NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
496069 |
2l2x   |
17154 | cing | 2-parsed | STAR | entry | full | 167 |
data_2l2x_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2l2x
_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_2l2x 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2l2x
_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 2l2x "Master copy" parsed_2l2x
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2l2x
_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 2l2x.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2l2x 1
1 2l2x.mr . . XPLOR/CNS 2 distance NOE simple 159 parsed_2l2x 1
1 2l2x.mr . . XPLOR/CNS 3 distance NOE ambi 8 parsed_2l2x 1
1 2l2x.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2l2x 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_2l2x
_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 ANTIBIOTIC 27-AUG-10 2L2X
*TITLE THIOSTREPTON, OXIDIZED AT CA-CB BOND OF RESIDUE 9
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: THIOSTREPTON;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: RESIDUES 1-16;
*COMPND 5 SYNONYM: ALANINAMIDE, BRYAMYCIN, GARGON, THIACTIN;
*COMPND 6 MUTATION: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES AZUREUS;
*SOURCE 3 ORGANISM_TAXID: 146537
*KEYWDS NATURAL ANTIBIOTIC, THIOPEPTIDE, ANTIBIOTIC, ANTIMICROBIAL,
*KEYWDS 2 ANTIBACTERIAL, THIAZOLE, THIAZOLINE
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR H.R.A.JONKER, S.BAUMANN, A.WOLF, S.SCHOOF, F.HILLER, K.W.SCHULTE,
*AUTHOR 2 K.N.KIRSCHNER, H.SCHWALBE, H.-D.ARNDT
*REVDAT 1 02-FEB-11 2L2X 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2l2x
_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_2l2x 1
2 1 . . . parsed_2l2x 1
3 1 . . . parsed_2l2x 1
4 1 . . . parsed_2l2x 1
5 1 . . . parsed_2l2x 1
6 1 . . . parsed_2l2x 1
7 1 . . . parsed_2l2x 1
8 1 . . . parsed_2l2x 1
9 1 . . . parsed_2l2x 1
10 1 . . . parsed_2l2x 1
11 1 . . . parsed_2l2x 1
12 1 . . . parsed_2l2x 1
13 1 . . . parsed_2l2x 1
14 1 . . . parsed_2l2x 1
15 1 . . . parsed_2l2x 1
16 1 . . . parsed_2l2x 1
17 1 . . . parsed_2l2x 1
18 1 . . . parsed_2l2x 1
19 1 . . . parsed_2l2x 1
20 1 . . . parsed_2l2x 1
21 1 . . . parsed_2l2x 1
22 1 . . . parsed_2l2x 1
23 1 . . . parsed_2l2x 1
24 1 . . . parsed_2l2x 1
25 1 . . . parsed_2l2x 1
26 1 . . . parsed_2l2x 1
27 1 . . . parsed_2l2x 1
28 1 . . . parsed_2l2x 1
29 1 . . . parsed_2l2x 1
30 1 . . . parsed_2l2x 1
31 1 . . . parsed_2l2x 1
32 1 . . . parsed_2l2x 1
33 1 . . . parsed_2l2x 1
34 1 . . . parsed_2l2x 1
35 1 . . . parsed_2l2x 1
36 1 . . . parsed_2l2x 1
37 1 . . . parsed_2l2x 1
38 1 . . . parsed_2l2x 1
39 1 . . . parsed_2l2x 1
40 1 . . . parsed_2l2x 1
41 1 . . . parsed_2l2x 1
42 1 . . . parsed_2l2x 1
43 1 . . . parsed_2l2x 1
44 1 . . . parsed_2l2x 1
45 1 . . . parsed_2l2x 1
46 1 . . . parsed_2l2x 1
47 1 . . . parsed_2l2x 1
48 1 . . . parsed_2l2x 1
49 1 . . . parsed_2l2x 1
50 1 . . . parsed_2l2x 1
51 1 . . . parsed_2l2x 1
