaa 3
20 1 . . . parsed_1jaa 3
21 1 . . . parsed_1jaa 3
22 1 . . . parsed_1jaa 3
23 1 . . . parsed_1jaa 3
24 1 . . . parsed_1jaa 3
25 1 . . . parsed_1jaa 3
26 1 . . . parsed_1jaa 3
27 1 . . . parsed_1jaa 3
28 1 . . . parsed_1jaa 3
29 1 . . . parsed_1jaa 3
30 1 . . . parsed_1jaa 3
31 1 . . . parsed_1jaa 3
32 1 . . . parsed_1jaa 3
33 1 . . . parsed_1jaa 3
34 1 . . . parsed_1jaa 3
35 1 . . . parsed_1jaa 3
36 1 . . . parsed_1jaa 3
37 1 . . . parsed_1jaa 3
38 1 . . . parsed_1jaa 3
39 1 . . . parsed_1jaa 3
40 1 . . . parsed_1jaa 3
41 1 . . . parsed_1jaa 3
42 1 . . . parsed_1jaa 3
43 1 . . . parsed_1jaa 3
44 1 . . . parsed_1jaa 3
45 1 . . . parsed_1jaa 3
46 1 . . . parsed_1jaa 3
47 1 . . . parsed_1jaa 3
48 1 . . . parsed_1jaa 3
49 1 . . . parsed_1jaa 3
50 1 . . . parsed_1jaa 3
51 1 . . . parsed_1jaa 3
52 1 . . . parsed_1jaa 3
53 1 . . . parsed_1jaa 3
54 1 . . . parsed_1jaa 3
55 1 . . . parsed_1jaa 3
56 1 . . . parsed_1jaa 3
57 1 . . . parsed_1jaa 3
58 1 . . . parsed_1jaa 3
59 1 . . . parsed_1jaa 3
60 1 . . . parsed_1jaa 3
61 1 . . . parsed_1jaa 3
62 1 . . . parsed_1jaa 3
63 1 . . . parsed_1jaa 3
64 1 . . . parsed_1jaa 3
65 1 . . . parsed_1jaa 3
66 1 . . . parsed_1jaa 3
67 1 . . . parsed_1jaa 3
68 1 . . . parsed_1jaa 3
69 1 . . . parsed_1jaa 3
70 1 . . . parsed_1jaa 3
71 1 . . . parsed_1jaa 3
72 1 . . . parsed_1jaa 3
73 1 . . . parsed_1jaa 3
74 1 . . . parsed_1jaa 3
75 1 . . . parsed_1jaa 3
76 1 . . . parsed_1jaa 3
77 1 . . . parsed_1jaa 3
78 1 . . . parsed_1jaa 3
79 1 . . . parsed_1jaa 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_1jaa 3
1 1 2 . . . . . . . . . 2 ILE HA parsed_1jaa 3
2 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 3
2 1 2 . . . . . . . . . 2 ILE HB parsed_1jaa 3
3 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 3
3 1 2 . . . . . . . . . 2 ILE QG2 parsed_1jaa 3
4 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 3
4 1 2 . . . . . . . . . 2 ILE QG1 parsed_1jaa 3
5 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 3
5 1 2 . . . . . . . . . 2 ILE QD1 parsed_1jaa 3
6 1 1 . . . . . . . . . 2 ILE HN parsed_1jaa 3
6 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 3
7 1 1 . . . . . . . . . 2 ILE HA parsed_1jaa 3
7 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 3
8 1 1 . . . . . . . . . 2 ILE HA parsed_1jaa 3
8 1 2 . . . . . . . . . 3 TRP HD1 parsed_1jaa 3
9 1 1 . . . . . . . . . 2 ILE HB parsed_1jaa 3
9 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 3
10 1 1 . . . . . . . . . 2 ILE QG1 parsed_1jaa 3
10 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 3
11 1 1 . . . . . . . . . 2 ILE QD1 parsed_1jaa 3
11 1 2 . . . . . . . . . 3 TRP HN parsed_1jaa 3
12 1 1 . . . . . . . . . 3 TRP HN parsed_1jaa 3
12 1 2 . . . . . . . . . 3 TRP HA parsed_1jaa 3
13 1 1 . . . . . . . . . 3 TRP HN parsed_1jaa 3
13 1 2 . . . . . . . . . 3 TRP QB parsed_1jaa 3
14 1 1 . . . . . . . . . 3 TRP HN parsed_1jaa 3
