NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
37861 |
1qe7   |
4542 | cing | 2-parsed | STAR | entry | full | 273 |
data_1qe7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1qe7
_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_1qe7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1qe7
_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 1qe7 "Master copy" parsed_1qe7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1qe7
_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 1qe7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1qe7 1
1 1qe7.mr . . DISCOVER 2 distance NOE simple 54 parsed_1qe7 1
1 1qe7.mr . . DISCOVER 3 distance "hydrogen bond" simple 16 parsed_1qe7 1
1 1qe7.mr . . DISCOVER 4 distance NOE simple 139 parsed_1qe7 1
1 1qe7.mr . . DISCOVER 5 "dihedral angle" "Not applicable" "Not applicable" 64 parsed_1qe7 1
1 1qe7.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1qe7 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_1qe7
_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 DNA 13-JUL-99 1QE7
*TITLE SOLUTION STRUCTURE OF A URACIL CONTAINING HAIRPIN DNA
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: URACIL CONTAINING HAIRPIN 22-MER DNA;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: HAIRPIN DNA CONTAINING URACIL;
*COMPND 5 ENGINEERED: YES;
*COMPND 6 OTHER_DETAILS: BIOLOGICALLY RELEVANT SEQUENCE
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: CUSTOM MADE BY RANSOM HILL BIOSCIENCES,
*SOURCE 4 INC., RAMONA CA (USA)
*KEYWDS URACIL, HAIRPIN DNA, HAIRPIN LOOP, DOUBLE HELIX
*EXPDTA NMR, 10 STRUCTURES
*AUTHOR K.V.R.CHARY, M.GHOSH
*REVDAT 1 02-FEB-00 1QE7 0
!BIOSYM restraint 1
!
;
save_
save_Discover_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1qe7
_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_1qe7 1
2 1 . . . parsed_1qe7 1
3 1 . . . parsed_1qe7 1
4 1 . . . parsed_1qe7 1
5 1 . . . parsed_1qe7 1
6 1 . . . parsed_1qe7 1
7 1 . . . parsed_1qe7 1
8 1 . . . parsed_1qe7 1
9 1 . . . parsed_1qe7 1
10 1 . . . parsed_1qe7 1
11 1 . . . parsed_1qe7 1
12 1 . . . parsed_1qe7 1
13 1 . . . parsed_1qe7 1
14 1 . . . parsed_1qe7 1
15 1 . . . parsed_1qe7 1
16 1 . . . parsed_1qe7 1
17 1 . . . parsed_1qe7 1
18 1 . . . parsed_1qe7 1
19 1 . . . parsed_1qe7 1
20 1 . . . parsed_1qe7 1
21 1 . . . parsed_1qe7 1
22 1 . . . parsed_1qe7 1
23 1 . . . parsed_1qe7 1
24 1 . . . parsed_1qe7 1
25 1 . . . parsed_1qe7 1
26 1 . . . parsed_1qe7 1
27 1 . . . parsed_1qe7 1
28 1 . . . parsed_1qe7 1
29 1 . . . parsed_1qe7 1
30 1 . . . parsed_1qe7 1
31 1 . . . parsed_1qe7 1
32 1 . . . parsed_1qe7 1
33 1 . . . parsed_1qe7 1
34 1 . . . parsed_1qe7 1
35 1 . . . parsed_1qe7 1
36 1 . . . parsed_1qe7 1
37 1 . . . parsed_1qe7 1
38 1 . . . parsed_1qe7 1
39 1 . . . parsed_1qe7 1
40 1 . . . parsed_1qe7 1
41 1 . . . parsed_1qe7 1
42 1 . . . parsed_1qe7 1
43 1 . . . parsed_1qe7 1
44 1 . . . parsed_1qe7 1
45 1 . . . parsed_1qe7 1
46 1 . . . parsed_1qe7 1
47 1 . . . parsed_1qe7 1
48 1 . . . parsed_1qe7 1
49 1 . . . parsed_1qe7 1
50 1 . . . parsed_1qe7 1
51 1 . . . parsed_1qe7 1
52 1 . . . parsed_1qe7 1
53 1 . . . parsed_1qe7 1
54 1 . . . parsed_1qe7 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 13 T O3' parsed_1qe7 1
1 1 2 . . . . . . . . 1 14 T P parsed_1qe7 1
2 1 1 . . . . . . . . 1 14 T P parsed_1qe7 1
2 1 2 . . . . . . . . 1 14 T O5' parsed_1qe7 1
3 1 1 . . . . . . . . 1 7 G H8 parsed_1qe7 1
3 1 2 . . . . . . . . 1 7 G H1' parsed_1qe7 1
4 1 1 . . . . . . . . 1 8 A H8 parsed_1qe7 1
4 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 1
5 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 1
5 1 2 . . . . . . . . 1 9 T H1' parsed_1qe7 1
6 1 1 . . . . . . . . 1 11 C H6 parsed_1qe7 1
6 1 2 . . . . . . . . 1 11 C H1' parsed_1qe7 1
7 1 1 . . . . . . . . 1 12 T H6 parsed_1qe7 1
7 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 1
8 1 1 . . . . . . . . 1 13 T H6 parsed_1qe7 1
8 1 2 . . . . . . . . 1 13 T H1' parsed_1qe7 1
9 1 1 . . . . . . . . 1 14 T H6 parsed_1qe7 1
9 1 2 . . . . . . . . 1 14 T H1' parsed_1qe7 1
10 1 1 . . . . . . . . 1 15 U H6 parsed_1qe7 1
10 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 1
11 1 1 . . . . . . . . 1 16 G H8 parsed_1qe7 1
11 1 2 . . . . . . . . 1 16 G H1' parsed_1qe7 1
12 1 1 . . . . . . . . 1 17 G H8 parsed_1qe7 1
12 1 2 . . . . . . . . 1 17 G H1' parsed_1qe7 1
13 1 1 . . . . . . . . 1 18 A H8 parsed_1qe7 1
13 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 1
14 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 1
14 1 2 . . . . . . . . 1 19 T H1' parsed_1qe7 1
15 1 1 . . . . . . . . 1 22 T H6 parsed_1qe7 1
15 1 2 . . . . . . . . 1 22 T H1' parsed_1qe7 1
16 1 1 . . . . . . . . 1 22 T H2'1 parsed_1qe7 1
16 1 2 . . . . . . . . 1 22 T H6 parsed_1qe7 1
17 1 1 . . . . . . . . 1 21 C H2'1 parsed_1qe7 1
17 1 2 . . . . . . . . 1 21 C H6 parsed_1qe7 1
18 1 1 . . . . . . . . 1 19 T H2'1 parsed_1qe7 1
18 1 2 . . . . . . . . 1 19 T H6 parsed_1qe7 1
19 1 1 . . . . . . . . 1 18 A H2'1 parsed_1qe7 1
19 1 2 . . . . . . . . 1 18 A H8 parsed_1qe7 1
20 1 1 . . . . . . . . 1 17 G H2'1 parsed_1qe7 1
20 1 2 . . . . . . . . 1 17 G H8 parsed_1qe7 1
21 1 1 . . . . . . . . 1 16 G H2'1 parsed_1qe7 1
21 1 2 . . . . . . . . 1 16 G H8 parsed_1qe7 1
22 1 1 . . . . . . . . 1 15 U H2'1 parsed_1qe7 1
22 1 2 . . . . . . . . 1 15 U H6 parsed_1qe7 1
23 1 1 . . . . . . . . 1 14 T H2'1 parsed_1qe7 1
23 1 2 . . . . . . . . 1 14 T H6 parsed_1qe7 1
24 1 1 . . . . . . . . 1 13 T H2'1 parsed_1qe7 1
24 1 2 . . . . . . . . 1 13 T H6 parsed_1qe7 1
25 1 1 . . . . . . . . 1 12 T H2'1 parsed_1qe7 1
25 1 2 . . . . . . . . 1 12 T H6 parsed_1qe7 1
