NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
603376 |
2n60   |
25746 | cing | 2-parsed | STAR | entry | full | 215 |
data_2n60_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2n60
_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_2n60 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2n60
_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 2n60 "Master copy" parsed_2n60
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2n60
_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 2n60.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n60 1
1 2n60.mr . . XPLOR/CNS 2 distance NOE simple 136 parsed_2n60 1
1 2n60.mr . . "MR format" 3 comment "Not applicable" "Not applicable" 0 parsed_2n60 1
1 2n60.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 11 parsed_2n60 1
1 2n60.mr . . "MR format" 5 comment "Not applicable" "Not applicable" 0 parsed_2n60 1
1 2n60.mr . . XPLOR/CNS 6 distance NOE simple 12 parsed_2n60 1
1 2n60.mr . . "MR format" 7 comment "Not applicable" "Not applicable" 0 parsed_2n60 1
1 2n60.mr . . XPLOR/CNS 8 distance "hydrogen bond" simple 40 parsed_2n60 1
1 2n60.mr . . "MR format" 9 comment "Not applicable" "Not applicable" 0 parsed_2n60 1
1 2n60.mr . . XPLOR/CNS 10 distance NOE simple 16 parsed_2n60 1
1 2n60.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n60 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_2n60
_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 08-AUG-15 2N60
*TITLE G-QUADRUPLEXES WITH (4N-1) GUANINES IN THE G-TETRAD CORE: FORMATION OF
*TITLE 2 A G-TRIAD WATER COMPLEX AND IMPLICATION FOR SMALL-MOLECULE BINDING
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: DNA (5'-
*COMPND 3 D(*TP*TP*GP*TP*GP*TP*GP*GP*GP*TP*GP*GP*GP*TP*GP*GP*GP*T)-3');
*COMPND 4 CHAIN: A;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC;
*SOURCE 4 ORGANISM_TAXID: 32630
*KEYWDS G-QUADRUPLEX, VACANT SITE, 11 GUANINES, G-TRIAD, K+ SOLUTION, DNA
*EXPDTA SOLUTION NMR
*NUMMDL 10
*AUTHOR B.HEDDI,N.MARTIN-PINTADO,Z.SERIMBETOV,T.M.KARI,A.T.PHAN
*REVDAT 1 01-JUN-16 2N60 0
::::::::::::::
D2O.tbl
::::::::::::::
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2n60
_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_2n60 1
2 1 . . . parsed_2n60 1
3 1 . . . parsed_2n60 1
4 1 . . . parsed_2n60 1
5 1 . . . parsed_2n60 1
6 1 . . . parsed_2n60 1
7 1 . . . parsed_2n60 1
8 1 . . . parsed_2n60 1
9 1 . . . parsed_2n60 1
10 1 . . . parsed_2n60 1
11 1 . . . parsed_2n60 1
12 1 . . . parsed_2n60 1
13 1 . . . parsed_2n60 1
14 1 . . . parsed_2n60 1
15 1 . . . parsed_2n60 1
16 1 . . . parsed_2n60 1
17 1 . . . parsed_2n60 1
18 1 . . . parsed_2n60 1
19 1 . . . parsed_2n60 1
20 1 . . . parsed_2n60 1
21 1 . . . parsed_2n60 1
22 1 . . . parsed_2n60 1
23 1 . . . parsed_2n60 1
24 1 . . . parsed_2n60 1
25 1 . . . parsed_2n60 1
26 1 . . . parsed_2n60 1
27 1 . . . parsed_2n60 1
28 1 . . . parsed_2n60 1
29 1 . . . parsed_2n60 1
30 1 . . . parsed_2n60 1
31 1 . . . parsed_2n60 1
32 1 . . . parsed_2n60 1
33 1 . . . parsed_2n60 1
34 1 . . . parsed_2n60 1
35 1 . . . parsed_2n60 1
36 1 . . . parsed_2n60 1
37 1 . . . parsed_2n60 1
38 1 . . . parsed_2n60 1
39 1 . . . parsed_2n60 1
40 1 . . . parsed_2n60 1
41 1 . . . parsed_2n60 1
42 1 . . . parsed_2n60 1
43 1 . . . parsed_2n60 1
44 1 . . . parsed_2n60 1
45 1 . . . parsed_2n60 1
46 1 . . . parsed_2n60 1
47 1 . . . parsed_2n60 1
48 1 . . . parsed_2n60 1
49 1 . . . parsed_2n60 1
50 1 . . . parsed_2n60 1
51 1 . . . parsed_2n60 1
52 1 . . . parsed_2n60 1
53 1 . . . parsed_2n60 1
54 1 . . . parsed_2n60 1
55 1 . . . parsed_2n60 1
56 1 . . . parsed_2n60 1
57 1 . . . parsed_2n60 1
58 1 . . . parsed_2n60 1
59 1 . . . parsed_2n60 1
60 1 . . . parsed_2n60 1
61 1 . . . parsed_2n60 1
62 1 . . . parsed_2n60 1
63 1 . . . parsed_2n60 1
64 1 . . . parsed_2n60 1
65 1 . . . parsed_2n60 1
66 1 . . . parsed_2n60 1
67 1 . . . parsed_2n60 1
68 1 . . . parsed_2n60 1
69 1 . . . parsed_2n60 1
70 1 . . . parsed_2n60 1
71 1 . . . parsed_2n60 1
72 1 . . . parsed_2n60 1
73 1 . . . parsed_2n60 1
74 1 . . . parsed_2n60 1
75 1 . . . parsed_2n60 1
76 1 . . . parsed_2n60 1
77 1 . . . parsed_2n60 1
78 1 . . . parsed_2n60 1
79 1 . . . parsed_2n60 1
80 1 . . . parsed_2n60 1
81 1 . . . parsed_2n60 1
82 1 . . . parsed_2n60 1
83 1 . . . parsed_2n60 1
84 1 . . . parsed_2n60 1
85 1 . . . parsed_2n60 1
86 1 . . . parsed_2n60 1
87 1 . . . parsed_2n60 1
88 1 . . . parsed_2n60 1
89 1 . . . parsed_2n60 1
90 1 . . . parsed_2n60 1
91 1 . . . parsed_2n60 1
92 1 . . . parsed_2n60 1
93 1 . . . parsed_2n60 1
94 1 . . . parsed_2n60 1
95 1 . . . parsed_2n60 1
96 1 . . . parsed_2n60 1
97 1 . . . parsed_2n60 1
98 1 . . . parsed_2n60 1
99 1 . . . parsed_2n60 1
100 1 . . . parsed_2n60 1
101 1 . . . parsed_2n60 1
102 1 . . . parsed_2n60 1
103 1 . . . parsed_2n60 1
104 1 . . . parsed_2n60 1
105 1 . . . parsed_2n60 1
106 1 . . . parsed_2n60 1
107 1 . . . parsed_2n60 1
108 1 . . . parsed_2n60 1
109 1 . . . parsed_2n60 1
110 1 . . . parsed_2n60 1
111 1 . . . parsed_2n60 1
112 1 . . . parsed_2n60 1
113 1 . . . parsed_2n60 1
114 1 . . . parsed_2n60 1
115 1 . . . parsed_2n60 1
116 1 . . . parsed_2n60 1
117 1 . . . parsed_2n60 1
118 1 . . . parsed_2n60 1
119 1 . . . parsed_2n60 1
120 1 . . . parsed_2n60 1
121 1 . . . parsed_2n60 1
122 1 . . . parsed_2n60 1
123 1 . . . parsed_2n60 1
124 1 . . . parsed_2n60 1
125 1 . . . parsed_2n60 1
126 1 . . . parsed_2n60 1
127 1 . . . parsed_2n60 1
128 1 . . . parsed_2n60 1
129 1 . . . parsed_2n60 1