52 1 . . . parsed_2l2x 1
53 1 . . . parsed_2l2x 1
54 1 . . . parsed_2l2x 1
55 1 . . . parsed_2l2x 1
56 1 . . . parsed_2l2x 1
57 1 . . . parsed_2l2x 1
58 1 . . . parsed_2l2x 1
59 1 . . . parsed_2l2x 1
60 1 . . . parsed_2l2x 1
61 1 . . . parsed_2l2x 1
62 1 . . . parsed_2l2x 1
63 1 . . . parsed_2l2x 1
64 1 . . . parsed_2l2x 1
65 1 . . . parsed_2l2x 1
66 1 . . . parsed_2l2x 1
67 1 . . . parsed_2l2x 1
68 1 . . . parsed_2l2x 1
69 1 . . . parsed_2l2x 1
70 1 . . . parsed_2l2x 1
71 1 . . . parsed_2l2x 1
72 1 . . . parsed_2l2x 1
73 1 . . . parsed_2l2x 1
74 1 . . . parsed_2l2x 1
75 1 . . . parsed_2l2x 1
76 1 . . . parsed_2l2x 1
77 1 . . . parsed_2l2x 1
78 1 . . . parsed_2l2x 1
79 1 . . . parsed_2l2x 1
80 1 . . . parsed_2l2x 1
81 1 . . . parsed_2l2x 1
82 1 . . . parsed_2l2x 1
83 1 . . . parsed_2l2x 1
84 1 . . . parsed_2l2x 1
85 1 . . . parsed_2l2x 1
86 1 . . . parsed_2l2x 1
87 1 . . . parsed_2l2x 1
88 1 . . . parsed_2l2x 1
89 1 . . . parsed_2l2x 1
90 1 . . . parsed_2l2x 1
91 1 . . . parsed_2l2x 1
92 1 . . . parsed_2l2x 1
93 1 . . . parsed_2l2x 1
94 1 . . . parsed_2l2x 1
95 1 . . . parsed_2l2x 1
96 1 . . . parsed_2l2x 1
97 1 . . . parsed_2l2x 1
98 1 . . . parsed_2l2x 1
99 1 . . . parsed_2l2x 1
100 1 . . . parsed_2l2x 1
101 1 . . . parsed_2l2x 1
102 1 . . . parsed_2l2x 1
103 1 . . . parsed_2l2x 1
104 1 . . . parsed_2l2x 1
105 1 . . . parsed_2l2x 1
106 1 . . . parsed_2l2x 1
107 1 . . . parsed_2l2x 1
108 1 . . . parsed_2l2x 1
109 1 . . . parsed_2l2x 1
110 1 . . . parsed_2l2x 1
111 1 . . . parsed_2l2x 1
112 1 . . . parsed_2l2x 1
113 1 . . . parsed_2l2x 1
114 1 . . . parsed_2l2x 1
115 1 . . . parsed_2l2x 1
116 1 . . . parsed_2l2x 1
117 1 . . . parsed_2l2x 1
118 1 . . . parsed_2l2x 1
119 1 . . . parsed_2l2x 1
120 1 . . . parsed_2l2x 1
121 1 . . . parsed_2l2x 1
122 1 . . . parsed_2l2x 1
123 1 . . . parsed_2l2x 1
124 1 . . . parsed_2l2x 1
125 1 . . . parsed_2l2x 1
126 1 . . . parsed_2l2x 1
127 1 . . . parsed_2l2x 1
128 1 . . . parsed_2l2x 1
129 1 . . . parsed_2l2x 1
130 1 . . . parsed_2l2x 1
131 1 . . . parsed_2l2x 1
132 1 . . . parsed_2l2x 1
133 1 . . . parsed_2l2x 1
134 1 . . . parsed_2l2x 1
135 1 . . . parsed_2l2x 1
136 1 . . . parsed_2l2x 1
137 1 . . . parsed_2l2x 1
138 1 . . . parsed_2l2x 1
139 1 . . . parsed_2l2x 1
140 1 . . . parsed_2l2x 1
141 1 . . . parsed_2l2x 1
142 1 . . . parsed_2l2x 1
143 1 . . . parsed_2l2x 1
144 1 . . . parsed_2l2x 1
145 1 . . . parsed_2l2x 1
146 1 . . . parsed_2l2x 1
147 1 . . . parsed_2l2x 1
148 1 . . . parsed_2l2x 1
149 1 . . . parsed_2l2x 1
150 1 . . . parsed_2l2x 1
151 1 . . . parsed_2l2x 1
152 1 . . . parsed_2l2x 1
153 1 . . . parsed_2l2x 1
154 1 . . . parsed_2l2x 1
155 1 . . . parsed_2l2x 1
156 1 . . . parsed_2l2x 1
157 1 . . . parsed_2l2x 1
158 1 . . . parsed_2l2x 1
159 1 . . . parsed_2l2x 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 . . . . . . . . . 0 . HC5 parsed_2l2x 1
1 1 2 . . . . . . . . . 0 . HC6 parsed_2l2x 1
2 1 1 . . . . . . . . . 0 . HC5 parsed_2l2x 1