26 1 1 . . . . . . . . 1 9 T H2'1 parsed_1qe7 1
26 1 2 . . . . . . . . 1 9 T H6 parsed_1qe7 1
27 1 1 . . . . . . . . 1 8 A H2'1 parsed_1qe7 1
27 1 2 . . . . . . . . 1 8 A H8 parsed_1qe7 1
28 1 1 . . . . . . . . 1 7 G H2'1 parsed_1qe7 1
28 1 2 . . . . . . . . 1 7 G H8 parsed_1qe7 1
29 1 1 . . . . . . . . 1 6 G H2'1 parsed_1qe7 1
29 1 2 . . . . . . . . 1 6 G H8 parsed_1qe7 1
30 1 1 . . . . . . . . 1 5 A H2'1 parsed_1qe7 1
30 1 2 . . . . . . . . 1 5 A H8 parsed_1qe7 1
31 1 1 . . . . . . . . 1 5 A H2'2 parsed_1qe7 1
31 1 2 . . . . . . . . 1 5 A H8 parsed_1qe7 1
32 1 1 . . . . . . . . 1 6 G H2'2 parsed_1qe7 1
32 1 2 . . . . . . . . 1 6 G H8 parsed_1qe7 1
33 1 1 . . . . . . . . 1 7 G H2'2 parsed_1qe7 1
33 1 2 . . . . . . . . 1 7 G H8 parsed_1qe7 1
34 1 1 . . . . . . . . 1 8 A H2'2 parsed_1qe7 1
34 1 2 . . . . . . . . 1 8 A H8 parsed_1qe7 1
35 1 1 . . . . . . . . 1 9 T H2'2 parsed_1qe7 1
35 1 2 . . . . . . . . 1 9 T H6 parsed_1qe7 1
36 1 1 . . . . . . . . 1 12 T H2'2 parsed_1qe7 1
36 1 2 . . . . . . . . 1 12 T H6 parsed_1qe7 1
37 1 1 . . . . . . . . 1 13 T H2'2 parsed_1qe7 1
37 1 2 . . . . . . . . 1 13 T H6 parsed_1qe7 1
38 1 1 . . . . . . . . 1 14 T H2'2 parsed_1qe7 1
38 1 2 . . . . . . . . 1 14 T H6 parsed_1qe7 1
39 1 1 . . . . . . . . 1 15 U H2'2 parsed_1qe7 1
39 1 2 . . . . . . . . 1 15 U H6 parsed_1qe7 1
40 1 1 . . . . . . . . 1 16 G H2'2 parsed_1qe7 1
40 1 2 . . . . . . . . 1 16 G H8 parsed_1qe7 1
41 1 1 . . . . . . . . 1 17 G H2'2 parsed_1qe7 1
41 1 2 . . . . . . . . 1 17 G H8 parsed_1qe7 1
42 1 1 . . . . . . . . 1 18 A H2'2 parsed_1qe7 1
42 1 2 . . . . . . . . 1 18 A H8 parsed_1qe7 1
43 1 1 . . . . . . . . 1 19 T H2'2 parsed_1qe7 1
43 1 2 . . . . . . . . 1 19 T H6 parsed_1qe7 1
44 1 1 . . . . . . . . 1 22 T H2'2 parsed_1qe7 1
44 1 2 . . . . . . . . 1 22 T H6 parsed_1qe7 1
45 1 1 . . . . . . . . 1 8 A H8 parsed_1qe7 1
45 1 2 . . . . . . . . 1 8 A H3' parsed_1qe7 1
46 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 1
46 1 2 . . . . . . . . 1 9 T H3' parsed_1qe7 1
47 1 1 . . . . . . . . 1 12 T H6 parsed_1qe7 1
47 1 2 . . . . . . . . 1 12 T H3' parsed_1qe7 1
48 1 1 . . . . . . . . 1 14 T H6 parsed_1qe7 1
48 1 2 . . . . . . . . 1 14 T H3' parsed_1qe7 1
49 1 1 . . . . . . . . 1 15 U H6 parsed_1qe7 1
49 1 2 . . . . . . . . 1 15 U H3' parsed_1qe7 1
50 1 1 . . . . . . . . 1 16 G H8 parsed_1qe7 1
50 1 2 . . . . . . . . 1 16 G H3' parsed_1qe7 1
51 1 1 . . . . . . . . 1 17 G H8 parsed_1qe7 1
51 1 2 . . . . . . . . 1 17 G H3' parsed_1qe7 1
52 1 1 . . . . . . . . 1 18 A H8 parsed_1qe7 1
52 1 2 . . . . . . . . 1 18 A H3' parsed_1qe7 1
53 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 1
53 1 2 . . . . . . . . 1 19 T H3' parsed_1qe7 1
54 1 1 . . . . . . . . 1 22 T H6 parsed_1qe7 1
54 1 2 . . . . . . . . 1 22 T H3' parsed_1qe7 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 . . . . . . 1.600 1.640 parsed_1qe7 1
2 1 . . . . . . 1.560 1.620 parsed_1qe7 1
3 1 . . . . . . 4.000 5.000 parsed_1qe7 1
4 1 . . . . . . 3.500 4.500 parsed_1qe7 1
5 1 . . . . . . 3.300 4.300 parsed_1qe7 1
6 1 . . . . . . 2.000 5.000 parsed_1qe7 1
7 1 . . . . . . 3.200 4.200 parsed_1qe7 1
8 1 . . . . . . 3.500 4.500 parsed_1qe7 1
9 1 . . . . . . 2.800 3.800 parsed_1qe7 1
10 1 . . . . . . 3.400 4.400 parsed_1qe7 1
11 1 . . . . . . 3.800 4.800 parsed_1qe7 1
12 1 . . . . . . 3.800 4.800 parsed_1qe7 1
13 1 . . . . . . 3.500 4.500 parsed_1qe7 1
14 1 . . . . . . 3.600 4.600 parsed_1qe7 1
15 1 . . . . . . 3.200 4.200 parsed_1qe7 1
16 1 . . . . . . 2.800 3.800 parsed_1qe7 1
17 1 . . . . . . 2.000 5.000 parsed_1qe7 1
18 1 . . . . . . 2.900 3.900 parsed_1qe7 1
19 1 . . . . . . 2.900 3.900 parsed_1qe7 1
20 1 . . . . . . 3.000 4.000 parsed_1qe7 1
21 1 . . . . . . 3.200 4.200 parsed_1qe7 1
22 1 . . . . . . 3.000 4.000 parsed_1qe7 1
23 1 . . . . . . 3.000 4.010 parsed_1qe7 1
24 1 . . . . . . 2.600 3.600 parsed_1qe7 1
25 1 . . . . . . 3.000 4.000 parsed_1qe7 1
26 1 . . . . . . 3.000 4.000 parsed_1qe7 1
27 1 . . . . . . 3.000 4.000 parsed_1qe7 1
28 1 . . . . . . 3.100 4.110 parsed_1qe7 1
29 1 . . . . . . 3.100 4.100 parsed_1qe7 1
30 1 . . . . . . 4.000 5.000 parsed_1qe7 1
31 1 . . . . . . 4.300 5.300 parsed_1qe7 1
32 1 . . . . . . 2.700 3.700 parsed_1qe7 1
33 1 . . . . . . 2.750 3.700 parsed_1qe7 1
34 1 . . . . . . 2.300 3.300 parsed_1qe7 1
35 1 . . . . . . 2.350 3.350 parsed_1qe7 1
36 1 . . . . . . 2.200 3.200 parsed_1qe7 1
37 1 . . . . . . 2.100 3.100 parsed_1qe7 1
38 1 . . . . . . 2.400 3.400 parsed_1qe7 1
39 1 . . . . . . 2.580 3.580 parsed_1qe7 1
40 1 . . . . . . 2.400 3.400 parsed_1qe7 1
41 1 . . . . . . 2.200 3.200 parsed_1qe7 1
42 1 . . . . . . 2.200 3.200 parsed_1qe7 1
43 1 . . . . . . 2.200 3.200 parsed_1qe7 1
44 1 . . . . . . 2.300 3.300 parsed_1qe7 1
45 1 . . . . . . 3.200 4.200 parsed_1qe7 1
46 1 . . . . . . 3.300 4.300 parsed_1qe7 1
47 1 . . . . . . 3.100 4.100 parsed_1qe7 1
48 1 . . . . . . 3.100 4.130 parsed_1qe7 1
49 1 . . . . . . 2.000 5.000 parsed_1qe7 1
50 1 . . . . . . 3.500 4.500 parsed_1qe7 1
51 1 . . . . . . 3.500 4.500 parsed_1qe7 1
52 1 . . . . . . 3.200 4.200 parsed_1qe7 1
53 1 . . . . . . 3.500 4.500 parsed_1qe7 1
54 1 . . . . . . 3.000 4.000 parsed_1qe7 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 distance 1 1 1 9 parsed_1qe7 1
2 "THE H1'S" 4 1 4 9 parsed_1qe7 1
3 "THE H2''S" 18 1 18 10 parsed_1qe7 1
4 "THE H2'S" 34 1 34 9 parsed_1qe7 1
5 "THE H3'S" 49 1 49 9 parsed_1qe7 1
stop_
save_
save_Discover_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1qe7
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen 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_1qe7 2