130 1 . . . parsed_2n60 1
131 1 . . . parsed_2n60 1
132 1 . . . parsed_2n60 1
133 1 . . . parsed_2n60 1
134 1 . . . parsed_2n60 1
135 1 . . . parsed_2n60 1
136 1 . . . parsed_2n60 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 . . . . . . . . DNA1 3 . H2' parsed_2n60 1
1 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 1
2 1 1 . . . . . . . . DNA1 3 . H2'' parsed_2n60 1
2 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 1
3 1 1 . . . . . . . . DNA1 3 . H1' parsed_2n60 1
3 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 1
4 1 1 . . . . . . . . DNA1 3 . H3' parsed_2n60 1
4 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 1
5 1 1 . . . . . . . . DNA1 3 . H4' parsed_2n60 1
5 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 1
6 1 1 . . . . . . . . DNA1 7 . H2' parsed_2n60 1
6 1 2 . . . . . . . . DNA1 7 . H8 parsed_2n60 1
7 1 1 . . . . . . . . DNA1 7 . H2'' parsed_2n60 1
7 1 2 . . . . . . . . DNA1 7 . H8 parsed_2n60 1
8 1 1 . . . . . . . . DNA1 7 . H1' parsed_2n60 1
8 1 2 . . . . . . . . DNA1 7 . H8 parsed_2n60 1
9 1 1 . . . . . . . . DNA1 7 . H3' parsed_2n60 1
9 1 2 . . . . . . . . DNA1 7 . H8 parsed_2n60 1
10 1 1 . . . . . . . . DNA1 7 . H2' parsed_2n60 1
10 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
11 1 1 . . . . . . . . DNA1 7 . H2'' parsed_2n60 1
11 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
12 1 1 . . . . . . . . DNA1 7 . H1' parsed_2n60 1
12 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
13 1 1 . . . . . . . . DNA1 7 . H3' parsed_2n60 1
13 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
14 1 1 . . . . . . . . DNA1 8 . H2' parsed_2n60 1
14 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
15 1 1 . . . . . . . . DNA1 8 . H2'' parsed_2n60 1
15 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
16 1 1 . . . . . . . . DNA1 8 . H1' parsed_2n60 1
16 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
17 1 1 . . . . . . . . DNA1 8 . H3' parsed_2n60 1
17 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
18 1 1 . . . . . . . . DNA1 8 . H4' parsed_2n60 1
18 1 2 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
19 1 1 . . . . . . . . DNA1 8 . H2' parsed_2n60 1
19 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
20 1 1 . . . . . . . . DNA1 8 . H2'' parsed_2n60 1
20 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
21 1 1 . . . . . . . . DNA1 8 . H1' parsed_2n60 1
21 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
22 1 1 . . . . . . . . DNA1 8 . H3' parsed_2n60 1
22 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
23 1 1 . . . . . . . . DNA1 8 . H8 parsed_2n60 1
23 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
24 1 1 . . . . . . . . DNA1 9 . H2' parsed_2n60 1
24 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
25 1 1 . . . . . . . . DNA1 9 . H2'' parsed_2n60 1
25 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
26 1 1 . . . . . . . . DNA1 9 . H1' parsed_2n60 1
26 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
27 1 1 . . . . . . . . DNA1 9 . H3' parsed_2n60 1
27 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
28 1 1 . . . . . . . . DNA1 9 . H4' parsed_2n60 1
28 1 2 . . . . . . . . DNA1 9 . H8 parsed_2n60 1
29 1 1 . . . . . . . . DNA1 5 . H2' parsed_2n60 1
29 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
30 1 1 . . . . . . . . DNA1 5 . H2'' parsed_2n60 1
30 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
31 1 1 . . . . . . . . DNA1 5 . H1' parsed_2n60 1
31 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
32 1 1 . . . . . . . . DNA1 5 . H3' parsed_2n60 1
32 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
33 1 1 . . . . . . . . DNA1 5 . H4' parsed_2n60 1
33 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
34 1 1 . . . . . . . . DNA1 13 . H2' parsed_2n60 1
34 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
35 1 1 . . . . . . . . DNA1 13 . H2'' parsed_2n60 1
35 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
36 1 1 . . . . . . . . DNA1 13 . H1' parsed_2n60 1
36 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
37 1 1 . . . . . . . . DNA1 13 . H3' parsed_2n60 1
37 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
38 1 1 . . . . . . . . DNA1 13 . H4' parsed_2n60 1
38 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
39 1 1 . . . . . . . . DNA1 11 . H2' parsed_2n60 1
39 1 2 . . . . . . . . DNA1 11 . H8 parsed_2n60 1
40 1 1 . . . . . . . . DNA1 11 . H2'' parsed_2n60 1
40 1 2 . . . . . . . . DNA1 11 . H8 parsed_2n60 1
41 1 1 . . . . . . . . DNA1 11 . H1' parsed_2n60 1
41 1 2 . . . . . . . . DNA1 11 . H8 parsed_2n60 1
42 1 1 . . . . . . . . DNA1 11 . H3' parsed_2n60 1
42 1 2 . . . . . . . . DNA1 11 . H8 parsed_2n60 1
43 1 1 . . . . . . . . DNA1 11 . H4' parsed_2n60 1
43 1 2 . . . . . . . . DNA1 11 . H8 parsed_2n60 1
44 1 1 . . . . . . . . DNA1 11 . H2' parsed_2n60 1
44 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
45 1 1 . . . . . . . . DNA1 11 . H2'' parsed_2n60 1
45 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
46 1 1 . . . . . . . . DNA1 11 . H1' parsed_2n60 1
46 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
47 1 1 . . . . . . . . DNA1 11 . H3' parsed_2n60 1
47 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
48 1 1 . . . . . . . . DNA1 12 . H2' parsed_2n60 1
48 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
49 1 1 . . . . . . . . DNA1 12 . H2'' parsed_2n60 1
49 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