2 1 2 . . . . . . . . . 0 . HC71 parsed_2l2x 1
3 1 1 . . . . . . . . . 0 . HC5 parsed_2l2x 1
3 1 2 . . . . . . . . . 0 . H13 parsed_2l2x 1
4 1 1 . . . . . . . . . 0 . HC6 parsed_2l2x 1
4 1 2 . . . . . . . . . 0 . HC71 parsed_2l2x 1
5 1 1 . . . . . . . . . 0 . HC6 parsed_2l2x 1
5 1 2 . . . . . . . . . 0 . HC8 parsed_2l2x 1
6 1 1 . . . . . . . . . 0 . HC6 parsed_2l2x 1
6 1 2 . . . . . . . . . 0 . H13 parsed_2l2x 1
7 1 1 . . . . . . . . . 0 . HC71 parsed_2l2x 1
7 1 2 . . . . . . . . . 0 . HC8 parsed_2l2x 1
8 1 1 . . . . . . . . . 0 . H13 parsed_2l2x 1
8 1 2 . . . . . . . . . 0 . H14# parsed_2l2x 1
9 1 1 . . . . . . . . . 1 . HA parsed_2l2x 1
9 1 2 . . . . . . . . . 1 . HB parsed_2l2x 1
10 1 1 . . . . . . . . . 1 . HA parsed_2l2x 1
10 1 2 . . . . . . . . . 1 . HG2# parsed_2l2x 1
11 1 1 . . . . . . . . . 2 . H parsed_2l2x 1
11 1 2 . . . . . . . . . 2 . HA parsed_2l2x 1
12 1 1 . . . . . . . . . 2 . H parsed_2l2x 1
12 1 2 . . . . . . . . . 2 . HB# parsed_2l2x 1
13 1 1 . . . . . . . . . 2 . HA parsed_2l2x 1
13 1 2 . . . . . . . . . 2 . HB# parsed_2l2x 1
14 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
14 1 2 . . . . . . . . . 3 . HB1 parsed_2l2x 1
15 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
15 1 2 . . . . . . . . . 3 . HB2 parsed_2l2x 1
16 1 1 . . . . . . . . . 3 . HB1 parsed_2l2x 1
16 1 2 . . . . . . . . . 3 . HB2 parsed_2l2x 1
17 1 1 . . . . . . . . . 4 . H parsed_2l2x 1
17 1 2 . . . . . . . . . 4 . HA parsed_2l2x 1
18 1 1 . . . . . . . . . 4 . H parsed_2l2x 1
18 1 2 . . . . . . . . . 4 . HB# parsed_2l2x 1
19 1 1 . . . . . . . . . 4 . HA parsed_2l2x 1
19 1 2 . . . . . . . . . 4 . HB# parsed_2l2x 1
20 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
20 1 2 . . . . . . . . . 5 . HB2 parsed_2l2x 1
21 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
21 1 2 . . . . . . . . . 5 . HB3 parsed_2l2x 1
22 1 1 . . . . . . . . . 5 . HB2 parsed_2l2x 1
22 1 2 . . . . . . . . . 5 . HB3 parsed_2l2x 1
23 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
23 1 2 . . . . . . . . . 7 . HA parsed_2l2x 1
24 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
24 1 2 . . . . . . . . . 7 . HB parsed_2l2x 1
25 1 1 . . . . . . . . . 7 . HA parsed_2l2x 1
25 1 2 . . . . . . . . . 7 . HB parsed_2l2x 1
26 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
26 1 2 . . . . . . . . . 7 . HG2# parsed_2l2x 1
27 1 1 . . . . . . . . . 7 . HA parsed_2l2x 1
27 1 2 . . . . . . . . . 7 . HG2# parsed_2l2x 1
28 1 1 . . . . . . . . . 8 . H1 parsed_2l2x 1
28 1 2 . . . . . . . . . 8 . HG# parsed_2l2x 1
29 1 1 . . . . . . . . . 8 . H1 parsed_2l2x 1
29 1 2 . . . . . . . . . 8 . HB1 parsed_2l2x 1
30 1 1 . . . . . . . . . 8 . HB1 parsed_2l2x 1
30 1 2 . . . . . . . . . 8 . HG# parsed_2l2x 1
31 1 1 . . . . . . . . . 10 . H parsed_2l2x 1
31 1 2 . . . . . . . . . 10 . HA parsed_2l2x 1
32 1 1 . . . . . . . . . 10 . H parsed_2l2x 1
32 1 2 . . . . . . . . . 10 . HG1 parsed_2l2x 1
33 1 1 . . . . . . . . . 10 . H parsed_2l2x 1