2 1 . . . parsed_1qe7 2
3 1 . . . parsed_1qe7 2
4 1 . . . parsed_1qe7 2
5 1 . . . parsed_1qe7 2
6 1 . . . parsed_1qe7 2
7 1 . . . parsed_1qe7 2
8 1 . . . parsed_1qe7 2
9 1 . . . parsed_1qe7 2
10 1 . . . parsed_1qe7 2
11 1 . . . parsed_1qe7 2
12 1 . . . parsed_1qe7 2
13 1 . . . parsed_1qe7 2
14 1 . . . parsed_1qe7 2
15 1 . . . parsed_1qe7 2
16 1 . . . parsed_1qe7 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 11 C H42 parsed_1qe7 2
1 1 2 . . . . . . . . 1 16 G O6 parsed_1qe7 2
2 1 1 . . . . . . . . 1 11 C N3 parsed_1qe7 2
2 1 2 . . . . . . . . 1 16 G H1 parsed_1qe7 2
3 1 1 . . . . . . . . 1 11 C O2 parsed_1qe7 2
3 1 2 . . . . . . . . 1 16 G H22 parsed_1qe7 2
4 1 1 . . . . . . . . 1 10 C H42 parsed_1qe7 2
4 1 2 . . . . . . . . 1 17 G O6 parsed_1qe7 2
5 1 1 . . . . . . . . 1 10 C N3 parsed_1qe7 2
5 1 2 . . . . . . . . 1 17 G H1 parsed_1qe7 2
6 1 1 . . . . . . . . 1 10 C O2 parsed_1qe7 2
6 1 2 . . . . . . . . 1 17 G H22 parsed_1qe7 2
7 1 1 . . . . . . . . 1 9 T O4 parsed_1qe7 2
7 1 2 . . . . . . . . 1 18 A H61 parsed_1qe7 2
8 1 1 . . . . . . . . 1 9 T H3 parsed_1qe7 2
8 1 2 . . . . . . . . 1 18 A N1 parsed_1qe7 2
9 1 1 . . . . . . . . 1 8 A H61 parsed_1qe7 2
9 1 2 . . . . . . . . 1 19 T O4 parsed_1qe7 2
10 1 1 . . . . . . . . 1 8 A N1 parsed_1qe7 2
10 1 2 . . . . . . . . 1 19 T H3 parsed_1qe7 2
11 1 1 . . . . . . . . 1 7 G O6 parsed_1qe7 2
11 1 2 . . . . . . . . 1 20 C H42 parsed_1qe7 2
12 1 1 . . . . . . . . 1 7 G H1 parsed_1qe7 2
12 1 2 . . . . . . . . 1 20 C N3 parsed_1qe7 2
13 1 1 . . . . . . . . 1 7 G H22 parsed_1qe7 2
13 1 2 . . . . . . . . 1 20 C O2 parsed_1qe7 2
14 1 1 . . . . . . . . 1 6 G O6 parsed_1qe7 2
14 1 2 . . . . . . . . 1 21 C H42 parsed_1qe7 2
15 1 1 . . . . . . . . 1 6 G H1 parsed_1qe7 2
15 1 2 . . . . . . . . 1 21 C N3 parsed_1qe7 2
16 1 1 . . . . . . . . 1 6 G H22 parsed_1qe7 2
16 1 2 . . . . . . . . 1 21 C O2 parsed_1qe7 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 . . . . . . 1.700 2.000 parsed_1qe7 2
2 1 . . . . . . 1.700 2.000 parsed_1qe7 2
3 1 . . . . . . 1.700 2.000 parsed_1qe7 2
4 1 . . . . . . 1.700 2.000 parsed_1qe7 2
5 1 . . . . . . 1.700 2.000 parsed_1qe7 2
6 1 . . . . . . 1.700 2.000 parsed_1qe7 2
7 1 . . . . . . 1.700 2.000 parsed_1qe7 2
8 1 . . . . . . 1.700 2.000 parsed_1qe7 2
9 1 . . . . . . 1.700 2.000 parsed_1qe7 2
10 1 . . . . . . 1.700 2.000 parsed_1qe7 2
11 1 . . . . . . 1.700 2.000 parsed_1qe7 2
12 1 . . . . . . 1.700 2.000 parsed_1qe7 2
13 1 . . . . . . 1.700 2.000 parsed_1qe7 2
14 1 . . . . . . 1.700 2.000 parsed_1qe7 2
15 1 . . . . . . 1.700 2.000 parsed_1qe7 2
16 1 . . . . . . 1.700 2.000 parsed_1qe7 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 "THE HYDROGEN-BOND CONSTRAINTS" 1 1 1 30 parsed_1qe7 2
stop_
save_
save_Discover_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1qe7
_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_1qe7 3
2 1 . . . parsed_1qe7 3
3 1 . . . parsed_1qe7 3
4 1 . . . parsed_1qe7 3
5 1 . . . parsed_1qe7 3
6 1 . . . parsed_1qe7 3
7 1 . . . parsed_1qe7 3
8 1 . . . parsed_1qe7 3
9 1 . . . parsed_1qe7 3
10 1 . . . parsed_1qe7 3
11 1 . . . parsed_1qe7 3
12 1 . . . parsed_1qe7 3
13 1 . . . parsed_1qe7 3
14 1 . . . parsed_1qe7 3
15 1 . . . parsed_1qe7 3
16 1 . . . parsed_1qe7 3
17 1 . . . parsed_1qe7 3
18 1 . . . parsed_1qe7 3
19 1 . . . parsed_1qe7 3
20 1 . . . parsed_1qe7 3
21 1 . . . parsed_1qe7 3
22 1 . . . parsed_1qe7 3
23 1 . . . parsed_1qe7 3
24 1 . . . parsed_1qe7 3
25 1 . . . parsed_1qe7 3
26 1 . . . parsed_1qe7 3
27 1 . . . parsed_1qe7 3
28 1 . . . parsed_1qe7 3
29 1 . . . parsed_1qe7 3
30 1 . . . parsed_1qe7 3
31 1 . . . parsed_1qe7 3
32 1 . . . parsed_1qe7 3
33 1 . . . parsed_1qe7 3
34 1 . . . parsed_1qe7 3
35 1 . . . parsed_1qe7 3
36 1 . . . parsed_1qe7 3
37 1 . . . parsed_1qe7 3
38 1 . . . parsed_1qe7 3
39 1 . . . parsed_1qe7 3
40 1 . . . parsed_1qe7 3
41 1 . . . parsed_1qe7 3
42 1 . . . parsed_1qe7 3
43 1 . . . parsed_1qe7 3
44 1 . . . parsed_1qe7 3
45 1 . . . parsed_1qe7 3
46 1 . . . parsed_1qe7 3
47 1 . . . parsed_1qe7 3
48 1 . . . parsed_1qe7 3
49 1 . . . parsed_1qe7 3
50 1 . . . parsed_1qe7 3
51 1 . . . parsed_1qe7 3
52 1 . . . parsed_1qe7 3
53 1 . . . parsed_1qe7 3
54 1 . . . parsed_1qe7 3
55 1 . . . parsed_1qe7 3
56 1 . . . parsed_1qe7 3
57 1 . . . parsed_1qe7 3
58 1 . . . parsed_1qe7 3
59 1 . . . parsed_1qe7 3
60 1 . . . parsed_1qe7 3
61 1 . . . parsed_1qe7 3
62 1 . . . parsed_1qe7 3
63 1 . . . parsed_1qe7 3
64 1 . . . parsed_1qe7 3
65 1 . . . parsed_1qe7 3
66 1 . . . parsed_1qe7 3
67 1 . . . parsed_1qe7 3
68 1 . . . parsed_1qe7 3
69 1 . . . parsed_1qe7 3
70 1 . . . parsed_1qe7 3
71 1 . . . parsed_1qe7 3
72 1 . . . parsed_1qe7 3
73 1 . . . parsed_1qe7 3
74 1 . . . parsed_1qe7 3
75 1 . . . parsed_1qe7 3
76 1 . . . parsed_1qe7 3
77 1 . . . parsed_1qe7 3
78 1 . . . parsed_1qe7 3
79 1 . . . parsed_1qe7 3
80 1 . . . parsed_1qe7 3
81 1 . . . parsed_1qe7 3
82 1 . . . parsed_1qe7 3
83 1 . . . parsed_1qe7 3
84 1 . . . parsed_1qe7 3
85 1 . . . parsed_1qe7 3
86 1 . . . parsed_1qe7 3
87 1 . . . parsed_1qe7 3
88 1 . . . parsed_1qe7 3
89 1 . . . parsed_1qe7 3
90 1 . . . parsed_1qe7 3
91 1 . . . parsed_1qe7 3
92 1 . . . parsed_1qe7 3
93 1 . . . parsed_1qe7 3
94 1 . . . parsed_1qe7 3
95 1 . . . parsed_1qe7 3
96 1 . . . parsed_1qe7 3
97 1 . . . parsed_1qe7 3
98 1 . . . parsed_1qe7 3
99 1 . . . parsed_1qe7 3
100 1 . . . parsed_1qe7 3
101 1 . . . parsed_1qe7 3
102 1 . . . parsed_1qe7 3
103 1 . . . parsed_1qe7 3
104 1 . . . parsed_1qe7 3
105 1 . . . parsed_1qe7 3
106 1 . . . parsed_1qe7 3
107 1 . . . parsed_1qe7 3
108 1 . . . parsed_1qe7 3
109 1 . . . parsed_1qe7 3