14 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 3
15 1 1 . . . . . . . . . 3 TRP HA parsed_1jaa 3
15 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 3
16 1 1 . . . . . . . . . 3 TRP QB parsed_1jaa 3
16 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 3
17 1 1 . . . . . . . . . 3 TRP HD1 parsed_1jaa 3
17 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 3
18 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jaa 3
18 1 2 . . . . . . . . . 4 GLY HN parsed_1jaa 3
19 1 1 . . . . . . . . . 4 GLY HN parsed_1jaa 3
19 1 2 . . . . . . . . . 4 GLY QA parsed_1jaa 3
20 1 1 . . . . . . . . . 4 GLY HN parsed_1jaa 3
20 1 2 . . . . . . . . . 5 DAP HN parsed_1jaa 3
21 1 1 . . . . . . . . . 4 GLY QA parsed_1jaa 3
21 1 2 . . . . . . . . . 5 DAP HN parsed_1jaa 3
22 1 1 . . . . . . . . . 5 DAP HN parsed_1jaa 3
22 1 2 . . . . . . . . . 5 DAP HA parsed_1jaa 3
23 1 1 . . . . . . . . . 5 DAP HN parsed_1jaa 3
23 1 2 . . . . . . . . . 5 DAP QB parsed_1jaa 3
24 1 1 . . . . . . . . . 5 DAP HA parsed_1jaa 3
24 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 3
25 1 1 . . . . . . . . . 5 DAP HA parsed_1jaa 3
25 1 2 . . . . . . . . . 6 SER HN parsed_1jaa 3
26 1 1 . . . . . . . . . 5 DAP QB parsed_1jaa 3
26 1 2 . . . . . . . . . 6 SER HN parsed_1jaa 3
27 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 3
27 1 2 . . . . . . . . . 6 SER HN parsed_1jaa 3
28 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 3
28 1 2 . . . . . . . . . 11 GLU HA parsed_1jaa 3
29 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 3
29 1 2 . . . . . . . . . 11 GLU QB parsed_1jaa 3
30 1 1 . . . . . . . . . 5 DAP HG parsed_1jaa 3
30 1 2 . . . . . . . . . 11 GLU QG parsed_1jaa 3
31 1 1 . . . . . . . . . 6 SER HN parsed_1jaa 3
31 1 2 . . . . . . . . . 6 SER HA parsed_1jaa 3
32 1 1 . . . . . . . . . 6 SER HN parsed_1jaa 3
32 1 2 . . . . . . . . . 7 GLY HN parsed_1jaa 3
33 1 1 . . . . . . . . . 6 SER HA parsed_1jaa 3
33 1 2 . . . . . . . . . 7 GLY HN parsed_1jaa 3
34 1 1 . . . . . . . . . 6 SER QB parsed_1jaa 3
34 1 2 . . . . . . . . . 7 GLY HN parsed_1jaa 3
35 1 1 . . . . . . . . . 7 GLY HN parsed_1jaa 3
35 1 2 . . . . . . . . . 7 GLY QA parsed_1jaa 3
36 1 1 . . . . . . . . . 7 GLY HN parsed_1jaa 3
36 1 2 . . . . . . . . . 8 LYS HN parsed_1jaa 3
37 1 1 . . . . . . . . . 7 GLY QA parsed_1jaa 3
37 1 2 . . . . . . . . . 8 LYS HN parsed_1jaa 3
38 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 3
38 1 2 . . . . . . . . . 8 LYS HA parsed_1jaa 3
39 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 3
39 1 2 . . . . . . . . . 8 LYS QB parsed_1jaa 3
40 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 3
40 1 2 . . . . . . . . . 8 LYS QG parsed_1jaa 3
41 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 3
41 1 2 . . . . . . . . . 8 LYS QD parsed_1jaa 3
42 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 3
42 1 2 . . . . . . . . . 8 LYS QE parsed_1jaa 3