33 1 2 . . . . . . . . . 10 . HG2# parsed_2l2x 1
34 1 1 . . . . . . . . . 10 . H parsed_2l2x 1
34 1 2 . . . . . . . . . 10 . HD1# parsed_2l2x 1
35 1 1 . . . . . . . . . 10 . HA parsed_2l2x 1
35 1 2 . . . . . . . . . 10 . HG1 parsed_2l2x 1
36 1 1 . . . . . . . . . 10 . HA parsed_2l2x 1
36 1 2 . . . . . . . . . 10 . HG2# parsed_2l2x 1
37 1 1 . . . . . . . . . 10 . HA parsed_2l2x 1
37 1 2 . . . . . . . . . 10 . HD1# parsed_2l2x 1
38 1 1 . . . . . . . . . 10 . HG1 parsed_2l2x 1
38 1 2 . . . . . . . . . 10 . HG2# parsed_2l2x 1
39 1 1 . . . . . . . . . 10 . HG1 parsed_2l2x 1
39 1 2 . . . . . . . . . 10 . HD1# parsed_2l2x 1
40 1 1 . . . . . . . . . 12 . H parsed_2l2x 1
40 1 2 . . . . . . . . . 12 . HA parsed_2l2x 1
41 1 1 . . . . . . . . . 12 . H parsed_2l2x 1
41 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
42 1 1 . . . . . . . . . 12 . H parsed_2l2x 1
42 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
43 1 1 . . . . . . . . . 12 . HA parsed_2l2x 1
43 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
44 1 1 . . . . . . . . . 12 . HA parsed_2l2x 1
44 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
45 1 1 . . . . . . . . . 12 . HB parsed_2l2x 1
45 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
46 1 1 . . . . . . . . . 13 . HB parsed_2l2x 1
46 1 2 . . . . . . . . . 13 . HC parsed_2l2x 1
47 1 1 . . . . . . . . . 14 . HB2 parsed_2l2x 1
47 1 2 . . . . . . . . . 14 . HB3 parsed_2l2x 1
48 1 1 . . . . . . . . . 16 . H parsed_2l2x 1
48 1 2 . . . . . . . . . 16 . HB1 parsed_2l2x 1
49 1 1 . . . . . . . . . 16 . H parsed_2l2x 1
49 1 2 . . . . . . . . . 16 . HB2 parsed_2l2x 1
50 1 1 . . . . . . . . . 16 . HB1 parsed_2l2x 1
50 1 2 . . . . . . . . . 16 . HB2 parsed_2l2x 1
51 1 1 . . . . . . . . . 17 . HN1 parsed_2l2x 1
51 1 2 . . . . . . . . . 17 . HN2 parsed_2l2x 1
52 1 1 . . . . . . . . . 0 . HC6 parsed_2l2x 1
52 1 2 . . . . . . . . . 1 . HA parsed_2l2x 1
53 1 1 . . . . . . . . . 0 . HC6 parsed_2l2x 1
53 1 2 . . . . . . . . . 1 . HG2# parsed_2l2x 1
54 1 1 . . . . . . . . . 0 . HC71 parsed_2l2x 1
54 1 2 . . . . . . . . . 1 . HA parsed_2l2x 1
55 1 1 . . . . . . . . . 0 . HC71 parsed_2l2x 1
55 1 2 . . . . . . . . . 1 . HG2# parsed_2l2x 1
56 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
56 1 2 . . . . . . . . . 1 . HA parsed_2l2x 1
57 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
57 1 2 . . . . . . . . . 1 . HB parsed_2l2x 1
58 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
58 1 2 . . . . . . . . . 1 . HG2# parsed_2l2x 1
59 1 1 . . . . . . . . . 1 . HA parsed_2l2x 1
59 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
60 1 1 . . . . . . . . . 1 . HA parsed_2l2x 1
60 1 2 . . . . . . . . . 2 . HA parsed_2l2x 1
61 1 1 . . . . . . . . . 1 . HB parsed_2l2x 1
61 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
62 1 1 . . . . . . . . . 1 . HG12 parsed_2l2x 1
62 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
63 1 1 . . . . . . . . . 1 . HG13 parsed_2l2x 1
