NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
39150 |
1sp2   |
cing | 2-parsed | STAR | entry | full | 147 |
data_1sp2_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1sp2
_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_1sp2 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1sp2
_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 1sp2 "Master copy" parsed_1sp2
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1sp2
_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 1sp2.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1sp2 1
1 1sp2.mr . . XPLOR/CNS 2 distance NOE simple 137 parsed_1sp2 1
1 1sp2.mr . . XPLOR/CNS 3 distance "general distance" simple 10 parsed_1sp2 1
1 1sp2.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1sp2 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_1sp2
_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 ZINC FINGER 21-NOV-96 1SP2
*TITLE NMR STRUCTURE OF A ZINC FINGER DOMAIN FROM TRANSCRIPTION
*TITLE 2 FACTOR SP1F2, MINIMIZED AVERAGE STRUCTURE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: SP1F2;
*COMPND 3 CHAIN: NULL;
*COMPND 4 FRAGMENT: ZINC FINGER DNA BINDING DOMAIN;
*COMPND 5 SYNONYM: TRANSCRIPTION FACTOR SP1;
*COMPND 6 ENGINEERED: YES;
*COMPND 7 OTHER_DETAILS: DOES NOT BIND DNA SPECIFICALLY AS A SINGLE
*COMPND 8 ZINC FINGER
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 4 ORGANISM_COMMON: HUMAN;
*SOURCE 5 CELLULAR_LOCATION: NUCLEOPLASM
*KEYWDS ZINC FINGER, TRANSCRIPTION ACTIVATION, SP1
*EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE
*AUTHOR V.A.NARAYAN,R.W.KRIWACKI,J.P.CARADONNA
*REVDAT 1 21-APR-97 1SP2 0
XPLOR input for Sp1f2 structure calculation
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1sp2
_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_1sp2 1
2 1 . . . parsed_1sp2 1
3 1 . . . parsed_1sp2 1
4 1 . . . parsed_1sp2 1
5 1 . . . parsed_1sp2 1
6 1 . . . parsed_1sp2 1
7 1 . . . parsed_1sp2 1
8 1 . . . parsed_1sp2 1
9 1 . . . parsed_1sp2 1
10 1 . . . parsed_1sp2 1
11 1 . . . parsed_1sp2 1
12 1 . . . parsed_1sp2 1
13 1 . . . parsed_1sp2 1
14 1 . . . parsed_1sp2 1
15 1 . . . parsed_1sp2 1
16 1 . . . parsed_1sp2 1
17 1 . . . parsed_1sp2 1
18 1 . . . parsed_1sp2 1
19 1 . . . parsed_1sp2 1
20 1 . . . parsed_1sp2 1
21 1 . . . parsed_1sp2 1
22 1 . . . parsed_1sp2 1
23 1 . . . parsed_1sp2 1
24 1 . . . parsed_1sp2 1
25 1 . . . parsed_1sp2 1
26 1 . . . parsed_1sp2 1
27 1 . . . parsed_1sp2 1
28 1 . . . parsed_1sp2 1
29 1 . . . parsed_1sp2 1
30 1 . . . parsed_1sp2 1
31 1 . . . parsed_1sp2 1
32 1 . . . parsed_1sp2 1
33 1 . . . parsed_1sp2 1
34 1 . . . parsed_1sp2 1
35 1 . . . parsed_1sp2 1
36 1 . . . parsed_1sp2 1
37 1 . . . parsed_1sp2 1
38 1 . . . parsed_1sp2 1
39 1 . . . parsed_1sp2 1
40 1 . . . parsed_1sp2 1
41 1 . . . parsed_1sp2 1
42 1 . . . parsed_1sp2 1
43 1 . . . parsed_1sp2 1
44 1 . . . parsed_1sp2 1
45 1 . . . parsed_1sp2 1
46 1 . . . parsed_1sp2 1
47 1 . . . parsed_1sp2 1
48 1 . . . parsed_1sp2 1
49 1 . . . parsed_1sp2 1
50 1 . . . parsed_1sp2 1
51 1 . . . parsed_1sp2 1
52 1 . . . parsed_1sp2 1
53 1 . . . parsed_1sp2 1
54 1 . . . parsed_1sp2 1
55 1 . . . parsed_1sp2 1
56 1 . . . parsed_1sp2 1
57 1 . . . parsed_1sp2 1
58 1 . . . parsed_1sp2 1
59 1 . . . parsed_1sp2 1
60 1 . . . parsed_1sp2 1
61 1 . . . parsed_1sp2 1
62 1 . . . parsed_1sp2 1
63 1 . . . parsed_1sp2 1
64 1 . . . parsed_1sp2 1
65 1 . . . parsed_1sp2 1
66 1 . . . parsed_1sp2 1
67 1 . . . parsed_1sp2 1
68 1 . . . parsed_1sp2 1
69 1 . . . parsed_1sp2 1
70 1 . . . parsed_1sp2 1
71 1 . . . parsed_1sp2 1
72 1 . . . parsed_1sp2 1
73 1 . . . parsed_1sp2 1
74 1 . . . parsed_1sp2 1
75 1 . . . parsed_1sp2 1
76 1 . . . parsed_1sp2 1
77 1 . . . parsed_1sp2 1
78 1 . . . parsed_1sp2 1
79 1 . . . parsed_1sp2 1
80 1 . . . parsed_1sp2 1
81 1 . . . parsed_1sp2 1
82 1 . . . parsed_1sp2 1
83 1 . . . parsed_1sp2 1
84 1 . . . parsed_1sp2 1
85 1 . . . parsed_1sp2 1
86 1 . . . parsed_1sp2 1
87 1 . . . parsed_1sp2 1
88 1 . . . parsed_1sp2 1
89 1 . . . parsed_1sp2 1
90 1 . . . parsed_1sp2 1
91 1 . . . parsed_1sp2 1