43 1 1 . . . . . . . . . 8 LYS HN parsed_1jaa 3
43 1 2 . . . . . . . . . 9 LEU HN parsed_1jaa 3
44 1 1 . . . . . . . . . 8 LYS HA parsed_1jaa 3
44 1 2 . . . . . . . . . 9 LEU HN parsed_1jaa 3
45 1 1 . . . . . . . . . 8 LYS HA parsed_1jaa 3
45 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 3
46 1 1 . . . . . . . . . 8 LYS QB parsed_1jaa 3
46 1 2 . . . . . . . . . 9 LEU HN parsed_1jaa 3
47 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 3
47 1 2 . . . . . . . . . 9 LEU HA parsed_1jaa 3
48 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 3
48 1 2 . . . . . . . . . 9 LEU QB parsed_1jaa 3
49 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 3
49 1 2 . . . . . . . . . 9 LEU HG parsed_1jaa 3
50 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 3
50 1 2 . . . . . . . . . 9 LEU QQD parsed_1jaa 3
51 1 1 . . . . . . . . . 9 LEU HN parsed_1jaa 3
51 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 3
52 1 1 . . . . . . . . . 9 LEU QB parsed_1jaa 3
52 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 3
53 1 1 . . . . . . . . . 9 LEU HG parsed_1jaa 3
53 1 2 . . . . . . . . . 10 ILE HN parsed_1jaa 3
54 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 3
54 1 2 . . . . . . . . . 10 ILE HA parsed_1jaa 3
55 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 3
55 1 2 . . . . . . . . . 10 ILE HB parsed_1jaa 3
56 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 3
56 1 2 . . . . . . . . . 10 ILE QG1 parsed_1jaa 3
57 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 3
57 1 2 . . . . . . . . . 10 ILE QD1 parsed_1jaa 3
58 1 1 . . . . . . . . . 10 ILE HN parsed_1jaa 3
58 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 3
59 1 1 . . . . . . . . . 10 ILE HA parsed_1jaa 3
59 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 3
60 1 1 . . . . . . . . . 10 ILE QG2 parsed_1jaa 3
60 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 3
61 1 1 . . . . . . . . . 10 ILE QG1 parsed_1jaa 3
61 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 3
62 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jaa 3
62 1 2 . . . . . . . . . 11 GLU HN parsed_1jaa 3
63 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jaa 3
63 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 3
64 1 1 . . . . . . . . . 11 GLU HN parsed_1jaa 3
64 1 2 . . . . . . . . . 11 GLU HA parsed_1jaa 3
65 1 1 . . . . . . . . . 11 GLU HN parsed_1jaa 3
65 1 2 . . . . . . . . . 11 GLU QG parsed_1jaa 3
66 1 1 . . . . . . . . . 11 GLU HN parsed_1jaa 3
66 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 3
67 1 1 . . . . . . . . . 11 GLU HA parsed_1jaa 3
67 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 3
68 1 1 . . . . . . . . . 11 GLU QB parsed_1jaa 3
68 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 3
69 1 1 . . . . . . . . . 11 GLU QG parsed_1jaa 3
69 1 2 . . . . . . . . . 12 THR HN parsed_1jaa 3
70 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 3