63 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
64 1 1 . . . . . . . . . 1 . HG2# parsed_2l2x 1
64 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
65 1 1 . . . . . . . . . 1 . HG2# parsed_2l2x 1
65 1 2 . . . . . . . . . 2 . HA parsed_2l2x 1
66 1 1 . . . . . . . . . 2 . H parsed_2l2x 1
66 1 2 . . . . . . . . . 3 . HB1 parsed_2l2x 1
67 1 1 . . . . . . . . . 2 . HA parsed_2l2x 1
67 1 2 . . . . . . . . . 3 . H parsed_2l2x 1
68 1 1 . . . . . . . . . 2 . HB# parsed_2l2x 1
68 1 2 . . . . . . . . . 3 . H parsed_2l2x 1
69 1 1 . . . . . . . . . 2 . HB# parsed_2l2x 1
69 1 2 . . . . . . . . . 3 . HB1 parsed_2l2x 1
70 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
70 1 2 . . . . . . . . . 4 . H parsed_2l2x 1
71 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
71 1 2 . . . . . . . . . 4 . HA parsed_2l2x 1
72 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
72 1 2 . . . . . . . . . 4 . HB# parsed_2l2x 1
73 1 1 . . . . . . . . . 3 . HB1 parsed_2l2x 1
73 1 2 . . . . . . . . . 4 . H parsed_2l2x 1
74 1 1 . . . . . . . . . 3 . HB1 parsed_2l2x 1
74 1 2 . . . . . . . . . 4 . HB# parsed_2l2x 1
75 1 1 . . . . . . . . . 3 . HB2 parsed_2l2x 1
75 1 2 . . . . . . . . . 4 . H parsed_2l2x 1
76 1 1 . . . . . . . . . 3 . HB2 parsed_2l2x 1
76 1 2 . . . . . . . . . 4 . HA parsed_2l2x 1
77 1 1 . . . . . . . . . 3 . HB2 parsed_2l2x 1
77 1 2 . . . . . . . . . 4 . HB# parsed_2l2x 1
78 1 1 . . . . . . . . . 4 . H parsed_2l2x 1
78 1 2 . . . . . . . . . 5 . H parsed_2l2x 1
79 1 1 . . . . . . . . . 4 . HA parsed_2l2x 1
79 1 2 . . . . . . . . . 5 . H parsed_2l2x 1
80 1 1 . . . . . . . . . 4 . HB# parsed_2l2x 1
80 1 2 . . . . . . . . . 5 . H parsed_2l2x 1
81 1 1 . . . . . . . . . 5 . HB2 parsed_2l2x 1
81 1 2 . . . . . . . . . 6 . HB parsed_2l2x 1
82 1 1 . . . . . . . . . 6 . HB parsed_2l2x 1
82 1 2 . . . . . . . . . 7 . H parsed_2l2x 1
83 1 1 . . . . . . . . . 6 . HB parsed_2l2x 1
83 1 2 . . . . . . . . . 7 . HA parsed_2l2x 1
84 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
84 1 2 . . . . . . . . . 8 . H1 parsed_2l2x 1
85 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
85 1 2 . . . . . . . . . 8 . HG# parsed_2l2x 1
86 1 1 . . . . . . . . . 7 . HA parsed_2l2x 1
86 1 2 . . . . . . . . . 8 . H1 parsed_2l2x 1
87 1 1 . . . . . . . . . 7 . HA parsed_2l2x 1
87 1 2 . . . . . . . . . 8 . HG# parsed_2l2x 1
88 1 1 . . . . . . . . . 7 . HB parsed_2l2x 1
88 1 2 . . . . . . . . . 8 . H1 parsed_2l2x 1
89 1 1 . . . . . . . . . 7 . HG2# parsed_2l2x 1
89 1 2 . . . . . . . . . 8 . H1 parsed_2l2x 1
90 1 1 . . . . . . . . . 8 . HB1 parsed_2l2x 1
90 1 2 . . . . . . . . . 9 . HB parsed_2l2x 1
91 1 1 . . . . . . . . . 10 . HG2# parsed_2l2x 1
91 1 2 . . . . . . . . . 11 . HB parsed_2l2x 1
92 1 1 . . . . . . . . . 11 . HB parsed_2l2x 1
92 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
93 1 1 . . . . . . . . . 12 . HA parsed_2l2x 1
93 1 2 . . . . . . . . . 13 . HB parsed_2l2x 1
94 1 1 . . . . . . . . . 13 . HC parsed_2l2x 1