92 1 . . . parsed_1sp2 1
93 1 . . . parsed_1sp2 1
94 1 . . . parsed_1sp2 1
95 1 . . . parsed_1sp2 1
96 1 . . . parsed_1sp2 1
97 1 . . . parsed_1sp2 1
98 1 . . . parsed_1sp2 1
99 1 . . . parsed_1sp2 1
100 1 . . . parsed_1sp2 1
101 1 . . . parsed_1sp2 1
102 1 . . . parsed_1sp2 1
103 1 . . . parsed_1sp2 1
104 1 . . . parsed_1sp2 1
105 1 . . . parsed_1sp2 1
106 1 . . . parsed_1sp2 1
107 1 . . . parsed_1sp2 1
108 1 . . . parsed_1sp2 1
109 1 . . . parsed_1sp2 1
110 1 . . . parsed_1sp2 1
111 1 . . . parsed_1sp2 1
112 1 . . . parsed_1sp2 1
113 1 . . . parsed_1sp2 1
114 1 . . . parsed_1sp2 1
115 1 . . . parsed_1sp2 1
116 1 . . . parsed_1sp2 1
117 1 . . . parsed_1sp2 1
118 1 . . . parsed_1sp2 1
119 1 . . . parsed_1sp2 1
120 1 . . . parsed_1sp2 1
121 1 . . . parsed_1sp2 1
122 1 . . . parsed_1sp2 1
123 1 . . . parsed_1sp2 1
124 1 . . . parsed_1sp2 1
125 1 . . . parsed_1sp2 1
126 1 . . . parsed_1sp2 1
127 1 . . . parsed_1sp2 1
128 1 . . . parsed_1sp2 1
129 1 . . . parsed_1sp2 1
130 1 . . . parsed_1sp2 1
131 1 . . . parsed_1sp2 1
132 1 . . . parsed_1sp2 1
133 1 . . . parsed_1sp2 1
134 1 . . . parsed_1sp2 1
135 1 . . . parsed_1sp2 1
136 1 . . . parsed_1sp2 1
137 1 . . . parsed_1sp2 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 . . . . . . . . . 28 . hn parsed_1sp2 1
1 1 2 . . . . . . . . . 27 . hn parsed_1sp2 1
2 1 1 . . . . . . . . . 18 . hn parsed_1sp2 1
2 1 2 . . . . . . . . . 17 . hn parsed_1sp2 1
3 1 1 . . . . . . . . . 27 . he1 parsed_1sp2 1
3 1 2 . . . . . . . . . 7 . hd1 parsed_1sp2 1
4 1 1 . . . . . . . . . 10 . hn parsed_1sp2 1
4 1 2 . . . . . . . . . 7 . hd1 parsed_1sp2 1
5 1 1 . . . . . . . . . 3 . hb* parsed_1sp2 1
5 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
6 1 1 . . . . . . . . . 5 . hb2 parsed_1sp2 1
6 1 2 . . . . . . . . . 20 . hd2* parsed_1sp2 1
7 1 1 . . . . . . . . . 17 . ha parsed_1sp2 1
7 1 2 . . . . . . . . . 20 . hg parsed_1sp2 1
8 1 1 . . . . . . . . . 23 . ha parsed_1sp2 1
8 1 2 . . . . . . . . . 26 . hg2* parsed_1sp2 1
9 1 1 . . . . . . . . . 21 . ha parsed_1sp2 1
9 1 2 . . . . . . . . . 24 . hb* parsed_1sp2 1
10 1 1 . . . . . . . . . 5 . hb2 parsed_1sp2 1
10 1 2 . . . . . . . . . 20 . hg parsed_1sp2 1
11 1 1 . . . . . . . . . 14 . hb2 parsed_1sp2 1
11 1 2 . . . . . . . . . 20 . hg parsed_1sp2 1
12 1 1 . . . . . . . . . 18 . ha parsed_1sp2 1
12 1 2 . . . . . . . . . 21 . hg* parsed_1sp2 1
13 1 1 . . . . . . . . . 18 . ha parsed_1sp2 1
13 1 2 . . . . . . . . . 21 . hb* parsed_1sp2 1
14 1 1 . . . . . . . . . 10 . hb2 parsed_1sp2 1
14 1 2 . . . . . . . . . 7 . hb1 parsed_1sp2 1
15 1 1 . . . . . . . . . 23 . hd2 parsed_1sp2 1
15 1 2 . . . . . . . . . 5 . hb1 parsed_1sp2 1
16 1 1 . . . . . . . . . 23 . hn parsed_1sp2 1
16 1 2 . . . . . . . . . 20 . ha parsed_1sp2 1
17 1 1 . . . . . . . . . 26 . hn parsed_1sp2 1
17 1 2 . . . . . . . . . 25 . ha parsed_1sp2 1
18 1 1 . . . . . . . . . 31 . hn parsed_1sp2 1
18 1 2 . . . . . . . . . 30 . ha parsed_1sp2 1
19 1 1 . . . . . . . . . 8 . hn parsed_1sp2 1
19 1 2 . . . . . . . . . 7 . hb1 parsed_1sp2 1
20 1 1 . . . . . . . . . 21 . hn parsed_1sp2 1
20 1 2 . . . . . . . . . 20 . hb* parsed_1sp2 1
21 1 1 . . . . . . . . . 17 . hn parsed_1sp2 1
21 1 2 . . . . . . . . . 16 . hb* parsed_1sp2 1
22 1 1 . . . . . . . . . 17 . hn parsed_1sp2 1
22 1 2 . . . . . . . . . 16 . hg* parsed_1sp2 1
23 1 1 . . . . . . . . . 3 . hn parsed_1sp2 1
23 1 2 . . . . . . . . . 2 . hb* parsed_1sp2 1
24 1 1 . . . . . . . . . 3 . hn parsed_1sp2 1
24 1 2 . . . . . . . . . 2 . hb* parsed_1sp2 1
25 1 1 . . . . . . . . . 23 . hd2 parsed_1sp2 1
25 1 2 . . . . . . . . . 5 . hb2 parsed_1sp2 1
26 1 1 . . . . . . . . . 20 . hn parsed_1sp2 1
26 1 2 . . . . . . . . . 19 . hb* parsed_1sp2 1
27 1 1 . . . . . . . . . 25 . hn parsed_1sp2 1
27 1 2 . . . . . . . . . 24 . ha parsed_1sp2 1
28 1 1 . . . . . . . . . 20 . hn parsed_1sp2 1
28 1 2 . . . . . . . . . 19 . ha parsed_1sp2 1
29 1 1 . . . . . . . . . 27 . hn parsed_1sp2 1
29 1 2 . . . . . . . . . 26 . ha parsed_1sp2 1
30 1 1 . . . . . . . . . 27 . hn parsed_1sp2 1
30 1 2 . . . . . . . . . 25 . ha parsed_1sp2 1