70 1 2 . . . . . . . . . 12 THR HA parsed_1jaa 3
71 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 3
71 1 2 . . . . . . . . . 12 THR HB parsed_1jaa 3
72 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 3
72 1 2 . . . . . . . . . 12 THR QG2 parsed_1jaa 3
73 1 1 . . . . . . . . . 12 THR HN parsed_1jaa 3
73 1 2 . . . . . . . . . 13 THR HN parsed_1jaa 3
74 1 1 . . . . . . . . . 12 THR HA parsed_1jaa 3
74 1 2 . . . . . . . . . 13 THR HN parsed_1jaa 3
75 1 1 . . . . . . . . . 13 THR HN parsed_1jaa 3
75 1 2 . . . . . . . . . 13 THR HA parsed_1jaa 3
76 1 1 . . . . . . . . . 13 THR HN parsed_1jaa 3
76 1 2 . . . . . . . . . 13 THR HB parsed_1jaa 3
77 1 1 . . . . . . . . . 13 THR HN parsed_1jaa 3
77 1 2 . . . . . . . . . 13 THR QG2 parsed_1jaa 3
78 1 1 . . . . . . . . . 14 ALA HN parsed_1jaa 3
78 1 2 . . . . . . . . . 14 ALA HA parsed_1jaa 3
79 1 1 . . . . . . . . . 14 ALA HN parsed_1jaa 3
79 1 2 . . . . . . . . . 14 ALA QB parsed_1jaa 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_1jaa 3
2 1 . . . . . . 2.80 . parsed_1jaa 3
3 1 . . . . . . 3.80 . parsed_1jaa 3
4 1 . . . . . . 3.80 . parsed_1jaa 3
5 1 . . . . . . 4.80 . parsed_1jaa 3
6 1 . . . . . . 3.80 . parsed_1jaa 3
7 1 . . . . . . 1.80 . parsed_1jaa 3
8 1 . . . . . . 4.80 . parsed_1jaa 3
9 1 . . . . . . 3.80 . parsed_1jaa 3
10 1 . . . . . . 4.80 . parsed_1jaa 3
11 1 . . . . . . 4.80 . parsed_1jaa 3
12 1 . . . . . . 2.80 . parsed_1jaa 3
13 1 . . . . . . 2.84 . parsed_1jaa 3
14 1 . . . . . . 2.80 . parsed_1jaa 3
15 1 . . . . . . 2.20 . parsed_1jaa 3
16 1 . . . . . . 3.39 . parsed_1jaa 3
17 1 . . . . . . 4.80 . parsed_1jaa 3
18 1 . . . . . . 4.80 . parsed_1jaa 3
19 1 . . . . . . 2.53 . parsed_1jaa 3
20 1 . . . . . . 2.80 . parsed_1jaa 3
21 1 . . . . . . 2.45 . parsed_1jaa 3
22 1 . . . . . . 2.80 . parsed_1jaa 3
23 1 . . . . . . 2.80 . parsed_1jaa 3
24 1 . . . . . . 3.80 . parsed_1jaa 3
25 1 . . . . . . 2.20 . parsed_1jaa 3
26 1 . . . . . . 3.55 . parsed_1jaa 3
27 1 . . . . . . 3.80 . parsed_1jaa 3
28 1 . . . . . . 3.80 . parsed_1jaa 3
29 1 . . . . . . 1.80 . parsed_1jaa 3
30 1 . . . . . . 3.02 . parsed_1jaa 3
31 1 . . . . . . 2.80 . parsed_1jaa 3
32 1 . . . . . . 3.80 . parsed_1jaa 3
33 1 . . . . . . 2.20 . parsed_1jaa 3
34 1 . . . . . . 3.80 . parsed_1jaa 3
35 1 . . . . . . 2.20 . parsed_1jaa 3
36 1 . . . . . . 2.80 . parsed_1jaa 3
37 1 . . . . . . 2.80 . parsed_1jaa 3
38 1 . . . . . . 2.80 . parsed_1jaa 3
39 1 . . . . . . 1.80 . parsed_1jaa 3
40 1 . . . . . . 4.42 . parsed_1jaa 3
41 1 . . . . . . 3.80 . parsed_1jaa 3
42 1 . . . . . . 4.80 . parsed_1jaa 3
43 1 . . . . . . 2.80 . parsed_1jaa 3
44 1 . . . . . . 1.80 . parsed_1jaa 3
45 1 . . . . . . 3.80 . parsed_1jaa 3
46 1 . . . . . . 3.80 . parsed_1jaa 3
47 1 . . . . . . 2.80 . parsed_1jaa 3
48 1 . . . . . . 1.80 . parsed_1jaa 3
49 1 . . . . . . 2.80 . parsed_1jaa 3
50 1 . . . . . . 3.80 . parsed_1jaa 3
51 1 . . . . . . 1.80 . parsed_1jaa 3