110 1 . . . parsed_1qe7 3
111 1 . . . parsed_1qe7 3
112 1 . . . parsed_1qe7 3
113 1 . . . parsed_1qe7 3
114 1 . . . parsed_1qe7 3
115 1 . . . parsed_1qe7 3
116 1 . . . parsed_1qe7 3
117 1 . . . parsed_1qe7 3
118 1 . . . parsed_1qe7 3
119 1 . . . parsed_1qe7 3
120 1 . . . parsed_1qe7 3
121 1 . . . parsed_1qe7 3
122 1 . . . parsed_1qe7 3
123 1 . . . parsed_1qe7 3
124 1 . . . parsed_1qe7 3
125 1 . . . parsed_1qe7 3
126 1 . . . parsed_1qe7 3
127 1 . . . parsed_1qe7 3
128 1 . . . parsed_1qe7 3
129 1 . . . parsed_1qe7 3
130 1 . . . parsed_1qe7 3
131 1 . . . parsed_1qe7 3
132 1 . . . parsed_1qe7 3
133 1 . . . parsed_1qe7 3
134 1 . . . parsed_1qe7 3
135 1 . . . parsed_1qe7 3
136 1 . . . parsed_1qe7 3
137 1 . . . parsed_1qe7 3
138 1 . . . parsed_1qe7 3
139 1 . . . parsed_1qe7 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 . . . . . . . . 1 22 T H3' parsed_1qe7 3
1 1 2 . . . . . . . . 1 22 T H1' parsed_1qe7 3
2 1 1 . . . . . . . . 1 21 C H4' parsed_1qe7 3
2 1 2 . . . . . . . . 1 21 C H1' parsed_1qe7 3
3 1 1 . . . . . . . . 1 20 C H2'1 parsed_1qe7 3
3 1 2 . . . . . . . . 1 20 C H1' parsed_1qe7 3
4 1 1 . . . . . . . . 1 19 T H2'2 parsed_1qe7 3
4 1 2 . . . . . . . . 1 19 T H1' parsed_1qe7 3
5 1 1 . . . . . . . . 1 18 A H2'1 parsed_1qe7 3
5 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 3
6 1 1 . . . . . . . . 1 18 A H2'2 parsed_1qe7 3
6 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 3
7 1 1 . . . . . . . . 1 18 A H3' parsed_1qe7 3
7 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 3
8 1 1 . . . . . . . . 1 18 A H4' parsed_1qe7 3
8 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 3
9 1 1 . . . . . . . . 1 17 G H2'2 parsed_1qe7 3
9 1 2 . . . . . . . . 1 17 G H1' parsed_1qe7 3
10 1 1 . . . . . . . . 1 17 G H2'1 parsed_1qe7 3
10 1 2 . . . . . . . . 1 17 G H1' parsed_1qe7 3
11 1 1 . . . . . . . . 1 17 G H3' parsed_1qe7 3
11 1 2 . . . . . . . . 1 17 G H1' parsed_1qe7 3
12 1 1 . . . . . . . . 1 17 G H4' parsed_1qe7 3
12 1 2 . . . . . . . . 1 17 G H1' parsed_1qe7 3
13 1 1 . . . . . . . . 1 16 G H2'1 parsed_1qe7 3
13 1 2 . . . . . . . . 1 16 G H1' parsed_1qe7 3
14 1 1 . . . . . . . . 1 16 G H2'2 parsed_1qe7 3
14 1 2 . . . . . . . . 1 16 G H1' parsed_1qe7 3
15 1 1 . . . . . . . . 1 16 G H3' parsed_1qe7 3
15 1 2 . . . . . . . . 1 16 G H1' parsed_1qe7 3
16 1 1 . . . . . . . . 1 16 G H4' parsed_1qe7 3
16 1 2 . . . . . . . . 1 16 G H1' parsed_1qe7 3
17 1 1 . . . . . . . . 1 15 U H2'1 parsed_1qe7 3
17 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 3
18 1 1 . . . . . . . . 1 15 U H2'2 parsed_1qe7 3
18 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 3
19 1 1 . . . . . . . . 1 15 U H3' parsed_1qe7 3
19 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 3
20 1 1 . . . . . . . . 1 15 U H4' parsed_1qe7 3
20 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 3
21 1 1 . . . . . . . . 1 14 T H3' parsed_1qe7 3
21 1 2 . . . . . . . . 1 14 T H1' parsed_1qe7 3
22 1 1 . . . . . . . . 1 14 T H4' parsed_1qe7 3
22 1 2 . . . . . . . . 1 14 T H1' parsed_1qe7 3
23 1 1 . . . . . . . . 1 12 T H2'1 parsed_1qe7 3
23 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
24 1 1 . . . . . . . . 1 12 T H2'2 parsed_1qe7 3
24 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
25 1 1 . . . . . . . . 1 12 T H3' parsed_1qe7 3
25 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
26 1 1 . . . . . . . . 1 12 T H3' parsed_1qe7 3
26 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
27 1 1 . . . . . . . . 1 13 T H2'1 parsed_1qe7 3
27 1 2 . . . . . . . . 1 13 T H1' parsed_1qe7 3
28 1 1 . . . . . . . . 1 13 T H2'2 parsed_1qe7 3
28 1 2 . . . . . . . . 1 13 T H1' parsed_1qe7 3
29 1 1 . . . . . . . . 1 13 T H3' parsed_1qe7 3
29 1 2 . . . . . . . . 1 13 T H1' parsed_1qe7 3
30 1 1 . . . . . . . . 1 13 T H4' parsed_1qe7 3
30 1 2 . . . . . . . . 1 13 T H1' parsed_1qe7 3
31 1 1 . . . . . . . . 1 11 C H2'1 parsed_1qe7 3
31 1 2 . . . . . . . . 1 11 C H1' parsed_1qe7 3
32 1 1 . . . . . . . . 1 11 C H2'2 parsed_1qe7 3
32 1 2 . . . . . . . . 1 11 C H1' parsed_1qe7 3
33 1 1 . . . . . . . . 1 11 C H3' parsed_1qe7 3
33 1 2 . . . . . . . . 1 11 C H1' parsed_1qe7 3
34 1 1 . . . . . . . . 1 11 C H4' parsed_1qe7 3
34 1 2 . . . . . . . . 1 11 C H1' parsed_1qe7 3
35 1 1 . . . . . . . . 1 10 C H3' parsed_1qe7 3
35 1 2 . . . . . . . . 1 10 C H1' parsed_1qe7 3
36 1 1 . . . . . . . . 1 8 A H2'1 parsed_1qe7 3
36 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 3
37 1 1 . . . . . . . . 1 8 A H2'2 parsed_1qe7 3
37 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 3
38 1 1 . . . . . . . . 1 8 A H3' parsed_1qe7 3
38 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 3
39 1 1 . . . . . . . . 1 8 A H4' parsed_1qe7 3
39 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 3
40 1 1 . . . . . . . . 1 7 G H2'1 parsed_1qe7 3
40 1 2 . . . . . . . . 1 7 G H1' parsed_1qe7 3
41 1 1 . . . . . . . . 1 7 G H2'2 parsed_1qe7 3
41 1 2 . . . . . . . . 1 7 G H1' parsed_1qe7 3
42 1 1 . . . . . . . . 1 7 G H3' parsed_1qe7 3
42 1 2 . . . . . . . . 1 7 G H1' parsed_1qe7 3
43 1 1 . . . . . . . . 1 7 G H4' parsed_1qe7 3
43 1 2 . . . . . . . . 1 7 G H1' parsed_1qe7 3
44 1 1 . . . . . . . . 1 6 G H3' parsed_1qe7 3
44 1 2 . . . . . . . . 1 6 G H1' parsed_1qe7 3
45 1 1 . . . . . . . . 1 6 G H4' parsed_1qe7 3
45 1 2 . . . . . . . . 1 6 G H1' parsed_1qe7 3
46 1 1 . . . . . . . . 1 5 A H2'1 parsed_1qe7 3
46 1 2 . . . . . . . . 1 5 A H1' parsed_1qe7 3
47 1 1 . . . . . . . . 1 5 A H2'2 parsed_1qe7 3
47 1 2 . . . . . . . . 1 5 A H1' parsed_1qe7 3
48 1 1 . . . . . . . . 1 5 A H3' parsed_1qe7 3
48 1 2 . . . . . . . . 1 5 A H1' parsed_1qe7 3