31 1 1 . . . . . . . . . 3 . hd* parsed_1sp2 1
31 1 2 . . . . . . . . . 2 . ha parsed_1sp2 1
32 1 1 . . . . . . . . . 3 . hd* parsed_1sp2 1
32 1 2 . . . . . . . . . 15 . ha parsed_1sp2 1
33 1 1 . . . . . . . . . 14 . hd* parsed_1sp2 1
33 1 2 . . . . . . . . . 13 . ha parsed_1sp2 1
34 1 1 . . . . . . . . . 3 . he* parsed_1sp2 1
34 1 2 . . . . . . . . . 17 . ha parsed_1sp2 1
35 1 1 . . . . . . . . . 3 . he* parsed_1sp2 1
35 1 2 . . . . . . . . . 17 . hb* parsed_1sp2 1
36 1 1 . . . . . . . . . 3 . he* parsed_1sp2 1
36 1 2 . . . . . . . . . 17 . hb* parsed_1sp2 1
37 1 1 . . . . . . . . . 3 . he* parsed_1sp2 1
37 1 2 . . . . . . . . . 16 . ha parsed_1sp2 1
38 1 1 . . . . . . . . . 7 . hz2 parsed_1sp2 1
38 1 2 . . . . . . . . . 27 . hb1 parsed_1sp2 1
39 1 1 . . . . . . . . . 28 . hn parsed_1sp2 1
39 1 2 . . . . . . . . . 27 . hb* parsed_1sp2 1
40 1 1 . . . . . . . . . 28 . hn parsed_1sp2 1
40 1 2 . . . . . . . . . 27 . hb1 parsed_1sp2 1
41 1 1 . . . . . . . . . 28 . hn parsed_1sp2 1
41 1 2 . . . . . . . . . 27 . hb* parsed_1sp2 1
42 1 1 . . . . . . . . . 28 . hn parsed_1sp2 1
42 1 2 . . . . . . . . . 25 . ha parsed_1sp2 1
43 1 1 . . . . . . . . . 16 . hn parsed_1sp2 1
43 1 2 . . . . . . . . . 14 . hb* parsed_1sp2 1
44 1 1 . . . . . . . . . 16 . hn parsed_1sp2 1
44 1 2 . . . . . . . . . 15 . hb* parsed_1sp2 1
45 1 1 . . . . . . . . . 16 . hn parsed_1sp2 1
45 1 2 . . . . . . . . . 15 . ha parsed_1sp2 1
46 1 1 . . . . . . . . . 27 . he1 parsed_1sp2 1
46 1 2 . . . . . . . . . 7 . hb1 parsed_1sp2 1
47 1 1 . . . . . . . . . 27 . he1 parsed_1sp2 1
47 1 2 . . . . . . . . . 7 . hb2 parsed_1sp2 1
48 1 1 . . . . . . . . . 27 . he1 parsed_1sp2 1
48 1 2 . . . . . . . . . 10 . hb2 parsed_1sp2 1
49 1 1 . . . . . . . . . 27 . he1 parsed_1sp2 1
49 1 2 . . . . . . . . . 10 . hb1 parsed_1sp2 1
50 1 1 . . . . . . . . . 12 . hn parsed_1sp2 1
50 1 2 . . . . . . . . . 5 . hb2 parsed_1sp2 1
51 1 1 . . . . . . . . . 12 . hn parsed_1sp2 1
51 1 2 . . . . . . . . . 5 . hb1 parsed_1sp2 1
52 1 1 . . . . . . . . . 29 . hn parsed_1sp2 1
52 1 2 . . . . . . . . . 28 . ha parsed_1sp2 1
53 1 1 . . . . . . . . . 13 . hn parsed_1sp2 1
53 1 2 . . . . . . . . . 12 . ha parsed_1sp2 1
54 1 1 . . . . . . . . . 30 . hn parsed_1sp2 1
54 1 2 . . . . . . . . . 29 . ha* parsed_1sp2 1
55 1 1 . . . . . . . . . 30 . hn parsed_1sp2 1
55 1 2 . . . . . . . . . 29 . ha* parsed_1sp2 1
56 1 1 . . . . . . . . . 8 . hn parsed_1sp2 1
56 1 2 . . . . . . . . . 7 . ha parsed_1sp2 1
57 1 1 . . . . . . . . . 21 . hn parsed_1sp2 1
57 1 2 . . . . . . . . . 18 . ha parsed_1sp2 1
58 1 1 . . . . . . . . . 10 . hn parsed_1sp2 1
58 1 2 . . . . . . . . . 9 . ha parsed_1sp2 1
59 1 1 . . . . . . . . . 21 . hn parsed_1sp2 1
59 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
60 1 1 . . . . . . . . . 29 . hn parsed_1sp2 1
60 1 2 . . . . . . . . . 28 . hg* parsed_1sp2 1
61 1 1 . . . . . . . . . 21 . hn parsed_1sp2 1
61 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
62 1 1 . . . . . . . . . 11 . hn parsed_1sp2 1
62 1 2 . . . . . . . . . 10 . hb2 parsed_1sp2 1
63 1 1 . . . . . . . . . 11 . hn parsed_1sp2 1
63 1 2 . . . . . . . . . 10 . hb1 parsed_1sp2 1
64 1 1 . . . . . . . . . 9 . hn parsed_1sp2 1
64 1 2 . . . . . . . . . 8 . hb* parsed_1sp2 1
65 1 1 . . . . . . . . . 9 . hn parsed_1sp2 1
65 1 2 . . . . . . . . . 8 . ha parsed_1sp2 1
66 1 1 . . . . . . . . . 10 . hn parsed_1sp2 1
66 1 2 . . . . . . . . . 8 . ha parsed_1sp2 1
67 1 1 . . . . . . . . . 3 . hn parsed_1sp2 1
67 1 2 . . . . . . . . . 2 . ha parsed_1sp2 1
68 1 1 . . . . . . . . . 17 . hn parsed_1sp2 1
68 1 2 . . . . . . . . . 16 . ha parsed_1sp2 1
69 1 1 . . . . . . . . . 5 . hn parsed_1sp2 1
69 1 2 . . . . . . . . . 13 . ha parsed_1sp2 1
70 1 1 . . . . . . . . . 5 . hn parsed_1sp2 1
70 1 2 . . . . . . . . . 4 . ha parsed_1sp2 1
71 1 1 . . . . . . . . . 14 . hn parsed_1sp2 1
71 1 2 . . . . . . . . . 13 . ha parsed_1sp2 1
72 1 1 . . . . . . . . . 4 . hn parsed_1sp2 1
72 1 2 . . . . . . . . . 13 . ha parsed_1sp2 1
73 1 1 . . . . . . . . . 7 . hn parsed_1sp2 1