50 1 1 . . . . . . . . DNA1 12 . H1' parsed_2n60 1
50 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
51 1 1 . . . . . . . . DNA1 12 . H3' parsed_2n60 1
51 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
52 1 1 . . . . . . . . DNA1 12 . H4' parsed_2n60 1
52 1 2 . . . . . . . . DNA1 12 . H8 parsed_2n60 1
53 1 1 . . . . . . . . DNA1 12 . H2' parsed_2n60 1
53 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
54 1 1 . . . . . . . . DNA1 12 . H2'' parsed_2n60 1
54 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
55 1 1 . . . . . . . . DNA1 12 . H1' parsed_2n60 1
55 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
56 1 1 . . . . . . . . DNA1 12 . H3' parsed_2n60 1
56 1 2 . . . . . . . . DNA1 13 . H8 parsed_2n60 1
57 1 1 . . . . . . . . DNA1 15 . H2' parsed_2n60 1
57 1 2 . . . . . . . . DNA1 15 . H8 parsed_2n60 1
58 1 1 . . . . . . . . DNA1 15 . H2'' parsed_2n60 1
58 1 2 . . . . . . . . DNA1 15 . H8 parsed_2n60 1
59 1 1 . . . . . . . . DNA1 15 . H1' parsed_2n60 1
59 1 2 . . . . . . . . DNA1 15 . H8 parsed_2n60 1
60 1 1 . . . . . . . . DNA1 15 . H3' parsed_2n60 1
60 1 2 . . . . . . . . DNA1 15 . H8 parsed_2n60 1
61 1 1 . . . . . . . . DNA1 15 . H4' parsed_2n60 1
61 1 2 . . . . . . . . DNA1 15 . H8 parsed_2n60 1
62 1 1 . . . . . . . . DNA1 15 . H2' parsed_2n60 1
62 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
63 1 1 . . . . . . . . DNA1 15 . H2'' parsed_2n60 1
63 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
64 1 1 . . . . . . . . DNA1 15 . H1' parsed_2n60 1
64 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
65 1 1 . . . . . . . . DNA1 15 . H3' parsed_2n60 1
65 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
66 1 1 . . . . . . . . DNA1 15 . H4' parsed_2n60 1
66 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
67 1 1 . . . . . . . . DNA1 16 . H2' parsed_2n60 1
67 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
68 1 1 . . . . . . . . DNA1 16 . H2'' parsed_2n60 1
68 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
69 1 1 . . . . . . . . DNA1 16 . H1' parsed_2n60 1
69 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
70 1 1 . . . . . . . . DNA1 16 . H3' parsed_2n60 1
70 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
71 1 1 . . . . . . . . DNA1 16 . H4' parsed_2n60 1
71 1 2 . . . . . . . . DNA1 16 . H8 parsed_2n60 1
72 1 1 . . . . . . . . DNA1 16 . H2' parsed_2n60 1
72 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
73 1 1 . . . . . . . . DNA1 16 . H2'' parsed_2n60 1
73 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
74 1 1 . . . . . . . . DNA1 16 . H1' parsed_2n60 1
74 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
75 1 1 . . . . . . . . DNA1 16 . H3' parsed_2n60 1
75 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
76 1 1 . . . . . . . . DNA1 17 . H2' parsed_2n60 1
76 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
77 1 1 . . . . . . . . DNA1 17 . H2'' parsed_2n60 1
77 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
78 1 1 . . . . . . . . DNA1 17 . H1' parsed_2n60 1
78 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
79 1 1 . . . . . . . . DNA1 17 . H3' parsed_2n60 1
79 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
80 1 1 . . . . . . . . DNA1 17 . H4' parsed_2n60 1
80 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
81 1 1 . . . . . . . . DNA1 1 . H7# parsed_2n60 1
81 1 2 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
82 1 1 . . . . . . . . DNA1 1 . H2' parsed_2n60 1
82 1 2 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
83 1 1 . . . . . . . . DNA1 1 . H2'' parsed_2n60 1
83 1 2 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
84 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 1
84 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
85 1 1 . . . . . . . . DNA1 2 . H2' parsed_2n60 1
85 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
86 1 1 . . . . . . . . DNA1 2 . H2'' parsed_2n60 1
86 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
87 1 1 . . . . . . . . DNA1 18 . H7# parsed_2n60 1
87 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
88 1 1 . . . . . . . . DNA1 18 . H2' parsed_2n60 1
88 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
89 1 1 . . . . . . . . DNA1 17 . H2' parsed_2n60 1
89 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
90 1 1 . . . . . . . . DNA1 17 . H2'' parsed_2n60 1
90 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
91 1 1 . . . . . . . . DNA1 3 . H2' parsed_2n60 1
91 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
92 1 1 . . . . . . . . DNA1 3 . H2'' parsed_2n60 1
92 1 2 . . . . . . . . DNA1 5 . H8 parsed_2n60 1
93 1 1 . . . . . . . . DNA1 4 . H7# parsed_2n60 1
93 1 2 . . . . . . . . DNA1 4 . H6 parsed_2n60 1
94 1 1 . . . . . . . . DNA1 4 . H2' parsed_2n60 1
94 1 2 . . . . . . . . DNA1 4 . H6 parsed_2n60 1
95 1 1 . . . . . . . . DNA1 4 . H2'' parsed_2n60 1
95 1 2 . . . . . . . . DNA1 4 . H6 parsed_2n60 1
96 1 1 . . . . . . . . DNA1 18 . H7# parsed_2n60 1
96 1 2 . . . . . . . . DNA1 17 . H8 parsed_2n60 1
97 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 1
97 1 2 . . . . . . . . DNA1 1 . H1' parsed_2n60 1
98 1 1 . . . . . . . . DNA1 18 . H3' parsed_2n60 1
98 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
99 1 1 . . . . . . . . DNA1 18 . H1' parsed_2n60 1
99 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
100 1 1 . . . . . . . . DNA1 18 . H7# parsed_2n60 1
100 1 2 . . . . . . . . DNA1 17 . H3' parsed_2n60 1