52 1 . . . . . . 3.80 . parsed_1jaa 3
53 1 . . . . . . 3.80 . parsed_1jaa 3
54 1 . . . . . . 2.80 . parsed_1jaa 3
55 1 . . . . . . 2.80 . parsed_1jaa 3
56 1 . . . . . . 3.80 . parsed_1jaa 3
57 1 . . . . . . 4.80 . parsed_1jaa 3
58 1 . . . . . . 2.80 . parsed_1jaa 3
59 1 . . . . . . 1.80 . parsed_1jaa 3
60 1 . . . . . . 4.80 . parsed_1jaa 3
61 1 . . . . . . 4.80 . parsed_1jaa 3
62 1 . . . . . . 4.80 . parsed_1jaa 3
63 1 . . . . . . 4.80 . parsed_1jaa 3
64 1 . . . . . . 2.80 . parsed_1jaa 3
65 1 . . . . . . 3.36 . parsed_1jaa 3
66 1 . . . . . . 2.80 . parsed_1jaa 3
67 1 . . . . . . 2.80 . parsed_1jaa 3
68 1 . . . . . . 3.80 . parsed_1jaa 3
69 1 . . . . . . 3.80 . parsed_1jaa 3
70 1 . . . . . . 2.80 . parsed_1jaa 3
71 1 . . . . . . 2.80 . parsed_1jaa 3
72 1 . . . . . . 4.80 . parsed_1jaa 3
73 1 . . . . . . 2.80 . parsed_1jaa 3
74 1 . . . . . . 2.80 . parsed_1jaa 3
75 1 . . . . . . 2.80 . parsed_1jaa 3
76 1 . . . . . . 2.80 . parsed_1jaa 3
77 1 . . . . . . 3.80 . parsed_1jaa 3
78 1 . . . . . . 2.80 . parsed_1jaa 3
79 1 . . . . . . 1.80 . parsed_1jaa 3
stop_
save_
save_DYANA/DIANA_distance_constraints_7
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jaa
_Distance_constraint_list.ID 4
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 7
_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_1jaa 4
2 1 . . . parsed_1jaa 4
3 1 . . . parsed_1jaa 4
4 1 . . . parsed_1jaa 4
5 1 . . . parsed_1jaa 4
6 1 . . . parsed_1jaa 4
7 1 . . . parsed_1jaa 4
8 1 . . . parsed_1jaa 4
9 1 . . . parsed_1jaa 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 . . . . . . . . . 11 GLU CD parsed_1jaa 4
1 1 2 . . . . . . . . . 5 DAP NG parsed_1jaa 4
2 1 1 . . . . . . . . . 11 GLU OD1 parsed_1jaa 4
2 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 4
3 1 1 . . . . . . . . . 11 GLU CG parsed_1jaa 4
3 1 2 . . . . . . . . . 5 DAP NG parsed_1jaa 4
4 1 1 . . . . . . . . . 11 GLU OD1 parsed_1jaa 4
4 1 2 . . . . . . . . . 5 DAP NG parsed_1jaa 4
5 1 1 . . . . . . . . . 11 GLU CD parsed_1jaa 4
5 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 4
6 1 1 . . . . . . . . . 11 GLU CD parsed_1jaa 4
6 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 4
7 1 1 . . . . . . . . . 11 GLU CG parsed_1jaa 4
7 1 2 . . . . . . . . . 5 DAP HG parsed_1jaa 4
8 1 1 . . . . . . . . . 11 GLU OD1 parsed_1jaa 4
8 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 4
9 1 1 . . . . . . . . . 11 GLU CG parsed_1jaa 4
9 1 2 . . . . . . . . . 5 DAP CB parsed_1jaa 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 . . . . . . . 1.34 parsed_1jaa 4
2 1 . . . . . . . 3.17 parsed_1jaa 4
3 1 . . . . . . . 2.36 parsed_1jaa 4
4 1 . . . . . . . 2.24 parsed_1jaa 4
5 1 . . . . . . . 2.43 parsed_1jaa 4
6 1 . . . . . . . 2.06 parsed_1jaa 4
7 1 . . . . . . . 2.46 parsed_1jaa 4
8 1 . . . . . . . 2.71 parsed_1jaa 4
9 1 . . . . . . . 3.76 parsed_1jaa 4
stop_
save_
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