73 1 2 . . . . . . . . . 6 . ha parsed_1sp2 1
74 1 1 . . . . . . . . . 18 . hn parsed_1sp2 1
74 1 2 . . . . . . . . . 17 . hb* parsed_1sp2 1
75 1 1 . . . . . . . . . 18 . hn parsed_1sp2 1
75 1 2 . . . . . . . . . 17 . hb* parsed_1sp2 1
76 1 1 . . . . . . . . . 24 . hn parsed_1sp2 1
76 1 2 . . . . . . . . . 21 . ha parsed_1sp2 1
77 1 1 . . . . . . . . . 24 . hn parsed_1sp2 1
77 1 2 . . . . . . . . . 23 . hb2 parsed_1sp2 1
78 1 1 . . . . . . . . . 24 . hn parsed_1sp2 1
78 1 2 . . . . . . . . . 23 . hb1 parsed_1sp2 1
79 1 1 . . . . . . . . . 18 . hn parsed_1sp2 1
79 1 2 . . . . . . . . . 17 . ha parsed_1sp2 1
80 1 1 . . . . . . . . . 14 . hn parsed_1sp2 1
80 1 2 . . . . . . . . . 13 . hb* parsed_1sp2 1
81 1 1 . . . . . . . . . 5 . hn parsed_1sp2 1
81 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
82 1 1 . . . . . . . . . 5 . hn parsed_1sp2 1
82 1 2 . . . . . . . . . 4 . hg* parsed_1sp2 1
83 1 1 . . . . . . . . . 5 . hn parsed_1sp2 1
83 1 2 . . . . . . . . . 4 . hg* parsed_1sp2 1
84 1 1 . . . . . . . . . 15 . hn parsed_1sp2 1
84 1 2 . . . . . . . . . 14 . hb1 parsed_1sp2 1
85 1 1 . . . . . . . . . 27 . hd2 parsed_1sp2 1
85 1 2 . . . . . . . . . 7 . hb2 parsed_1sp2 1
86 1 1 . . . . . . . . . 27 . hd2 parsed_1sp2 1
86 1 2 . . . . . . . . . 24 . ha parsed_1sp2 1
87 1 1 . . . . . . . . . 24 . hn parsed_1sp2 1
87 1 2 . . . . . . . . . 25 . hn parsed_1sp2 1
88 1 1 . . . . . . . . . 24 . hn parsed_1sp2 1
88 1 2 . . . . . . . . . 23 . hn parsed_1sp2 1
89 1 1 . . . . . . . . . 26 . hn parsed_1sp2 1
89 1 2 . . . . . . . . . 27 . hn parsed_1sp2 1
90 1 1 . . . . . . . . . 26 . hn parsed_1sp2 1
90 1 2 . . . . . . . . . 25 . ha parsed_1sp2 1
91 1 1 . . . . . . . . . 29 . hn parsed_1sp2 1
91 1 2 . . . . . . . . . 28 . hn parsed_1sp2 1
92 1 1 . . . . . . . . . 21 . hn parsed_1sp2 1
92 1 2 . . . . . . . . . 20 . hn parsed_1sp2 1
93 1 1 . . . . . . . . . 21 . hn parsed_1sp2 1
93 1 2 . . . . . . . . . 22 . hn parsed_1sp2 1
94 1 1 . . . . . . . . . 15 . hn parsed_1sp2 1
94 1 2 . . . . . . . . . 16 . hn parsed_1sp2 1
95 1 1 . . . . . . . . . 17 . hn parsed_1sp2 1
95 1 2 . . . . . . . . . 21 . he* parsed_1sp2 1
96 1 1 . . . . . . . . . 11 . hn parsed_1sp2 1
96 1 2 . . . . . . . . . 10 . hn parsed_1sp2 1
97 1 1 . . . . . . . . . 11 . hn parsed_1sp2 1
97 1 2 . . . . . . . . . 12 . hn parsed_1sp2 1
98 1 1 . . . . . . . . . 8 . hn parsed_1sp2 1
98 1 2 . . . . . . . . . 7 . hd1 parsed_1sp2 1
99 1 1 . . . . . . . . . 15 . hn parsed_1sp2 1
99 1 2 . . . . . . . . . 14 . hb2 parsed_1sp2 1
100 1 1 . . . . . . . . . 24 . hn parsed_1sp2 1
100 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
101 1 1 . . . . . . . . . 27 . hd2 parsed_1sp2 1
101 1 2 . . . . . . . . . 24 . hb* parsed_1sp2 1
102 1 1 . . . . . . . . . 27 . hd2 parsed_1sp2 1
102 1 2 . . . . . . . . . 24 . hb* parsed_1sp2 1
103 1 1 . . . . . . . . . 23 . hd2 parsed_1sp2 1
103 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
104 1 1 . . . . . . . . . 3 . hd* parsed_1sp2 1
104 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
105 1 1 . . . . . . . . . 14 . hd* parsed_1sp2 1
105 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
106 1 1 . . . . . . . . . 14 . hd* parsed_1sp2 1
106 1 2 . . . . . . . . . 20 . hg parsed_1sp2 1
107 1 1 . . . . . . . . . 14 . he* parsed_1sp2 1
107 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
108 1 1 . . . . . . . . . 14 . he* parsed_1sp2 1
108 1 2 . . . . . . . . . 20 . hg parsed_1sp2 1
109 1 1 . . . . . . . . . 14 . hz parsed_1sp2 1
109 1 2 . . . . . . . . . 23 . hb* parsed_1sp2 1
110 1 1 . . . . . . . . . 14 . hz parsed_1sp2 1
110 1 2 . . . . . . . . . 23 . hb* parsed_1sp2 1
111 1 1 . . . . . . . . . 14 . he* parsed_1sp2 1
111 1 2 . . . . . . . . . 5 . hb1 parsed_1sp2 1
112 1 1 . . . . . . . . . 14 . he* parsed_1sp2 1
112 1 2 . . . . . . . . . 5 . hb2 parsed_1sp2 1
113 1 1 . . . . . . . . . 14 . he* parsed_1sp2 1
113 1 2 . . . . . . . . . 20 . ha parsed_1sp2 1
114 1 1 . . . . . . . . . 5 . hn parsed_1sp2 1
114 1 2 . . . . . . . . . 14 . he* parsed_1sp2 1
115 1 1 . . . . . . . . . 19 . hn parsed_1sp2 1