101 1 1 . . . . . . . . DNA1 1 . H2' parsed_2n60 1
101 1 2 . . . . . . . . DNA1 1 . H5'* parsed_2n60 1
102 1 1 . . . . . . . . DNA1 1 . H2'' parsed_2n60 1
102 1 2 . . . . . . . . DNA1 1 . H5'* parsed_2n60 1
103 1 1 . . . . . . . . DNA1 1 . H4' parsed_2n60 1
103 1 2 . . . . . . . . DNA1 1 . H5'* parsed_2n60 1
104 1 1 . . . . . . . . DNA1 2 . H3' parsed_2n60 1
104 1 2 . . . . . . . . DNA1 2 . H5' parsed_2n60 1
105 1 1 . . . . . . . . DNA1 2 . H3' parsed_2n60 1
105 1 2 . . . . . . . . DNA1 2 . H5'' parsed_2n60 1
106 1 1 . . . . . . . . DNA1 2 . H4' parsed_2n60 1
106 1 2 . . . . . . . . DNA1 2 . H5' parsed_2n60 1
107 1 1 . . . . . . . . DNA1 1 . H3' parsed_2n60 1
107 1 2 . . . . . . . . DNA1 1 . H5'* parsed_2n60 1
108 1 1 . . . . . . . . DNA1 3 . H4' parsed_2n60 1
108 1 2 . . . . . . . . DNA1 3 . H5'* parsed_2n60 1
109 1 1 . . . . . . . . DNA1 3 . H3' parsed_2n60 1
109 1 2 . . . . . . . . DNA1 3 . H5'* parsed_2n60 1
110 1 1 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
110 1 2 . . . . . . . . DNA1 1 . H5'* parsed_2n60 1
111 1 1 . . . . . . . . DNA1 1 . H4' parsed_2n60 1
111 1 2 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
112 1 1 . . . . . . . . DNA1 1 . H3' parsed_2n60 1
112 1 2 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
113 1 1 . . . . . . . . DNA1 1 . H1' parsed_2n60 1
113 1 2 . . . . . . . . DNA1 1 . H6 parsed_2n60 1
114 1 1 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
114 1 2 . . . . . . . . DNA1 2 . H5'* parsed_2n60 1
115 1 1 . . . . . . . . DNA1 1 . H3' parsed_2n60 1
115 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
116 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 1
116 1 2 . . . . . . . . DNA1 15 . H1' parsed_2n60 1
117 1 1 . . . . . . . . DNA1 1 . H5'* parsed_2n60 1
117 1 2 . . . . . . . . DNA1 7 . H8 parsed_2n60 1
118 1 1 . . . . . . . . DNA1 1 . H4' parsed_2n60 1
118 1 2 . . . . . . . . DNA1 2 . H5'' parsed_2n60 1
119 1 1 . . . . . . . . DNA1 2 . H4' parsed_2n60 1
119 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
120 1 1 . . . . . . . . DNA1 2 . H3' parsed_2n60 1
120 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
121 1 1 . . . . . . . . DNA1 2 . H1' parsed_2n60 1
121 1 2 . . . . . . . . DNA1 2 . H6 parsed_2n60 1
122 1 1 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
122 1 2 . . . . . . . . DNA1 17 . H1' parsed_2n60 1
123 1 1 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
123 1 2 . . . . . . . . DNA1 17 . H3' parsed_2n60 1
124 1 1 . . . . . . . . DNA1 18 . H4' parsed_2n60 1
124 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
125 1 1 . . . . . . . . DNA1 18 . H3' parsed_2n60 1
125 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
126 1 1 . . . . . . . . DNA1 18 . H1' parsed_2n60 1
126 1 2 . . . . . . . . DNA1 18 . H6 parsed_2n60 1
127 1 1 . . . . . . . . DNA1 4 . H3' parsed_2n60 1
127 1 2 . . . . . . . . DNA1 4 . H6 parsed_2n60 1
128 1 1 . . . . . . . . DNA1 4 . H1' parsed_2n60 1
128 1 2 . . . . . . . . DNA1 4 . H6 parsed_2n60 1
129 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 1
129 1 2 . . . . . . . . DNA1 1 . H4' parsed_2n60 1
130 1 1 . . . . . . . . DNA1 2 . H4' parsed_2n60 1
130 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 1
131 1 1 . . . . . . . . DNA1 1 . H7# parsed_2n60 1
131 1 2 . . . . . . . . DNA1 7 . H1' parsed_2n60 1
132 1 1 . . . . . . . . DNA1 18 . H7# parsed_2n60 1
132 1 2 . . . . . . . . DNA1 17 . H1' parsed_2n60 1
133 1 1 . . . . . . . . DNA1 18 . H7# parsed_2n60 1
133 1 2 . . . . . . . . DNA1 17 . H2' parsed_2n60 1
134 1 1 . . . . . . . . DNA1 18 . H7# parsed_2n60 1
134 1 2 . . . . . . . . DNA1 17 . H2'' parsed_2n60 1
135 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 1
135 1 2 . . . . . . . . DNA1 2 . H2'' parsed_2n60 1
136 1 1 . . . . . . . . DNA1 3 . H5* parsed_2n60 1
136 1 2 . . . . . . . . DNA1 3 . H8 parsed_2n60 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 . . . . . 2.40 1.80 3.00 parsed_2n60 1
2 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
3 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
4 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
5 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
6 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
7 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
8 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
9 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
10 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
11 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
12 1 . . . . . 3.20 1.80 4.60 parsed_2n60 1
13 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
14 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
15 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
16 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
17 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
18 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
19 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
20 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
21 1 . . . . . 3.20 1.80 4.60 parsed_2n60 1
22 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
23 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
24 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
25 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
26 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
27 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
28 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