94 1 2 . . . . . . . . . 14 . HB2 parsed_2l2x 1
95 1 1 . . . . . . . . . 13 . HC parsed_2l2x 1
95 1 2 . . . . . . . . . 14 . HB3 parsed_2l2x 1
96 1 1 . . . . . . . . . 15 . HB parsed_2l2x 1
96 1 2 . . . . . . . . . 16 . H parsed_2l2x 1
97 1 1 . . . . . . . . . 15 . HB parsed_2l2x 1
97 1 2 . . . . . . . . . 16 . HB1 parsed_2l2x 1
98 1 1 . . . . . . . . . 16 . HB2 parsed_2l2x 1
98 1 2 . . . . . . . . . 17 . HN1 parsed_2l2x 1
99 1 1 . . . . . . . . . 16 . HB2 parsed_2l2x 1
99 1 2 . . . . . . . . . 17 . HN2 parsed_2l2x 1
100 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
100 1 2 . . . . . . . . . 12 . H parsed_2l2x 1
101 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
101 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
102 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
102 1 2 . . . . . . . . . 13 . HB parsed_2l2x 1
103 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
103 1 2 . . . . . . . . . 13 . HC parsed_2l2x 1
104 1 1 . . . . . . . . . 5 . HB2 parsed_2l2x 1
104 1 2 . . . . . . . . . 13 . HC parsed_2l2x 1
105 1 1 . . . . . . . . . 5 . HB3 parsed_2l2x 1
105 1 2 . . . . . . . . . 13 . HB parsed_2l2x 1
106 1 1 . . . . . . . . . 5 . HB3 parsed_2l2x 1
106 1 2 . . . . . . . . . 13 . HC parsed_2l2x 1
107 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
107 1 2 . . . . . . . . . 14 . HB2 parsed_2l2x 1
108 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
108 1 2 . . . . . . . . . 14 . HB3 parsed_2l2x 1
109 1 1 . . . . . . . . . 5 . HB2 parsed_2l2x 1
109 1 2 . . . . . . . . . 14 . HB2 parsed_2l2x 1
110 1 1 . . . . . . . . . 5 . HB2 parsed_2l2x 1
110 1 2 . . . . . . . . . 14 . HB3 parsed_2l2x 1
111 1 1 . . . . . . . . . 5 . HB3 parsed_2l2x 1
111 1 2 . . . . . . . . . 14 . HB2 parsed_2l2x 1
112 1 1 . . . . . . . . . 5 . HB3 parsed_2l2x 1
112 1 2 . . . . . . . . . 14 . HB3 parsed_2l2x 1
113 1 1 . . . . . . . . . 0 . HC3 parsed_2l2x 1
113 1 2 . . . . . . . . . 3 . HB1 parsed_2l2x 1
114 1 1 . . . . . . . . . 0 . HC3 parsed_2l2x 1
114 1 2 . . . . . . . . . 5 . H parsed_2l2x 1
115 1 1 . . . . . . . . . 0 . HC3 parsed_2l2x 1
115 1 2 . . . . . . . . . 6 . HB parsed_2l2x 1
116 1 1 . . . . . . . . . 0 . HC3 parsed_2l2x 1
116 1 2 . . . . . . . . . 7 . HA parsed_2l2x 1
117 1 1 . . . . . . . . . 0 . HC3 parsed_2l2x 1
117 1 2 . . . . . . . . . 7 . HG2# parsed_2l2x 1
118 1 1 . . . . . . . . . 0 . HC6 parsed_2l2x 1
118 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
119 1 1 . . . . . . . . . 0 . HC71 parsed_2l2x 1
119 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
120 1 1 . . . . . . . . . 0 . HC71 parsed_2l2x 1
120 1 2 . . . . . . . . . 10 . HD1# parsed_2l2x 1
121 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
121 1 2 . . . . . . . . . 2 . H parsed_2l2x 1
122 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
122 1 2 . . . . . . . . . 2 . HA parsed_2l2x 1
123 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
123 1 2 . . . . . . . . . 7 . HG2# parsed_2l2x 1