115 1 2 . . . . . . . . . 16 . hg* parsed_1sp2 1
116 1 1 . . . . . . . . . 14 . hd* parsed_1sp2 1
116 1 2 . . . . . . . . . 20 . ha parsed_1sp2 1
117 1 1 . . . . . . . . . 14 . hd* parsed_1sp2 1
117 1 2 . . . . . . . . . 19 . hb* parsed_1sp2 1
118 1 1 . . . . . . . . . 14 . hd* parsed_1sp2 1
118 1 2 . . . . . . . . . 19 . hb* parsed_1sp2 1
119 1 1 . . . . . . . . . 14 . hz parsed_1sp2 1
119 1 2 . . . . . . . . . 12 . hg* parsed_1sp2 1
120 1 1 . . . . . . . . . 14 . hz parsed_1sp2 1
120 1 2 . . . . . . . . . 12 . hd* parsed_1sp2 1
121 1 1 . . . . . . . . . 27 . hn parsed_1sp2 1
121 1 2 . . . . . . . . . 24 . ha parsed_1sp2 1
122 1 1 . . . . . . . . . 22 . ha parsed_1sp2 1
122 1 2 . . . . . . . . . 25 . hn parsed_1sp2 1
123 1 1 . . . . . . . . . 23 . he1 parsed_1sp2 1
123 1 2 . . . . . . . . . 14 . hz parsed_1sp2 1
124 1 1 . . . . . . . . . 23 . he1 parsed_1sp2 1
124 1 2 . . . . . . . . . 14 . he* parsed_1sp2 1
125 1 1 . . . . . . . . . 23 . hd2 parsed_1sp2 1
125 1 2 . . . . . . . . . 27 . hd2 parsed_1sp2 1
126 1 1 . . . . . . . . . 4 . hn parsed_1sp2 1
126 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
127 1 1 . . . . . . . . . 22 . hn parsed_1sp2 1
127 1 2 . . . . . . . . . 23 . hn parsed_1sp2 1
128 1 1 . . . . . . . . . 19 . ha parsed_1sp2 1
128 1 2 . . . . . . . . . 22 . hn parsed_1sp2 1
129 1 1 . . . . . . . . . 23 . ha parsed_1sp2 1
129 1 2 . . . . . . . . . 26 . hn parsed_1sp2 1
130 1 1 . . . . . . . . . 20 . hn parsed_1sp2 1
130 1 2 . . . . . . . . . 17 . ha parsed_1sp2 1
131 1 1 . . . . . . . . . 23 . hb1 parsed_1sp2 1
131 1 2 . . . . . . . . . 24 . ha parsed_1sp2 1
132 1 1 . . . . . . . . . 14 . hb1 parsed_1sp2 1
132 1 2 . . . . . . . . . 19 . hb* parsed_1sp2 1
133 1 1 . . . . . . . . . 14 . hb1 parsed_1sp2 1
133 1 2 . . . . . . . . . 19 . hg* parsed_1sp2 1
134 1 1 . . . . . . . . . 5 . ha parsed_1sp2 1
134 1 2 . . . . . . . . . 20 . hd* parsed_1sp2 1
135 1 1 . . . . . . . . . 16 . hb* parsed_1sp2 1
135 1 2 . . . . . . . . . 19 . hn parsed_1sp2 1
136 1 1 . . . . . . . . . 10 . hb1 parsed_1sp2 1
136 1 2 . . . . . . . . . 7 . hb1 parsed_1sp2 1
137 1 1 . . . . . . . . . 10 . hb1 parsed_1sp2 1
137 1 2 . . . . . . . . . 7 . hb2 parsed_1sp2 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 . . . . . 2.579 2.180 2.978 parsed_1sp2 1
2 1 . . . . . 3.717 2.888 4.546 parsed_1sp2 1
3 1 . . . . . 3.087 2.515 3.659 parsed_1sp2 1
4 1 . . . . . 3.789 2.928 4.650 parsed_1sp2 1
5 1 . . . . . 2.934 0.117 5.751 parsed_1sp2 1
6 1 . . . . . 3.018 0.972 5.064 parsed_1sp2 1
7 1 . . . . . 2.936 2.419 3.453 parsed_1sp2 1
8 1 . . . . . 3.634 1.342 5.926 parsed_1sp2 1
9 1 . . . . . 3.168 1.766 4.570 parsed_1sp2 1
10 1 . . . . . 3.704 2.881 4.527 parsed_1sp2 1
11 1 . . . . . 3.391 2.701 4.081 parsed_1sp2 1
12 1 . . . . . 3.900 2.187 5.613 parsed_1sp2 1
13 1 . . . . . 2.769 1.509 4.029 parsed_1sp2 1
14 1 . . . . . 3.005 2.463 3.547 parsed_1sp2 1
15 1 . . . . . 2.942 2.423 3.461 parsed_1sp2 1
16 1 . . . . . 3.112 2.531 3.693 parsed_1sp2 1
17 1 . . . . . 2.910 2.402 3.418 parsed_1sp2 1
18 1 . . . . . 2.517 2.137 2.897 parsed_1sp2 1
19 1 . . . . . 3.533 2.784 4.282 parsed_1sp2 1
20 1 . . . . . 2.868 1.574 4.162 parsed_1sp2 1
21 1 . . . . . 3.600 2.022 5.178 parsed_1sp2 1
22 1 . . . . . 3.037 1.684 4.390 parsed_1sp2 1
23 1 . . . . . 3.306 1.850 4.762 parsed_1sp2 1
24 1 . . . . . 3.798 2.133 5.463 parsed_1sp2 1
25 1 . . . . . 2.591 2.188 2.994 parsed_1sp2 1
26 1 . . . . . 2.893 1.591 4.195 parsed_1sp2 1
27 1 . . . . . 2.722 2.277 3.567 parsed_1sp2 1
28 1 . . . . . 3.376 2.692 4.060 parsed_1sp2 1
29 1 . . . . . 2.972 2.442 3.502 parsed_1sp2 1
30 1 . . . . . 3.271 2.629 3.913 parsed_1sp2 1
31 1 . . . . . 3.162 0.562 5.762 parsed_1sp2 1
32 1 . . . . . 2.828 0.348 5.308 parsed_1sp2 1
33 1 . . . . . 3.026 0.477 5.575 parsed_1sp2 1
34 1 . . . . . 2.817 0.341 5.293 parsed_1sp2 1
35 1 . . . . . 2.833 -0.449 6.115 parsed_1sp2 1
36 1 . . . . . 2.780 -0.484 6.044 parsed_1sp2 1
37 1 . . . . . 3.043 0.487 5.599 parsed_1sp2 1
38 1 . . . . . 3.072 2.506 3.638 parsed_1sp2 1