29 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
30 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
31 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
32 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
33 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
34 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
35 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
36 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
37 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
38 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
39 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
40 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
41 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
42 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
43 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
44 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
45 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
46 1 . . . . . 3.20 1.80 4.60 parsed_2n60 1
47 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
48 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
49 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
50 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
51 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
52 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
53 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
54 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
55 1 . . . . . 3.20 1.80 4.60 parsed_2n60 1
56 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
57 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
58 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
59 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
60 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
61 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
62 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
63 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
64 1 . . . . . 3.20 1.80 4.60 parsed_2n60 1
65 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
66 1 . . . . . 6.00 4.50 7.50 parsed_2n60 1
67 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
68 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
69 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
70 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
71 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
72 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
73 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
74 1 . . . . . 3.20 1.80 4.60 parsed_2n60 1
75 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
76 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
77 1 . . . . . 3.75 3.00 4.50 parsed_2n60 1
78 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
79 1 . . . . . 3.80 2.85 4.75 parsed_2n60 1
80 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
81 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
82 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
83 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
84 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
85 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
86 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
87 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
88 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
89 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
90 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
91 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
92 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
93 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
94 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
95 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
96 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
97 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
98 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
99 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
100 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
101 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
102 1 . . . . . 5.00 3.00 7.00 parsed_2n60 1
103 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
104 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
105 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
106 1 . . . . . 2.40 1.80 3.00 parsed_2n60 1
107 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
108 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
109 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
110 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
111 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
112 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
113 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
114 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
115 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
116 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
117 1 . . . . . 5.50 3.50 7.50 parsed_2n60 1
118 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
119 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
120 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
121 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
122 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
123 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
124 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
125 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