124 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
124 1 2 . . . . . . . . . 10 . HD1# parsed_2l2x 1
125 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
125 1 2 . . . . . . . . . 10 . HG1 parsed_2l2x 1
126 1 1 . . . . . . . . . 0 . HC8 parsed_2l2x 1
126 1 2 . . . . . . . . . 10 . HG2# parsed_2l2x 1
127 1 1 . . . . . . . . . 0 . H13 parsed_2l2x 1
127 1 2 . . . . . . . . . 6 . HB parsed_2l2x 1
128 1 1 . . . . . . . . . 0 . H14# parsed_2l2x 1
128 1 2 . . . . . . . . . 3 . HB1 parsed_2l2x 1
129 1 1 . . . . . . . . . 0 . H14# parsed_2l2x 1
129 1 2 . . . . . . . . . 4 . H parsed_2l2x 1
130 1 1 . . . . . . . . . 1 . HA parsed_2l2x 1
130 1 2 . . . . . . . . . 10 . HD1# parsed_2l2x 1
131 1 1 . . . . . . . . . 1 . HA parsed_2l2x 1
131 1 2 . . . . . . . . . 10 . HG2# parsed_2l2x 1
132 1 1 . . . . . . . . . 2 . HA parsed_2l2x 1
132 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
133 1 1 . . . . . . . . . 2 . HA parsed_2l2x 1
133 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
134 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
134 1 2 . . . . . . . . . 5 . H parsed_2l2x 1
135 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
135 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
136 1 1 . . . . . . . . . 3 . H parsed_2l2x 1
136 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
137 1 1 . . . . . . . . . 4 . HA parsed_2l2x 1
137 1 2 . . . . . . . . . 12 . HA parsed_2l2x 1
138 1 1 . . . . . . . . . 4 . HA parsed_2l2x 1
138 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
139 1 1 . . . . . . . . . 4 . HA parsed_2l2x 1
139 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
140 1 1 . . . . . . . . . 4 . HA parsed_2l2x 1
140 1 2 . . . . . . . . . 14 . HB2 parsed_2l2x 1
141 1 1 . . . . . . . . . 4 . HB# parsed_2l2x 1
141 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
142 1 1 . . . . . . . . . 4 . HB# parsed_2l2x 1
142 1 2 . . . . . . . . . 14 . HB2 parsed_2l2x 1
143 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
143 1 2 . . . . . . . . . 7 . H parsed_2l2x 1
144 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
144 1 2 . . . . . . . . . 12 . HA parsed_2l2x 1
145 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
145 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
146 1 1 . . . . . . . . . 5 . H parsed_2l2x 1
146 1 2 . . . . . . . . . 12 . HG2# parsed_2l2x 1
147 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
147 1 2 . . . . . . . . . 13 . HB parsed_2l2x 1
148 1 1 . . . . . . . . . 7 . H parsed_2l2x 1
148 1 2 . . . . . . . . . 13 . HC parsed_2l2x 1
149 1 1 . . . . . . . . . 7 . HG2# parsed_2l2x 1
149 1 2 . . . . . . . . . 10 . H parsed_2l2x 1
150 1 1 . . . . . . . . . 7 . HG2# parsed_2l2x 1
150 1 2 . . . . . . . . . 10 . HG1 parsed_2l2x 1
151 1 1 . . . . . . . . . 7 . HG2# parsed_2l2x 1
151 1 2 . . . . . . . . . 12 . H parsed_2l2x 1
152 1 1 . . . . . . . . . 7 . HG2# parsed_2l2x 1
152 1 2 . . . . . . . . . 12 . HB parsed_2l2x 1
153 1 1 . . . . . . . . . 7 . HG2# parsed_2l2x 1