39 1 . . . . . 3.324 1.861 4.787 parsed_1sp2 1
40 1 . . . . . 3.324 2.661 3.987 parsed_1sp2 1
41 1 . . . . . 2.936 1.619 4.253 parsed_1sp2 1
42 1 . . . . . 3.107 2.528 3.686 parsed_1sp2 1
43 1 . . . . . 2.791 1.524 4.058 parsed_1sp2 1
44 1 . . . . . 2.942 1.623 4.261 parsed_1sp2 1
45 1 . . . . . 3.332 2.666 3.998 parsed_1sp2 1
46 1 . . . . . 3.258 2.621 3.895 parsed_1sp2 1
47 1 . . . . . 3.528 2.781 4.275 parsed_1sp2 1
48 1 . . . . . 2.717 2.274 3.160 parsed_1sp2 1
49 1 . . . . . 3.072 2.506 3.638 parsed_1sp2 1
50 1 . . . . . 3.305 2.650 3.960 parsed_1sp2 1
51 1 . . . . . 3.165 2.564 3.766 parsed_1sp2 1
52 1 . . . . . 2.746 2.294 3.198 parsed_1sp2 1
53 1 . . . . . 2.331 2.005 2.657 parsed_1sp2 1
54 1 . . . . . 3.287 2.639 3.935 parsed_1sp2 1
55 1 . . . . . 3.170 2.567 3.773 parsed_1sp2 1
56 1 . . . . . 2.406 2.059 2.753 parsed_1sp2 1
57 1 . . . . . 3.111 2.530 3.692 parsed_1sp2 1
58 1 . . . . . 3.034 2.482 3.586 parsed_1sp2 1
59 1 . . . . . 3.907 1.491 6.323 parsed_1sp2 1
60 1 . . . . . 3.972 1.525 6.419 parsed_1sp2 1
61 1 . . . . . 3.719 1.389 6.049 parsed_1sp2 1
62 1 . . . . . 2.880 2.382 3.378 parsed_1sp2 1
63 1 . . . . . 2.639 2.221 3.057 parsed_1sp2 1
64 1 . . . . . 3.110 1.730 4.490 parsed_1sp2 1
65 1 . . . . . 2.418 2.067 2.769 parsed_1sp2 1
66 1 . . . . . 3.563 2.801 4.325 parsed_1sp2 1
67 1 . . . . . 2.588 2.186 2.990 parsed_1sp2 1
68 1 . . . . . 2.762 2.304 3.220 parsed_1sp2 1
69 1 . . . . . 3.690 2.873 4.507 parsed_1sp2 1
70 1 . . . . . 2.839 2.355 3.323 parsed_1sp2 1
71 1 . . . . . 2.901 2.396 3.406 parsed_1sp2 1
72 1 . . . . . 3.924 3.000 4.848 parsed_1sp2 1
73 1 . . . . . 2.955 2.431 3.479 parsed_1sp2 1
74 1 . . . . . 3.028 1.678 4.378 parsed_1sp2 1
75 1 . . . . . 3.347 1.875 4.819 parsed_1sp2 1
76 1 . . . . . 3.328 2.663 3.993 parsed_1sp2 1
77 1 . . . . . 3.447 2.734 4.160 parsed_1sp2 1
78 1 . . . . . 2.860 2.369 3.351 parsed_1sp2 1
79 1 . . . . . 3.482 2.755 4.209 parsed_1sp2 1
80 1 . . . . . 3.005 1.663 4.347 parsed_1sp2 1
81 1 . . . . . 3.158 1.060 5.256 parsed_1sp2 1
82 1 . . . . . 3.727 2.094 5.360 parsed_1sp2 1
83 1 . . . . . 3.805 2.136 5.474 parsed_1sp2 1
84 1 . . . . . 2.837 2.354 3.320 parsed_1sp2 1
85 1 . . . . . 3.115 2.533 3.697 parsed_1sp2 1
86 1 . . . . . 2.450 2.090 2.810 parsed_1sp2 1
87 1 . . . . . 2.611 2.202 3.020 parsed_1sp2 1
88 1 . . . . . 2.851 2.363 3.339 parsed_1sp2 1
89 1 . . . . . 2.663 2.238 3.088 parsed_1sp2 1
90 1 . . . . . 2.820 2.343 3.297 parsed_1sp2 1
91 1 . . . . . 2.780 2.316 3.244 parsed_1sp2 1
92 1 . . . . . 2.756 2.300 3.212 parsed_1sp2 1
93 1 . . . . . 2.993 2.456 3.530 parsed_1sp2 1
94 1 . . . . . 2.774 2.312 3.236 parsed_1sp2 1
95 1 . . . . . 3.143 1.350 4.936 parsed_1sp2 1
96 1 . . . . . 2.690 2.256 3.124 parsed_1sp2 1
97 1 . . . . . 2.989 2.453 3.525 parsed_1sp2 1
98 1 . . . . . 3.399 2.706 4.092 parsed_1sp2 1
99 1 . . . . . 3.282 2.636 3.928 parsed_1sp2 1
100 1 . . . . . 3.692 1.374 6.010 parsed_1sp2 1
101 1 . . . . . 3.596 2.020 5.172 parsed_1sp2 1
102 1 . . . . . 3.501 1.966 5.036 parsed_1sp2 1
103 1 . . . . . 2.964 0.937 4.991 parsed_1sp2 1
104 1 . . . . . 2.980 -1.052 7.012 parsed_1sp2 1
105 1 . . . . . 2.980 -1.052 7.012 parsed_1sp2 1
106 1 . . . . . 2.740 0.290 5.190 parsed_1sp2 1
107 1 . . . . . 3.070 -0.995 7.135 parsed_1sp2 1
108 1 . . . . . 2.713 0.271 5.155 parsed_1sp2 1
109 1 . . . . . 2.939 1.621 4.257 parsed_1sp2 1
110 1 . . . . . 3.032 1.680 4.384 parsed_1sp2 1
111 1 . . . . . 3.221 0.599 5.843 parsed_1sp2 1
112 1 . . . . . 2.880 0.383 5.377 parsed_1sp2 1
113 1 . . . . . 2.962 0.436 5.488 parsed_1sp2 1
114 1 . . . . . 3.612 0.829 6.395 parsed_1sp2 1
115 1 . . . . . 2.939 1.621 4.257 parsed_1sp2 1
116 1 . . . . . 2.965 0.438 5.492 parsed_1sp2 1
117 1 . . . . . 2.727 -0.519 5.973 parsed_1sp2 1
118 1 . . . . . 2.632 -0.583 5.847 parsed_1sp2 1
119 1 . . . . . 3.078 1.710 4.446 parsed_1sp2 1
120 1 . . . . . 3.293 1.842 4.744 parsed_1sp2 1
121 1 . . . . . 3.327 2.663 3.991 parsed_1sp2 1
122 1 . . . . . 3.438 2.729 4.147 parsed_1sp2 1
123 1 . . . . . 3.312 2.654 3.970 parsed_1sp2 1
124 1 . . . . . 3.387 0.699 6.075 parsed_1sp2 1