126 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
127 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
128 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
129 1 . . . . . 4.00 3.00 5.00 parsed_2n60 1
130 1 . . . . . 4.80 3.60 6.00 parsed_2n60 1
131 1 . . . . . 5.00 3.00 7.00 parsed_2n60 1
132 1 . . . . . 5.00 4.00 6.00 parsed_2n60 1
133 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
134 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
135 1 . . . . . 5.00 3.00 7.00 parsed_2n60 1
136 1 . . . . . 3.00 2.25 3.75 parsed_2n60 1
stop_
save_
save_MR_file_comment_3
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2n60
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 3
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
::::::::::::::
dihe.tbl
::::::::::::::
;
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2n60
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . DNA1 3 . O4' DNA1 3 . C1' DNA1 3 . N9 DNA1 3 . C4 parsed_2n60 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 5 . O4' DNA1 5 . C1' DNA1 5 . N9 DNA1 5 . C4 parsed_2n60 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 7 . O4' DNA1 7 . C1' DNA1 7 . N9 DNA1 7 . C4 parsed_2n60 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 8 . O4' DNA1 8 . C1' DNA1 8 . N9 DNA1 8 . C4 parsed_2n60 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 9 . O4' DNA1 9 . C1' DNA1 9 . N9 DNA1 9 . C4 parsed_2n60 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 15 . O4' DNA1 15 . C1' DNA1 15 . N9 DNA1 15 . C4 parsed_2n60 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 16 . O4' DNA1 16 . C1' DNA1 16 . N9 DNA1 16 . C4 parsed_2n60 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 17 . O4' DNA1 17 . C1' DNA1 17 . N9 DNA1 17 . C4 parsed_2n60 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 11 . O4' DNA1 11 . C1' DNA1 11 . N9 DNA1 11 . C4 parsed_2n60 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 12 . O4' DNA1 12 . C1' DNA1 12 . N9 DNA1 12 . C4 parsed_2n60 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 200.0 280.0 . DNA1 13 . O4' DNA1 13 . C1' DNA1 13 . N9 DNA1 13 . C4 parsed_2n60 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 chi 1 1 1 5 parsed_2n60 1
stop_
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2n60
_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
;
::::::::::::::
H2O.tbl
::::::::::::::
;
save_
save_CNS/XPLOR_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2n60
_Distance_constraint_list.ID 2
_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_2n60 2
2 1 . . . parsed_2n60 2
3 1 . . . parsed_2n60 2
4 1 . . . parsed_2n60 2
5 1 . . . parsed_2n60 2
6 1 . . . parsed_2n60 2
7 1 . . . parsed_2n60 2
8 1 . . . parsed_2n60 2
9 1 . . . parsed_2n60 2
10 1 . . . parsed_2n60 2
11 1 . . . parsed_2n60 2
12 1 . . . parsed_2n60 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 . . . . . . . . DNA1 1 . H7# parsed_2n60 2
1 1 2 . . . . . . . . DNA1 7 . H1 parsed_2n60 2
2 1 1 . . . . . . . . DNA1 1 . H6 parsed_2n60 2
2 1 2 . . . . . . . . DNA1 7 . H1 parsed_2n60 2
3 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 2
3 1 2 . . . . . . . . DNA1 3 . H1 parsed_2n60 2
4 1 1 . . . . . . . . DNA1 2 . H6 parsed_2n60 2
4 1 2 . . . . . . . . DNA1 15 . H1 parsed_2n60 2
5 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 2
5 1 2 . . . . . . . . DNA1 11 . H1 parsed_2n60 2
6 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 2
6 1 2 . . . . . . . . DNA1 15 . H1 parsed_2n60 2
7 1 1 . . . . . . . . DNA1 2 . H7# parsed_2n60 2
7 1 2 . . . . . . . . DNA1 3 . H1 parsed_2n60 2
8 1 1 . . . . . . . . DNA1 7 . H1 parsed_2n60 2
8 1 2 . . . . . . . . DNA1 8 . H1 parsed_2n60 2
9 1 1 . . . . . . . . DNA1 9 . H1 parsed_2n60 2
9 1 2 . . . . . . . . DNA1 8 . H1 parsed_2n60 2
10 1 1 . . . . . . . . DNA1 11 . H1 parsed_2n60 2
10 1 2 . . . . . . . . DNA1 12 . H1 parsed_2n60 2
11 1 1 . . . . . . . . DNA1 1 . H2' parsed_2n60 2
11 1 2 . . . . . . . . DNA1 3 . H1 parsed_2n60 2
12 1 1 . . . . . . . . DNA1 1 . H2'' parsed_2n60 2
12 1 2 . . . . . . . . DNA1 3 . H1 parsed_2n60 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 . . . . . 4.20 3.00 5.40 parsed_2n60 2
2 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
3 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
4 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
5 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
6 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
7 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
8 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
9 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
10 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
11 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
12 1 . . . . . 4.20 3.00 5.40 parsed_2n60 2
stop_
save_
save_MR_file_comment_7
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2n60
_Org_constr_file_comment.ID 4
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 7
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
::::::::::::::
hbond.tbl
::::::::::::::
;
save_
save_CNS/XPLOR_distance_constraints_8
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2n60
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 8
_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_2n60 3
2 1 . . . parsed_2n60 3
3 1 . . . parsed_2n60 3
4 1 . . . parsed_2n60 3
5 1 . . . parsed_2n60 3
6 1 . . . parsed_2n60 3
7 1 . . . parsed_2n60 3