49 1 1 . . . . . . . . 1 5 A H4' parsed_1qe7 3
49 1 2 . . . . . . . . 1 5 A H1' parsed_1qe7 3
50 1 1 . . . . . . . . 1 6 G H8 parsed_1qe7 3
50 1 2 . . . . . . . . 1 5 A H2'1 parsed_1qe7 3
51 1 1 . . . . . . . . 1 6 G H8 parsed_1qe7 3
51 1 2 . . . . . . . . 1 5 A H3' parsed_1qe7 3
52 1 1 . . . . . . . . 1 7 G H8 parsed_1qe7 3
52 1 2 . . . . . . . . 1 6 G H1' parsed_1qe7 3
53 1 1 . . . . . . . . 1 7 G H8 parsed_1qe7 3
53 1 2 . . . . . . . . 1 6 G H2'2 parsed_1qe7 3
54 1 1 . . . . . . . . 1 8 A H8 parsed_1qe7 3
54 1 2 . . . . . . . . 1 7 G H1' parsed_1qe7 3
55 1 1 . . . . . . . . 1 8 A H8 parsed_1qe7 3
55 1 2 . . . . . . . . 1 7 G H2'1 parsed_1qe7 3
56 1 1 . . . . . . . . 1 8 A H8 parsed_1qe7 3
56 1 2 . . . . . . . . 1 7 G H2'2 parsed_1qe7 3
57 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 3
57 1 2 . . . . . . . . 1 8 A H8 parsed_1qe7 3
58 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 3
58 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 3
59 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 3
59 1 2 . . . . . . . . 1 8 A H2'1 parsed_1qe7 3
60 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 3
60 1 2 . . . . . . . . 1 8 A H2'2 parsed_1qe7 3
61 1 1 . . . . . . . . 1 9 T H6 parsed_1qe7 3
61 1 2 . . . . . . . . 1 8 A H3' parsed_1qe7 3
62 1 1 . . . . . . . . 1 9 T H5M2 parsed_1qe7 3
62 1 2 . . . . . . . . 1 8 A H8 parsed_1qe7 3
63 1 1 . . . . . . . . 1 9 T H5M2 parsed_1qe7 3
63 1 2 . . . . . . . . 1 8 A H1' parsed_1qe7 3
64 1 1 . . . . . . . . 1 9 T H5M2 parsed_1qe7 3
64 1 2 . . . . . . . . 1 8 A H2'1 parsed_1qe7 3
65 1 1 . . . . . . . . 1 10 C H6 parsed_1qe7 3
65 1 2 . . . . . . . . 1 9 T H6 parsed_1qe7 3
66 1 1 . . . . . . . . 1 10 C H5 parsed_1qe7 3
66 1 2 . . . . . . . . 1 9 T H5M3 parsed_1qe7 3
67 1 1 . . . . . . . . 1 10 C H5 parsed_1qe7 3
67 1 2 . . . . . . . . 1 9 T H1' parsed_1qe7 3
68 1 1 . . . . . . . . 1 10 C H5 parsed_1qe7 3
68 1 2 . . . . . . . . 1 9 T H3' parsed_1qe7 3
69 1 1 . . . . . . . . 1 10 C H5 parsed_1qe7 3
69 1 2 . . . . . . . . 1 9 T H4' parsed_1qe7 3
70 1 1 . . . . . . . . 1 11 C H5 parsed_1qe7 3
70 1 2 . . . . . . . . 1 11 C H2'1 parsed_1qe7 3
71 1 1 . . . . . . . . 1 11 C H5 parsed_1qe7 3
71 1 2 . . . . . . . . 1 11 C H2'2 parsed_1qe7 3
72 1 1 . . . . . . . . 1 11 C H5 parsed_1qe7 3
72 1 2 . . . . . . . . 1 10 C H1' parsed_1qe7 3
73 1 1 . . . . . . . . 1 12 T H6 parsed_1qe7 3
73 1 2 . . . . . . . . 1 11 C H1' parsed_1qe7 3
74 1 1 . . . . . . . . 1 12 T H6 parsed_1qe7 3
74 1 2 . . . . . . . . 1 11 C H2'1 parsed_1qe7 3
75 1 1 . . . . . . . . 1 12 T H6 parsed_1qe7 3
75 1 2 . . . . . . . . 1 11 C H2'2 parsed_1qe7 3
76 1 1 . . . . . . . . 1 12 T H5M2 parsed_1qe7 3
76 1 2 . . . . . . . . 1 11 C H6 parsed_1qe7 3
77 1 1 . . . . . . . . 1 12 T H5M2 parsed_1qe7 3
77 1 2 . . . . . . . . 1 11 C H5 parsed_1qe7 3
78 1 1 . . . . . . . . 1 13 T H6 parsed_1qe7 3
78 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
79 1 1 . . . . . . . . 1 13 T H6 parsed_1qe7 3
79 1 2 . . . . . . . . 1 12 T H3' parsed_1qe7 3
80 1 1 . . . . . . . . 1 13 T H5M2 parsed_1qe7 3
80 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
81 1 1 . . . . . . . . 1 13 T H6 parsed_1qe7 3
81 1 2 . . . . . . . . 1 12 T H2'2 parsed_1qe7 3
82 1 1 . . . . . . . . 1 13 T H6 parsed_1qe7 3
82 1 2 . . . . . . . . 1 12 T H2'1 parsed_1qe7 3
83 1 1 . . . . . . . . 1 14 T H6 parsed_1qe7 3
83 1 2 . . . . . . . . 1 13 T H1' parsed_1qe7 3
84 1 1 . . . . . . . . 1 14 T H6 parsed_1qe7 3
84 1 2 . . . . . . . . 1 13 T H2'2 parsed_1qe7 3
85 1 1 . . . . . . . . 1 14 T H6 parsed_1qe7 3
85 1 2 . . . . . . . . 1 13 T H2'1 parsed_1qe7 3
86 1 1 . . . . . . . . 1 14 T H5M2 parsed_1qe7 3
86 1 2 . . . . . . . . 1 13 T H6 parsed_1qe7 3
87 1 1 . . . . . . . . 1 14 T H5M2 parsed_1qe7 3
87 1 2 . . . . . . . . 1 12 T H1' parsed_1qe7 3
88 1 1 . . . . . . . . 1 14 T H5M2 parsed_1qe7 3
88 1 2 . . . . . . . . 1 12 T H6 parsed_1qe7 3
89 1 1 . . . . . . . . 1 14 T H5M2 parsed_1qe7 3
89 1 2 . . . . . . . . 1 12 T H2'2 parsed_1qe7 3
90 1 1 . . . . . . . . 1 14 T H5M2 parsed_1qe7 3
90 1 2 . . . . . . . . 1 12 T H2'1 parsed_1qe7 3
91 1 1 . . . . . . . . 1 14 T H5M2 parsed_1qe7 3
91 1 2 . . . . . . . . 1 12 T H5M2 parsed_1qe7 3
92 1 1 . . . . . . . . 1 15 U H6 parsed_1qe7 3
92 1 2 . . . . . . . . 1 14 T H1' parsed_1qe7 3
93 1 1 . . . . . . . . 1 15 U H5 parsed_1qe7 3
93 1 2 . . . . . . . . 1 14 T H1' parsed_1qe7 3
94 1 1 . . . . . . . . 1 15 U H5 parsed_1qe7 3
94 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 3
95 1 1 . . . . . . . . 1 15 U H5 parsed_1qe7 3
95 1 2 . . . . . . . . 1 15 U H3' parsed_1qe7 3
96 1 1 . . . . . . . . 1 15 U H5 parsed_1qe7 3
96 1 2 . . . . . . . . 1 15 U H4' parsed_1qe7 3
97 1 1 . . . . . . . . 1 16 G H8 parsed_1qe7 3
97 1 2 . . . . . . . . 1 15 U H1' parsed_1qe7 3
98 1 1 . . . . . . . . 1 16 G H8 parsed_1qe7 3
98 1 2 . . . . . . . . 1 15 U H2'1 parsed_1qe7 3
99 1 1 . . . . . . . . 1 16 G H8 parsed_1qe7 3
99 1 2 . . . . . . . . 1 15 U H2'2 parsed_1qe7 3
100 1 1 . . . . . . . . 1 17 G H8 parsed_1qe7 3
100 1 2 . . . . . . . . 1 16 G H1' parsed_1qe7 3
101 1 1 . . . . . . . . 1 17 G H8 parsed_1qe7 3
101 1 2 . . . . . . . . 1 16 G H3' parsed_1qe7 3
102 1 1 . . . . . . . . 1 18 A H8 parsed_1qe7 3
102 1 2 . . . . . . . . 1 17 G H8 parsed_1qe7 3
103 1 1 . . . . . . . . 1 18 A H8 parsed_1qe7 3
103 1 2 . . . . . . . . 1 17 G H1' parsed_1qe7 3
104 1 1 . . . . . . . . 1 18 A H8 parsed_1qe7 3
104 1 2 . . . . . . . . 1 17 G H2'1 parsed_1qe7 3
105 1 1 . . . . . . . . 1 18 A H8 parsed_1qe7 3
105 1 2 . . . . . . . . 1 17 G H2'2 parsed_1qe7 3
106 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 3