125 1 . . . . . 3.044 2.488 3.600 parsed_1sp2 1
126 1 . . . . . 3.692 1.374 6.010 parsed_1sp2 1
127 1 . . . . . 2.822 2.344 3.300 parsed_1sp2 1
128 1 . . . . . 3.368 2.687 4.049 parsed_1sp2 1
129 1 . . . . . 3.368 2.687 4.049 parsed_1sp2 1
130 1 . . . . . 2.971 2.441 3.501 parsed_1sp2 1
131 1 . . . . . 3.352 2.678 4.026 parsed_1sp2 1
132 1 . . . . . 2.893 1.591 4.195 parsed_1sp2 1
133 1 . . . . . 3.156 1.759 4.553 parsed_1sp2 1
134 1 . . . . . 2.622 0.710 4.534 parsed_1sp2 1
135 1 . . . . . 2.662 1.437 3.887 parsed_1sp2 1
136 1 . . . . . 2.932 2.416 3.448 parsed_1sp2 1
137 1 . . . . . 3.079 2.510 3.648 parsed_1sp2 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 "0.000t h" 1 81 1 92 parsed_1sp2 1
2 "0.000d s" 2 81 2 92 parsed_1sp2 1
3 "0.000h w" 3 81 3 92 parsed_1sp2 1
4 "0.000c w" 4 81 4 92 parsed_1sp2 1
5 "0.000f l" 5 81 5 92 parsed_1sp2 1
6 "0.000c l" 6 81 6 92 parsed_1sp2 1
7 "0.000s l" 8 81 8 92 parsed_1sp2 1
8 "0.000h t" 9 81 9 92 parsed_1sp2 1
9 "0.000q k" 10 81 10 92 parsed_1sp2 1
10 "0.000c l" 11 81 11 92 parsed_1sp2 1
11 "0.000f l" 13 81 13 92 parsed_1sp2 1
12 "0.000d q" 15 81 15 92 parsed_1sp2 1
13 "0.000d q" 16 81 16 92 parsed_1sp2 1
14 "0.000c w" 17 81 17 92 parsed_1sp2 1
15 "0.000h c" 19 81 19 92 parsed_1sp2 1
16 "0.000h l" 21 81 21 92 parsed_1sp2 1
17 "0.000t r" 22 81 22 92 parsed_1sp2 1
18 "0.000k e" 23 81 23 92 parsed_1sp2 1
19 "0.000s w" 24 81 24 92 parsed_1sp2 1
20 "0.000q l" 26 81 26 92 parsed_1sp2 1
21 "0.000s r" 27 81 27 92 parsed_1sp2 1
22 "0.000s r" 28 81 28 92 parsed_1sp2 1
23 "0.000f p" 29 81 29 92 parsed_1sp2 1
24 "1.000f p" 30 81 30 92 parsed_1sp2 1
25 "0.000h c" 31 81 31 92 parsed_1sp2 1
26 "0.000l e" 33 81 33 92 parsed_1sp2 1
27 "0.000r k" 34 81 34 92 parsed_1sp2 1
28 "0.000l e" 35 81 35 92 parsed_1sp2 1
29 "0.000h t" 36 81 36 92 parsed_1sp2 1
30 "0.000h r" 37 81 37 92 parsed_1sp2 1
31 "0.000f p" 38 81 38 92 parsed_1sp2 1
32 "0.000f t" 39 81 39 92 parsed_1sp2 1
33 "0.000f r" 40 81 40 92 parsed_1sp2 1
34 "0.000f s" 41 81 41 92 parsed_1sp2 1
35 "1.000f s" 42 81 42 92 parsed_1sp2 1
36 "1.000f s" 43 81 43 92 parsed_1sp2 1
37 "0.000f r" 44 81 44 92 parsed_1sp2 1
38 "0.000w h" 45 81 45 92 parsed_1sp2 1
39 "0.000t h" 47 81 47 92 parsed_1sp2 1
40 "0.000t h" 48 81 48 92 parsed_1sp2 1
41 "0.000t h" 50 81 50 92 parsed_1sp2 1
42 "0.000t r" 51 81 51 92 parsed_1sp2 1
43 "0.000r f" 52 81 52 92 parsed_1sp2 1
44 "0.000r t" 53 81 53 92 parsed_1sp2 1
45 "0.000r t" 54 81 54 92 parsed_1sp2 1
46 "0.000h w" 55 81 55 92 parsed_1sp2 1
47 "0.000h w" 57 81 57 92 parsed_1sp2 1
48 "0.000h c" 59 81 59 92 parsed_1sp2 1
49 "0.000h c" 60 81 60 92 parsed_1sp2 1
50 "0.000k c" 62 81 62 92 parsed_1sp2 1
51 "0.000k c" 64 81 64 92 parsed_1sp2 1
52 "0.000g t" 66 81 66 92 parsed_1sp2 1
53 "0.000r k" 67 81 67 92 parsed_1sp2 1
54 "0.000e g" 68 81 68 92 parsed_1sp2 1
55 "0.000e g" 69 81 69 92 parsed_1sp2 1
56 "1.000s w" 70 81 70 92 parsed_1sp2 1
57 "0.000q d" 71 81 71 92 parsed_1sp2 1
58 "0.000c y" 72 81 72 92 parsed_1sp2 1
59 "0.000q l" 73 81 73 92 parsed_1sp2 1
60 "0.000g t" 74 81 74 92 parsed_1sp2 1
61 "0.000q l" 75 81 75 92 parsed_1sp2 1
62 "0.000g c" 76 81 76 92 parsed_1sp2 1
63 "0.000g c" 78 81 78 92 parsed_1sp2 1
64 "0.000y s" 80 81 80 92 parsed_1sp2 1
65 "0.000y s" 81 81 81 92 parsed_1sp2 1
66 "0.000c s" 82 81 82 92 parsed_1sp2 1
67 "0.000f p" 83 81 83 92 parsed_1sp2 1
68 "1.000 r" 84 81 84 92 parsed_1sp2 1
69 "0.000c r" 85 81 85 92 parsed_1sp2 1
70 "0.000c m" 86 81 86 92 parsed_1sp2 1
71 "0.000f r" 87 81 87 92 parsed_1sp2 1
72 "0.000m r" 88 81 88 92 parsed_1sp2 1
73 "0.000w t" 89 81 89 92 parsed_1sp2 1
74 "0.000d s" 90 81 90 92 parsed_1sp2 1
75 "0.000d s" 91 81 91 92 parsed_1sp2 1
76 "0.000k q" 92 81 92 92 parsed_1sp2 1
77 "0.000k h" 93 81 93 92 parsed_1sp2 1
78 "0.000k h" 95 81 95 92 parsed_1sp2 1
79 "0.000d s" 97 81 97 92 parsed_1sp2 1
80 "0.000f r" 98 81 98 92 parsed_1sp2 1
81 "0.000c l" 99 81 99 92 parsed_1sp2 1
82 "0.000c m" 100 81 100 92 parsed_1sp2 1
83 "0.000c m" 101 81 101 92 parsed_1sp2 1
84 "1.000t f" 102 81 102 92 parsed_1sp2 1