8 1 . . . parsed_2n60 3
9 1 . . . parsed_2n60 3
10 1 . . . parsed_2n60 3
11 1 . . . parsed_2n60 3
12 1 . . . parsed_2n60 3
13 1 . . . parsed_2n60 3
14 1 . . . parsed_2n60 3
15 1 . . . parsed_2n60 3
16 1 . . . parsed_2n60 3
17 1 . . . parsed_2n60 3
18 1 . . . parsed_2n60 3
19 1 . . . parsed_2n60 3
20 1 . . . parsed_2n60 3
21 1 . . . parsed_2n60 3
22 1 . . . parsed_2n60 3
23 1 . . . parsed_2n60 3
24 1 . . . parsed_2n60 3
25 1 . . . parsed_2n60 3
26 1 . . . parsed_2n60 3
27 1 . . . parsed_2n60 3
28 1 . . . parsed_2n60 3
29 1 . . . parsed_2n60 3
30 1 . . . parsed_2n60 3
31 1 . . . parsed_2n60 3
32 1 . . . parsed_2n60 3
33 1 . . . parsed_2n60 3
34 1 . . . parsed_2n60 3
35 1 . . . parsed_2n60 3
36 1 . . . parsed_2n60 3
37 1 . . . parsed_2n60 3
38 1 . . . parsed_2n60 3
39 1 . . . parsed_2n60 3
40 1 . . . parsed_2n60 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 . . . . . . . . DNA1 3 . H21 parsed_2n60 3
1 1 2 . . . . . . . . DNA1 7 . N7 parsed_2n60 3
2 1 1 . . . . . . . . DNA1 3 . N2 parsed_2n60 3
2 1 2 . . . . . . . . DNA1 7 . N7 parsed_2n60 3
3 1 1 . . . . . . . . DNA1 3 . H1 parsed_2n60 3
3 1 2 . . . . . . . . DNA1 7 . O6 parsed_2n60 3
4 1 1 . . . . . . . . DNA1 3 . N1 parsed_2n60 3
4 1 2 . . . . . . . . DNA1 7 . O6 parsed_2n60 3
5 1 1 . . . . . . . . DNA1 7 . H21 parsed_2n60 3
5 1 2 . . . . . . . . DNA1 11 . N7 parsed_2n60 3
6 1 1 . . . . . . . . DNA1 7 . N2 parsed_2n60 3
6 1 2 . . . . . . . . DNA1 11 . N7 parsed_2n60 3
7 1 1 . . . . . . . . DNA1 7 . H1 parsed_2n60 3
7 1 2 . . . . . . . . DNA1 11 . O6 parsed_2n60 3
8 1 1 . . . . . . . . DNA1 7 . N1 parsed_2n60 3
8 1 2 . . . . . . . . DNA1 11 . O6 parsed_2n60 3
9 1 1 . . . . . . . . DNA1 11 . H21 parsed_2n60 3
9 1 2 . . . . . . . . DNA1 15 . N7 parsed_2n60 3
10 1 1 . . . . . . . . DNA1 11 . N2 parsed_2n60 3
10 1 2 . . . . . . . . DNA1 15 . N7 parsed_2n60 3
11 1 1 . . . . . . . . DNA1 11 . H1 parsed_2n60 3
11 1 2 . . . . . . . . DNA1 15 . O6 parsed_2n60 3
12 1 1 . . . . . . . . DNA1 11 . N1 parsed_2n60 3
12 1 2 . . . . . . . . DNA1 15 . O6 parsed_2n60 3
13 1 1 . . . . . . . . DNA1 15 . H21 parsed_2n60 3
13 1 2 . . . . . . . . DNA1 3 . N7 parsed_2n60 3
14 1 1 . . . . . . . . DNA1 15 . N2 parsed_2n60 3
14 1 2 . . . . . . . . DNA1 3 . N7 parsed_2n60 3
15 1 1 . . . . . . . . DNA1 15 . H1 parsed_2n60 3
15 1 2 . . . . . . . . DNA1 3 . O6 parsed_2n60 3
16 1 1 . . . . . . . . DNA1 15 . N1 parsed_2n60 3
16 1 2 . . . . . . . . DNA1 3 . O6 parsed_2n60 3
17 1 1 . . . . . . . . DNA1 5 . H21 parsed_2n60 3
17 1 2 . . . . . . . . DNA1 8 . N7 parsed_2n60 3
18 1 1 . . . . . . . . DNA1 5 . N2 parsed_2n60 3
18 1 2 . . . . . . . . DNA1 8 . N7 parsed_2n60 3
19 1 1 . . . . . . . . DNA1 5 . H1 parsed_2n60 3
19 1 2 . . . . . . . . DNA1 8 . O6 parsed_2n60 3
20 1 1 . . . . . . . . DNA1 5 . N1 parsed_2n60 3
20 1 2 . . . . . . . . DNA1 8 . O6 parsed_2n60 3
21 1 1 . . . . . . . . DNA1 8 . H21 parsed_2n60 3
21 1 2 . . . . . . . . DNA1 12 . N7 parsed_2n60 3
22 1 1 . . . . . . . . DNA1 8 . N2 parsed_2n60 3
22 1 2 . . . . . . . . DNA1 12 . N7 parsed_2n60 3
23 1 1 . . . . . . . . DNA1 8 . H1 parsed_2n60 3
23 1 2 . . . . . . . . DNA1 12 . O6 parsed_2n60 3
24 1 1 . . . . . . . . DNA1 8 . N1 parsed_2n60 3
24 1 2 . . . . . . . . DNA1 12 . O6 parsed_2n60 3
25 1 1 . . . . . . . . DNA1 12 . H21 parsed_2n60 3
25 1 2 . . . . . . . . DNA1 16 . N7 parsed_2n60 3
26 1 1 . . . . . . . . DNA1 12 . N2 parsed_2n60 3
26 1 2 . . . . . . . . DNA1 16 . N7 parsed_2n60 3
27 1 1 . . . . . . . . DNA1 12 . H1 parsed_2n60 3
27 1 2 . . . . . . . . DNA1 16 . O6 parsed_2n60 3
28 1 1 . . . . . . . . DNA1 12 . N1 parsed_2n60 3
28 1 2 . . . . . . . . DNA1 16 . O6 parsed_2n60 3
29 1 1 . . . . . . . . DNA1 16 . H21 parsed_2n60 3
29 1 2 . . . . . . . . DNA1 5 . N7 parsed_2n60 3
30 1 1 . . . . . . . . DNA1 16 . N2 parsed_2n60 3
30 1 2 . . . . . . . . DNA1 5 . N7 parsed_2n60 3
31 1 1 . . . . . . . . DNA1 16 . H1 parsed_2n60 3
31 1 2 . . . . . . . . DNA1 5 . O6 parsed_2n60 3
32 1 1 . . . . . . . . DNA1 16 . N1 parsed_2n60 3
32 1 2 . . . . . . . . DNA1 5 . O6 parsed_2n60 3
33 1 1 . . . . . . . . DNA1 9 . H21 parsed_2n60 3
33 1 2 . . . . . . . . DNA1 13 . N7 parsed_2n60 3
34 1 1 . . . . . . . . DNA1 9 . N2 parsed_2n60 3
34 1 2 . . . . . . . . DNA1 13 . N7 parsed_2n60 3
35 1 1 . . . . . . . . DNA1 9 . H1 parsed_2n60 3
35 1 2 . . . . . . . . DNA1 13 . O6 parsed_2n60 3
36 1 1 . . . . . . . . DNA1 9 . N1 parsed_2n60 3
36 1 2 . . . . . . . . DNA1 13 . O6 parsed_2n60 3
37 1 1 . . . . . . . . DNA1 13 . H21 parsed_2n60 3
37 1 2 . . . . . . . . DNA1 17 . N7 parsed_2n60 3
38 1 1 . . . . . . . . DNA1 13 . N2 parsed_2n60 3
38 1 2 . . . . . . . . DNA1 17 . N7 parsed_2n60 3
39 1 1 . . . . . . . . DNA1 13 . H1 parsed_2n60 3
39 1 2 . . . . . . . . DNA1 17 . O6 parsed_2n60 3
40 1 1 . . . . . . . . DNA1 13 . N1 parsed_2n60 3
40 1 2 . . . . . . . . DNA1 17 . O6 parsed_2n60 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 . . . . . 2.00 1.80 2.20 parsed_2n60 3
2 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
3 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
4 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
5 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
6 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
7 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
8 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
9 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
10 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