106 1 2 . . . . . . . . 1 18 A H8 parsed_1qe7 3
107 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 3
107 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 3
108 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 3
108 1 2 . . . . . . . . 1 18 A H2'1 parsed_1qe7 3
109 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 3
109 1 2 . . . . . . . . 1 18 A H2'2 parsed_1qe7 3
110 1 1 . . . . . . . . 1 19 T H6 parsed_1qe7 3
110 1 2 . . . . . . . . 1 18 A H3' parsed_1qe7 3
111 1 1 . . . . . . . . 1 19 T H5M2 parsed_1qe7 3
111 1 2 . . . . . . . . 1 18 A H1' parsed_1qe7 3
112 1 1 . . . . . . . . 1 19 T H5M2 parsed_1qe7 3
112 1 2 . . . . . . . . 1 18 A H2'1 parsed_1qe7 3
113 1 1 . . . . . . . . 1 19 T H5M2 parsed_1qe7 3
113 1 2 . . . . . . . . 1 18 A H8 parsed_1qe7 3
114 1 1 . . . . . . . . 1 20 C H6 parsed_1qe7 3
114 1 2 . . . . . . . . 1 19 T H6 parsed_1qe7 3
115 1 1 . . . . . . . . 1 20 C H5 parsed_1qe7 3
115 1 2 . . . . . . . . 1 19 T H5M1 parsed_1qe7 3
116 1 1 . . . . . . . . 1 20 C H5 parsed_1qe7 3
116 1 2 . . . . . . . . 1 19 T H1' parsed_1qe7 3
117 1 1 . . . . . . . . 1 20 C H5 parsed_1qe7 3
117 1 2 . . . . . . . . 1 19 T H2'1 parsed_1qe7 3
118 1 1 . . . . . . . . 1 20 C H5 parsed_1qe7 3
118 1 2 . . . . . . . . 1 19 T H2'2 parsed_1qe7 3
119 1 1 . . . . . . . . 1 20 C H5 parsed_1qe7 3
119 1 2 . . . . . . . . 1 20 C H2'2 parsed_1qe7 3
120 1 1 . . . . . . . . 1 20 C H5 parsed_1qe7 3
120 1 2 . . . . . . . . 1 19 T H6 parsed_1qe7 3
121 1 1 . . . . . . . . 1 21 C H5 parsed_1qe7 3
121 1 2 . . . . . . . . 1 20 C H1' parsed_1qe7 3
122 1 1 . . . . . . . . 1 22 T H6 parsed_1qe7 3
122 1 2 . . . . . . . . 1 21 C H1' parsed_1qe7 3
123 1 1 . . . . . . . . 1 22 T H6 parsed_1qe7 3
123 1 2 . . . . . . . . 1 21 C H2'1 parsed_1qe7 3
124 1 1 . . . . . . . . 1 22 T H6 parsed_1qe7 3
124 1 2 . . . . . . . . 1 21 C H2'2 parsed_1qe7 3
125 1 1 . . . . . . . . 1 22 T H6 parsed_1qe7 3
125 1 2 . . . . . . . . 1 21 C H3' parsed_1qe7 3
126 1 1 . . . . . . . . 1 22 T H5M2 parsed_1qe7 3
126 1 2 . . . . . . . . 1 21 C H5 parsed_1qe7 3
127 1 1 . . . . . . . . 1 22 T H5M2 parsed_1qe7 3
127 1 2 . . . . . . . . 1 21 C H6 parsed_1qe7 3
128 1 1 . . . . . . . . 1 22 T H5M2 parsed_1qe7 3
128 1 2 . . . . . . . . 1 21 C H2'2 parsed_1qe7 3
129 1 1 . . . . . . . . 1 22 T H5M2 parsed_1qe7 3
129 1 2 . . . . . . . . 1 21 C H2'1 parsed_1qe7 3
130 1 1 . . . . . . . . 1 8 A H2 parsed_1qe7 3
130 1 2 . . . . . . . . 1 19 T H3 parsed_1qe7 3
131 1 1 . . . . . . . . 1 9 T H3 parsed_1qe7 3
131 1 2 . . . . . . . . 1 18 A H2 parsed_1qe7 3
132 1 1 . . . . . . . . 1 6 G H1 parsed_1qe7 3
132 1 2 . . . . . . . . 1 21 C H41 parsed_1qe7 3
133 1 1 . . . . . . . . 1 6 G H1 parsed_1qe7 3
133 1 2 . . . . . . . . 1 21 C H42 parsed_1qe7 3
134 1 1 . . . . . . . . 1 7 G H1 parsed_1qe7 3
134 1 2 . . . . . . . . 1 20 C H41 parsed_1qe7 3
135 1 1 . . . . . . . . 1 7 G H1 parsed_1qe7 3
135 1 2 . . . . . . . . 1 20 C H42 parsed_1qe7 3
136 1 1 . . . . . . . . 1 10 C H41 parsed_1qe7 3
136 1 2 . . . . . . . . 1 17 G H1 parsed_1qe7 3
137 1 1 . . . . . . . . 1 10 C H42 parsed_1qe7 3
137 1 2 . . . . . . . . 1 17 G H1 parsed_1qe7 3
138 1 1 . . . . . . . . 1 11 C H41 parsed_1qe7 3
138 1 2 . . . . . . . . 1 16 G H1 parsed_1qe7 3
139 1 1 . . . . . . . . 1 11 C H42 parsed_1qe7 3
139 1 2 . . . . . . . . 1 16 G H1 parsed_1qe7 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 . . . . . . 2.900 3.900 parsed_1qe7 3
2 1 . . . . . . 2.500 3.500 parsed_1qe7 3
3 1 . . . . . . 2.200 3.200 parsed_1qe7 3
4 1 . . . . . . 2.000 3.000 parsed_1qe7 3
5 1 . . . . . . 2.100 3.100 parsed_1qe7 3
6 1 . . . . . . 2.100 3.100 parsed_1qe7 3
7 1 . . . . . . 3.000 4.000 parsed_1qe7 3
8 1 . . . . . . 2.300 3.300 parsed_1qe7 3
9 1 . . . . . . 2.100 3.100 parsed_1qe7 3
10 1 . . . . . . 2.000 3.000 parsed_1qe7 3
11 1 . . . . . . 3.200 4.200 parsed_1qe7 3
12 1 . . . . . . 3.000 4.000 parsed_1qe7 3
13 1 . . . . . . 2.200 3.200 parsed_1qe7 3
14 1 . . . . . . 2.000 5.000 parsed_1qe7 3
15 1 . . . . . . 2.800 3.800 parsed_1qe7 3
16 1 . . . . . . 2.600 3.600 parsed_1qe7 3
17 1 . . . . . . 2.000 3.000 parsed_1qe7 3
18 1 . . . . . . 2.200 3.200 parsed_1qe7 3
19 1 . . . . . . 3.400 4.400 parsed_1qe7 3
20 1 . . . . . . 3.000 4.000 parsed_1qe7 3
21 1 . . . . . . 2.900 3.900 parsed_1qe7 3
22 1 . . . . . . 2.500 3.500 parsed_1qe7 3
23 1 . . . . . . 2.100 3.100 parsed_1qe7 3
24 1 . . . . . . 2.200 3.200 parsed_1qe7 3
25 1 . . . . . . 3.100 4.100 parsed_1qe7 3
26 1 . . . . . . 2.000 5.000 parsed_1qe7 3
27 1 . . . . . . 2.000 3.050 parsed_1qe7 3
28 1 . . . . . . 2.000 3.000 parsed_1qe7 3
29 1 . . . . . . 3.000 4.000 parsed_1qe7 3
30 1 . . . . . . 3.000 4.000 parsed_1qe7 3
31 1 . . . . . . 2.100 3.000 parsed_1qe7 3
32 1 . . . . . . 2.000 3.000 parsed_1qe7 3
33 1 . . . . . . 3.000 4.000 parsed_1qe7 3
34 1 . . . . . . 2.500 3.500 parsed_1qe7 3
35 1 . . . . . . 2.000 5.000 parsed_1qe7 3
36 1 . . . . . . 2.100 3.100 parsed_1qe7 3
37 1 . . . . . . 2.400 3.400 parsed_1qe7 3
38 1 . . . . . . 3.400 4.400 parsed_1qe7 3
39 1 . . . . . . 2.700 3.700 parsed_1qe7 3
40 1 . . . . . . 2.100 3.100 parsed_1qe7 3
41 1 . . . . . . 2.700 3.700 parsed_1qe7 3
42 1 . . . . . . 3.500 4.500 parsed_1qe7 3
43 1 . . . . . . 3.250 4.200 parsed_1qe7 3
44 1 . . . . . . 3.400 4.400 parsed_1qe7 3
45 1 . . . . . . 2.550 3.500 parsed_1qe7 3
46 1 . . . . . . 2.100 3.100 parsed_1qe7 3
47 1 . . . . . . 2.400 3.400 parsed_1qe7 3
48 1 . . . . . . 3.100 4.100 parsed_1qe7 3
49 1 . . . . . . 2.700 3.700 parsed_1qe7 3
50 1 . . . . . . 3.900 4.900 parsed_1qe7 3
51 1 . . . . . . 3.900 4.900 parsed_1qe7 3
52 1 . . . . . . 3.200 4.200 parsed_1qe7 3