85 "0.000h w" 104 81 104 92 parsed_1sp2 1
86 "0.000h k" 105 81 105 92 parsed_1sp2 1
87 "0.000k r" 106 81 106 92 parsed_1sp2 1
88 "0.000k h" 107 81 107 92 parsed_1sp2 1
89 "0.000t h" 108 81 108 92 parsed_1sp2 1
90 "0.000t r" 109 81 109 92 parsed_1sp2 1
91 "0.000g t" 110 81 110 92 parsed_1sp2 1
92 "0.000q l" 111 81 111 92 parsed_1sp2 1
93 "0.000q r" 112 81 112 92 parsed_1sp2 1
94 "0.000t r" 113 81 113 92 parsed_1sp2 1
95 "0.000s f" 114 81 114 92 parsed_1sp2 1
96 "0.000g c" 115 81 115 92 parsed_1sp2 1
97 "0.000g k" 116 81 116 92 parsed_1sp2 1
98 "0.000s w" 117 81 117 92 parsed_1sp2 1
99 "0.000t f" 118 81 118 92 parsed_1sp2 1
100 "0.000k l" 120 81 120 92 parsed_1sp2 1
101 "0.000h k" 121 81 121 92 parsed_1sp2 1
102 "0.000h k" 122 81 122 92 parsed_1sp2 1
103 "0.000h l" 123 81 123 92 parsed_1sp2 1
104 "0.000f l" 124 81 124 92 parsed_1sp2 1
105 "0.000f l" 125 81 125 92 parsed_1sp2 1
106 "0.000f l" 127 81 127 92 parsed_1sp2 1
107 "0.000f l" 128 81 128 92 parsed_1sp2 1
108 "0.000f l" 130 81 130 92 parsed_1sp2 1
109 "0.000f h" 131 81 131 92 parsed_1sp2 1
110 "0.000f h" 132 81 132 92 parsed_1sp2 1
111 "0.000f c" 133 81 133 92 parsed_1sp2 1
112 "0.000f c" 135 81 135 92 parsed_1sp2 1
113 "0.000f l" 137 81 137 92 parsed_1sp2 1
114 "0.000c f" 138 81 138 92 parsed_1sp2 1
115 "0.000e r" 139 81 139 92 parsed_1sp2 1
116 "0.000f l" 140 81 140 92 parsed_1sp2 1
117 "1.000f e" 141 81 141 92 parsed_1sp2 1
118 "1.000f e" 142 81 142 92 parsed_1sp2 1
119 "0.000f k" 144 81 144 92 parsed_1sp2 1
120 "0.000f k" 145 81 145 92 parsed_1sp2 1
121 "0.000h k" 146 81 146 92 parsed_1sp2 1
122 "0.000r r" 147 81 147 92 parsed_1sp2 1
123 "0.000h f" 148 81 148 92 parsed_1sp2 1
124 "0.000h f" 149 81 149 92 parsed_1sp2 1
125 "0.000h h" 150 81 150 92 parsed_1sp2 1
126 "0.000m l" 151 81 151 92 parsed_1sp2 1
127 "0.000r h" 152 81 152 92 parsed_1sp2 1
128 "0.000e r" 153 81 153 92 parsed_1sp2 1
129 "0.000h t" 154 81 154 92 parsed_1sp2 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1sp2
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "general distance"
_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_1sp2 2
2 1 . . . parsed_1sp2 2
3 1 . . . parsed_1sp2 2
4 1 . . . parsed_1sp2 2
5 1 . . . parsed_1sp2 2
6 1 . . . parsed_1sp2 2
7 1 . . . parsed_1sp2 2
8 1 . . . parsed_1sp2 2
9 1 . . . parsed_1sp2 2
10 1 . . . parsed_1sp2 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 5 . sg parsed_1sp2 2
1 1 2 . . . . . . . . . 1 . zn parsed_1sp2 2
2 1 1 . . . . . . . . . 10 . sg parsed_1sp2 2
2 1 2 . . . . . . . . . 1 . zn parsed_1sp2 2
3 1 1 . . . . . . . . . 23 . ne2 parsed_1sp2 2
3 1 2 . . . . . . . . . 1 . zn parsed_1sp2 2
4 1 1 . . . . . . . . . 27 . ne2 parsed_1sp2 2
4 1 2 . . . . . . . . . 1 . zn parsed_1sp2 2
5 1 1 . . . . . . . . . 5 . sg parsed_1sp2 2
5 1 2 . . . . . . . . . 10 . sg parsed_1sp2 2
6 1 1 . . . . . . . . . 23 . ne2 parsed_1sp2 2
6 1 2 . . . . . . . . . 27 . ne2 parsed_1sp2 2
7 1 1 . . . . . . . . . 5 . sg parsed_1sp2 2
7 1 2 . . . . . . . . . 23 . ne2 parsed_1sp2 2
8 1 1 . . . . . . . . . 10 . sg parsed_1sp2 2
8 1 2 . . . . . . . . . 27 . ne2 parsed_1sp2 2
9 1 1 . . . . . . . . . 5 . sg parsed_1sp2 2
9 1 2 . . . . . . . . . 27 . ne2 parsed_1sp2 2
10 1 1 . . . . . . . . . 10 . sg parsed_1sp2 2
10 1 2 . . . . . . . . . 23 . ne2 parsed_1sp2 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 . . . . . 2.300 2.250 2.350 parsed_1sp2 2
2 1 . . . . . 2.300 2.250 2.350 parsed_1sp2 2
3 1 . . . . . 2.085 2.035 2.135 parsed_1sp2 2
4 1 . . . . . 2.085 2.035 2.135 parsed_1sp2 2
5 1 . . . . . 3.701 3.418 3.984 parsed_1sp2 2
6 1 . . . . . 3.354 3.098 3.610 parsed_1sp2 2
7 1 . . . . . 3.530 3.261 3.799 parsed_1sp2 2
8 1 . . . . . 3.530 3.261 3.799 parsed_1sp2 2
9 1 . . . . . 3.530 3.261 3.799 parsed_1sp2 2
10 1 . . . . . 3.530 3.261 3.799 parsed_1sp2 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 "0.00 c zn" 1 83 1 95 parsed_1sp2 2
2 "0.00 c zn" 2 83 2 94 parsed_1sp2 2
3 "0.00 h zn" 3 83 3 94 parsed_1sp2 2
4 "0.00 h zn" 4 83 4 94 parsed_1sp2 2
stop_
save_
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