11 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
12 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
13 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
14 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
15 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
16 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
17 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
18 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
19 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
20 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
21 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
22 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
23 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
24 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
25 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
26 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
27 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
28 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
29 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
30 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
31 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
32 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
33 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
34 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
35 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
36 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
37 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
38 1 . . . . . 2.90 2.60 3.20 parsed_2n60 3
39 1 . . . . . 2.00 1.80 2.20 parsed_2n60 3
40 1 . . . . . 2.90 2.60 3.20 parsed_2n60 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
;
G3 G21 G17 G9
===================
;
1 1 2 22 parsed_2n60 3
2
;
G4 G10 G16 G22
====================
;
45 1 46 23 parsed_2n60 3
3
;
G5 G11 G15 G23
====================
;
88 1 89 23 parsed_2n60 3
stop_
save_
save_MR_file_comment_9
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2n60
_Org_constr_file_comment.ID 5
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 9
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
::::::::::::::
repl.tbl
::::::::::::::
;
save_
save_CNS/XPLOR_distance_constraints_10
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2n60
_Distance_constraint_list.ID 4
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 10
_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_2n60 4
2 1 . . . parsed_2n60 4
3 1 . . . parsed_2n60 4
4 1 . . . parsed_2n60 4
5 1 . . . parsed_2n60 4
6 1 . . . parsed_2n60 4
7 1 . . . parsed_2n60 4
8 1 . . . parsed_2n60 4
9 1 . . . parsed_2n60 4
10 1 . . . parsed_2n60 4
11 1 . . . parsed_2n60 4
12 1 . . . parsed_2n60 4
13 1 . . . parsed_2n60 4
14 1 . . . parsed_2n60 4
15 1 . . . parsed_2n60 4
16 1 . . . parsed_2n60 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 . . . . . . . . DNA1 4 . C7 parsed_2n60 4
1 1 2 . . . . . . . . DNA1 1 . H4' parsed_2n60 4
2 1 1 . . . . . . . . DNA1 4 . C7 parsed_2n60 4
2 1 2 . . . . . . . . DNA1 1 . H1' parsed_2n60 4
3 1 1 . . . . . . . . DNA1 6 . H1' parsed_2n60 4
3 1 2 . . . . . . . . DNA1 7 . H3' parsed_2n60 4
4 1 1 . . . . . . . . DNA1 10 . H1' parsed_2n60 4
4 1 2 . . . . . . . . DNA1 11 . H3' parsed_2n60 4
5 1 1 . . . . . . . . DNA1 14 . H1' parsed_2n60 4
5 1 2 . . . . . . . . DNA1 15 . H3' parsed_2n60 4
6 1 1 . . . . . . . . DNA1 5 . H1' parsed_2n60 4
6 1 2 . . . . . . . . DNA1 6 . H4' parsed_2n60 4
7 1 1 . . . . . . . . DNA1 9 . H1' parsed_2n60 4
7 1 2 . . . . . . . . DNA1 10 . H4' parsed_2n60 4
8 1 1 . . . . . . . . DNA1 13 . H1' parsed_2n60 4
8 1 2 . . . . . . . . DNA1 14 . H4' parsed_2n60 4
9 1 1 . . . . . . . . DNA1 5 . H5' parsed_2n60 4
9 1 2 . . . . . . . . DNA1 6 . H6 parsed_2n60 4
10 1 1 . . . . . . . . DNA1 9 . H5' parsed_2n60 4
10 1 2 . . . . . . . . DNA1 10 . H6 parsed_2n60 4
11 1 1 . . . . . . . . DNA1 13 . H5' parsed_2n60 4
11 1 2 . . . . . . . . DNA1 14 . H6 parsed_2n60 4
12 1 1 . . . . . . . . DNA1 5 . H5'' parsed_2n60 4
12 1 2 . . . . . . . . DNA1 6 . H6 parsed_2n60 4
13 1 1 . . . . . . . . DNA1 9 . H5'' parsed_2n60 4
13 1 2 . . . . . . . . DNA1 10 . H6 parsed_2n60 4
14 1 1 . . . . . . . . DNA1 13 . H5'' parsed_2n60 4
14 1 2 . . . . . . . . DNA1 14 . H6 parsed_2n60 4
15 1 1 . . . . . . . . DNA1 3 . H2'' parsed_2n60 4
15 1 2 . . . . . . . . DNA1 4 . H1' parsed_2n60 4
16 1 1 . . . . . . . . DNA1 5 . H3' parsed_2n60 4
16 1 2 . . . . . . . . DNA1 4 . H1' parsed_2n60 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 . . . . . 7.50 5.00 82.50 parsed_2n60 4
2 1 . . . . . 7.50 5.00 82.50 parsed_2n60 4
3 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
4 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
5 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
6 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
7 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
8 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
9 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
10 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
11 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
12 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
13 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
14 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
15 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
16 1 . . . . . 7.50 5.00 79.50 parsed_2n60 4
stop_
save_
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