53 1 . . . . . . 2.800 3.800 parsed_1qe7 3
54 1 . . . . . . 3.100 4.100 parsed_1qe7 3
55 1 . . . . . . 2.500 3.500 parsed_1qe7 3
56 1 . . . . . . 2.600 3.600 parsed_1qe7 3
57 1 . . . . . . 4.000 5.000 parsed_1qe7 3
58 1 . . . . . . 3.200 4.200 parsed_1qe7 3
59 1 . . . . . . 2.600 3.600 parsed_1qe7 3
60 1 . . . . . . 2.800 3.800 parsed_1qe7 3
61 1 . . . . . . 4.000 5.000 parsed_1qe7 3
62 1 . . . . . . 2.800 3.800 parsed_1qe7 3
63 1 . . . . . . 4.500 5.500 parsed_1qe7 3
64 1 . . . . . . 3.300 4.300 parsed_1qe7 3
65 1 . . . . . . 4.000 5.000 parsed_1qe7 3
66 1 . . . . . . 3.900 4.900 parsed_1qe7 3
67 1 . . . . . . 3.750 4.800 parsed_1qe7 3
68 1 . . . . . . 4.000 5.000 parsed_1qe7 3
69 1 . . . . . . 4.500 5.500 parsed_1qe7 3
70 1 . . . . . . 3.500 4.500 parsed_1qe7 3
71 1 . . . . . . 3.900 4.900 parsed_1qe7 3
72 1 . . . . . . 3.900 4.900 parsed_1qe7 3
73 1 . . . . . . 3.400 4.400 parsed_1qe7 3
74 1 . . . . . . 2.400 3.400 parsed_1qe7 3
75 1 . . . . . . 2.900 3.900 parsed_1qe7 3
76 1 . . . . . . 3.500 4.500 parsed_1qe7 3
77 1 . . . . . . 3.400 4.400 parsed_1qe7 3
78 1 . . . . . . 3.900 4.900 parsed_1qe7 3
79 1 . . . . . . 4.200 5.200 parsed_1qe7 3
80 1 . . . . . . 4.200 5.200 parsed_1qe7 3
81 1 . . . . . . 4.000 5.000 parsed_1qe7 3
82 1 . . . . . . 3.600 4.600 parsed_1qe7 3
83 1 . . . . . . 4.000 5.000 parsed_1qe7 3
84 1 . . . . . . 3.100 4.100 parsed_1qe7 3
85 1 . . . . . . 2.680 3.600 parsed_1qe7 3
86 1 . . . . . . 4.100 5.100 parsed_1qe7 3
87 1 . . . . . . 3.700 4.700 parsed_1qe7 3
88 1 . . . . . . 4.100 5.100 parsed_1qe7 3
89 1 . . . . . . 4.100 5.100 parsed_1qe7 3
90 1 . . . . . . 4.100 5.100 parsed_1qe7 3
91 1 . . . . . . 4.000 5.000 parsed_1qe7 3
92 1 . . . . . . 2.000 5.000 parsed_1qe7 3
93 1 . . . . . . 3.700 4.700 parsed_1qe7 3
94 1 . . . . . . 4.000 5.000 parsed_1qe7 3
95 1 . . . . . . 4.000 5.000 parsed_1qe7 3
96 1 . . . . . . 4.000 5.000 parsed_1qe7 3
97 1 . . . . . . 3.600 4.600 parsed_1qe7 3
98 1 . . . . . . 3.000 4.000 parsed_1qe7 3
99 1 . . . . . . 3.200 4.200 parsed_1qe7 3
100 1 . . . . . . 3.200 4.200 parsed_1qe7 3
101 1 . . . . . . 4.200 5.200 parsed_1qe7 3
102 1 . . . . . . 4.600 5.600 parsed_1qe7 3
103 1 . . . . . . 3.000 4.000 parsed_1qe7 3
104 1 . . . . . . 2.800 3.800 parsed_1qe7 3
105 1 . . . . . . 3.250 4.250 parsed_1qe7 3
106 1 . . . . . . 4.100 5.100 parsed_1qe7 3
107 1 . . . . . . 3.300 4.300 parsed_1qe7 3
108 1 . . . . . . 2.500 3.500 parsed_1qe7 3
109 1 . . . . . . 3.000 4.000 parsed_1qe7 3
110 1 . . . . . . 4.000 5.040 parsed_1qe7 3
111 1 . . . . . . 4.300 5.300 parsed_1qe7 3
112 1 . . . . . . 3.000 4.000 parsed_1qe7 3
113 1 . . . . . . 2.600 3.600 parsed_1qe7 3
114 1 . . . . . . 4.000 5.020 parsed_1qe7 3
115 1 . . . . . . 3.500 4.500 parsed_1qe7 3
116 1 . . . . . . 3.700 4.700 parsed_1qe7 3
117 1 . . . . . . 2.800 3.800 parsed_1qe7 3
118 1 . . . . . . 3.200 4.200 parsed_1qe7 3
119 1 . . . . . . 3.400 4.320 parsed_1qe7 3
120 1 . . . . . . 3.600 4.600 parsed_1qe7 3
121 1 . . . . . . 3.900 4.900 parsed_1qe7 3
122 1 . . . . . . 4.000 5.000 parsed_1qe7 3
123 1 . . . . . . 2.900 3.900 parsed_1qe7 3
124 1 . . . . . . 3.000 4.000 parsed_1qe7 3
125 1 . . . . . . 4.000 5.000 parsed_1qe7 3
126 1 . . . . . . 3.600 4.600 parsed_1qe7 3
127 1 . . . . . . 3.400 4.400 parsed_1qe7 3
128 1 . . . . . . 3.800 4.800 parsed_1qe7 3
129 1 . . . . . . 4.000 5.000 parsed_1qe7 3
130 1 . . . . . . 2.400 3.300 parsed_1qe7 3
131 1 . . . . . . 2.400 3.300 parsed_1qe7 3
132 1 . . . . . . 3.500 4.500 parsed_1qe7 3
133 1 . . . . . . 2.000 3.000 parsed_1qe7 3
134 1 . . . . . . 3.500 4.500 parsed_1qe7 3
135 1 . . . . . . 2.000 3.000 parsed_1qe7 3
136 1 . . . . . . 3.500 4.500 parsed_1qe7 3
137 1 . . . . . . 2.000 3.000 parsed_1qe7 3
138 1 . . . . . . 3.500 4.500 parsed_1qe7 3
139 1 . . . . . . 2.000 3.000 parsed_1qe7 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 "THE H1'-H2'/H2'', H1'-H3',H1'-H4' CONNECTIVITIES" 1 1 1 50 parsed_1qe7 3
2 "THE SEQUENTIAL CONNECTIVITIES" 51 1 51 30 parsed_1qe7 3
3 "THE IMINIO PROTON CONNECTIVITIES" 132 1 132 33 parsed_1qe7 3
stop_
save_
save_Discover_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1qe7
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 5 A O4' 1 5 A C1' 1 5 A N9 1 5 A C4 parsed_1qe7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 6 G O4' 1 6 G C1' 1 6 G N9 1 6 G C4 parsed_1qe7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 7 G O4' 1 7 G C1' 1 7 G N9 1 7 G C4 parsed_1qe7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 8 A O4' 1 8 A C1' 1 8 A N9 1 8 A C4 parsed_1qe7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 9 T O4' 1 9 T C1' 1 9 T N1 1 9 T C2 parsed_1qe7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 12 T O4' 1 12 T C1' 1 12 T N1 1 12 T C2 parsed_1qe7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 13 T O4' 1 13 T C1' 1 13 T N1 1 13 T C2 parsed_1qe7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 14 T O4' 1 14 T C1' 1 14 T N1 1 14 T C2 parsed_1qe7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 15 U O4' 1 15 U C1' 1 15 U N1 1 15 U C2 parsed_1qe7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 16 G O4' 1 16 G C1' 1 16 G N9 1 16 G C4 parsed_1qe7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 17 G O4' 1 17 G C1' 1 17 G N9 1 17 G C4 parsed_1qe7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 18 A O4' 1 18 A C1' 1 18 A N9 1 18 A C4 parsed_1qe7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -120.0 . 1 19 T O4' 1 19 T C1' 1 19 T N1 1 19 T C2 parsed_1qe7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 5 A C5' 1 5 A C4' 1 5 A C3' 1 5 A O3' parsed_1qe7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 6 G C5' 1 6 G C4' 1 6 G C3' 1 6 G O3' parsed_1qe7 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 7 G C5' 1 7 G C4' 1 7 G C3' 1 7 G O3' parsed_1qe7 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 8 A C5' 1 8 A C4' 1 8 A C3' 1 8 A O3' parsed_1qe7 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 9 T C5' 1 9 T C4' 1 9 T C3' 1 9 T O3' parsed_1qe7 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 10 C C5' 1 10 C C4' 1 10 C C3' 1 10 C O3' parsed_1qe7 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 11 C C5' 1 11 C C4' 1 11 C C3' 1 11 C O3' parsed_1qe7 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 12 T C5' 1 12 T C4' 1 12 T C3' 1 12 T O3' parsed_1qe7 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 13 T C5' 1 13 T C4' 1 13 T C3' 1 13 T O3' parsed_1qe7 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 14 T C5' 1 14 T C4' 1 14 T C3' 1 14 T O3' parsed_1qe7 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 15 U C5' 1 15 U C4' 1 15 U C3' 1 15 U O3' parsed_1qe7 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 16 G C5' 1 16 G C4' 1 16 G C3' 1 16 G O3' parsed_1qe7 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 17 G C5' 1 17 G C4' 1 17 G C3' 1 17 G O3' parsed_1qe7 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 18 A C5' 1 18 A C4' 1 18 A C3' 1 18 A O3' parsed_1qe7 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 19 T C5' 1 19 T C4' 1 19 T C3' 1 19 T O3' parsed_1qe7 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 20 C C5' 1 20 C C4' 1 20 C C3' 1 20 C O3' parsed_1qe7 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 160.0 . 1 21 C C5' 1 21 C C4' 1 21 C C3' 1 21 C O3' parsed_1qe7 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 5 A C2' 1 5 A C3' 1 5 A C4' 1 5 A O4' parsed_1qe7 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 6 G C2' 1 6 G C3' 1 6 G C4' 1 6 G O4' parsed_1qe7 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 7 G C2' 1 7 G C3' 1 7 G C4' 1 7 G O4' parsed_1qe7 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 8 A C2' 1 8 A C3' 1 8 A C4' 1 8 A O4' parsed_1qe7 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 9 T C2' 1 9 T C3' 1 9 T C4' 1 9 T O4' parsed_1qe7 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 10 C C2' 1 10 C C3' 1 10 C C4' 1 10 C O4' parsed_1qe7 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 11 C C2' 1 11 C C3' 1 11 C C4' 1 11 C O4' parsed_1qe7 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 12 T C2' 1 12 T C3' 1 12 T C4' 1 12 T O4' parsed_1qe7 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 13 T C2' 1 13 T C3' 1 13 T C4' 1 13 T O4' parsed_1qe7 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 14 T C2' 1 14 T C3' 1 14 T C4' 1 14 T O4' parsed_1qe7 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 15 U C2' 1 15 U C3' 1 15 U C4' 1 15 U O4' parsed_1qe7 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 16 G C2' 1 16 G C3' 1 16 G C4' 1 16 G O4' parsed_1qe7 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 17 G C2' 1 17 G C3' 1 17 G C4' 1 17 G O4' parsed_1qe7 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 18 A C2' 1 18 A C3' 1 18 A C4' 1 18 A O4' parsed_1qe7 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 19 T C2' 1 19 T C3' 1 19 T C4' 1 19 T O4' parsed_1qe7 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 20 C C2' 1 20 C C3' 1 20 C C4' 1 20 C O4' parsed_1qe7 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.0 35.0 . 1 21 C C2' 1 21 C C3' 1 21 C C4' 1 21 C O4' parsed_1qe7 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 5 A C4' 1 5 A C3' 1 5 A C2' 1 5 A C1' parsed_1qe7 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 6 G C4' 1 6 G C3' 1 6 G C2' 1 6 G C1' parsed_1qe7 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 7 G C4' 1 7 G C3' 1 7 G C2' 1 7 G C1' parsed_1qe7 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 8 A C4' 1 8 A C3' 1 8 A C2' 1 8 A C1' parsed_1qe7 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 9 T C4' 1 9 T C3' 1 9 T C2' 1 9 T C1' parsed_1qe7 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 10 C C4' 1 10 C C3' 1 10 C C2' 1 10 C C1' parsed_1qe7 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 11 C C4' 1 11 C C3' 1 11 C C2' 1 11 C C1' parsed_1qe7 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 12 T C4' 1 12 T C3' 1 12 T C2' 1 12 T C1' parsed_1qe7 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 13 T C4' 1 13 T C3' 1 13 T C2' 1 13 T C1' parsed_1qe7 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 14 T C4' 1 14 T C3' 1 14 T C2' 1 14 T C1' parsed_1qe7 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 15 U C4' 1 15 U C3' 1 15 U C2' 1 15 U C1' parsed_1qe7 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 16 G C4' 1 16 G C3' 1 16 G C2' 1 16 G C1' parsed_1qe7 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 17 G C4' 1 17 G C3' 1 17 G C2' 1 17 G C1' parsed_1qe7 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 18 A C4' 1 18 A C3' 1 18 A C2' 1 18 A C1' parsed_1qe7 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 19 T C4' 1 19 T C3' 1 19 T C2' 1 19 T C1' parsed_1qe7 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 20 C C4' 1 20 C C3' 1 20 C C2' 1 20 C C1' parsed_1qe7 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 -38.0 . 1 21 C C4' 1 21 C C3' 1 21 C C2' 1 21 C C1' parsed_1qe7 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1
;
NMR_dihedral
CHI
;
1 1 2 4 parsed_1qe7 1
2 DELTA 16 1 16 6 parsed_1qe7 1
stop_
save_
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