153 1 2 . . . . . . . . . 13 . HB parsed_2l2x 1
154 1 1 . . . . . . . . . 8 . H1 parsed_2l2x 1
154 1 2 . . . . . . . . . 10 . H parsed_2l2x 1
155 1 1 . . . . . . . . . 8 . HG# parsed_2l2x 1
155 1 2 . . . . . . . . . 13 . HB parsed_2l2x 1
156 1 1 . . . . . . . . . 10 . H parsed_2l2x 1
156 1 2 . . . . . . . . . 12 . H parsed_2l2x 1
157 1 1 . . . . . . . . . 10 . HG2# parsed_2l2x 1
157 1 2 . . . . . . . . . 12 . H parsed_2l2x 1
158 1 1 . . . . . . . . . 14 . HB2 parsed_2l2x 1
158 1 2 . . . . . . . . . 16 . H parsed_2l2x 1
159 1 1 . . . . . . . . . 14 . HB3 parsed_2l2x 1
159 1 2 . . . . . . . . . 16 . H parsed_2l2x 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 . . . . . 2.18 1.59 2.77 parsed_2l2x 1
2 1 . . . . . 5.06 1.22 6.50 parsed_2l2x 1
3 1 . . . . . 2.03 1.62 2.44 parsed_2l2x 1
4 1 . . . . . 2.26 1.62 2.90 parsed_2l2x 1
5 1 . . . . . 4.19 1.99 6.39 parsed_2l2x 1
6 1 . . . . . 4.80 1.92 6.50 parsed_2l2x 1
7 1 . . . . . 2.46 1.85 3.07 parsed_2l2x 1
8 1 . . . . . 2.46 1.55 3.37 parsed_2l2x 1
9 1 . . . . . 2.59 1.92 3.26 parsed_2l2x 1
10 1 . . . . . 2.69 1.96 3.42 parsed_2l2x 1
11 1 . . . . . 2.72 1.98 3.46 parsed_2l2x 1
12 1 . . . . . 3.00 2.10 3.90 parsed_2l2x 1
13 1 . . . . . 2.47 1.71 3.23 parsed_2l2x 1
14 1 . . . . . 3.30 2.21 4.39 parsed_2l2x 1
15 1 . . . . . 3.55 1.98 5.12 parsed_2l2x 1
16 1 . . . . . 1.59 1.34 2.20 parsed_2l2x 1
17 1 . . . . . 2.75 2.00 3.50 parsed_2l2x 1
18 1 . . . . . 2.82 2.03 3.61 parsed_2l2x 1
19 1 . . . . . 2.38 1.67 3.09 parsed_2l2x 1
20 1 . . . . . 3.47 1.97 4.97 parsed_2l2x 1
21 1 . . . . . 4.32 1.52 6.50 parsed_2l2x 1
22 1 . . . . . 1.85 1.51 2.20 parsed_2l2x 1
23 1 . . . . . 2.76 1.62 3.90 parsed_2l2x 1
24 1 . . . . . 3.05 2.12 3.98 parsed_2l2x 1
25 1 . . . . . 2.60 1.93 3.27 parsed_2l2x 1
26 1 . . . . . 2.65 1.95 3.35 parsed_2l2x 1
27 1 . . . . . 3.49 2.27 4.71 parsed_2l2x 1
28 1 . . . . . 3.13 1.90 4.36 parsed_2l2x 1
29 1 . . . . . 4.20 1.56 6.50 parsed_2l2x 1
30 1 . . . . . 1.86 1.51 2.21 parsed_2l2x 1
31 1 . . . . . 2.82 1.43 4.21 parsed_2l2x 1
32 1 . . . . . 2.63 1.94 3.32 parsed_2l2x 1
33 1 . . . . . 3.74 1.99 5.49 parsed_2l2x 1
34 1 . . . . . 4.18 1.56 6.50 parsed_2l2x 1
35 1 . . . . . 3.15 2.16 4.14 parsed_2l2x 1
36 1 . . . . . 2.80 2.02 3.58 parsed_2l2x 1
37 1 . . . . . 3.43 2.26 4.60 parsed_2l2x 1
38 1 . . . . . 3.25 1.93 4.57 parsed_2l2x 1
39 1 . . . . . 1.82 1.49 2.20 parsed_2l2x 1
40 1 . . . . . 2.71 1.61 3.81 parsed_2l2x 1
41 1 . . . . . 3.37 2.23 4.51 parsed_2l2x 1
42 1 . . . . . 2.76 2.00 3.52 parsed_2l2x 1
43 1 . . . . . 2.58 1.91 3.25 parsed_2l2x 1
44 1 . . . . . 2.57 1.91 3.23 parsed_2l2x 1
45 1 . . . . . 2.25 1.62 2.88 parsed_2l2x 1
46 1 . . . . . 2.30 1.77 2.83 parsed_2l2x 1
47 1 . . . . . 2.10 1.66 2.54 parsed_2l2x 1
48 1 . . . . . 3.31 2.22 4.40 parsed_2l2x 1
49 1 . . . . . 3.73 1.99 5.47 parsed_2l2x 1
50 1 . . . . . 1.85 1.51 2.20 parsed_2l2x 1
51 1 . . . . . 1.61 1.29 2.20 parsed_2l2x 1
52 1 . . . . . 5.28 1.09 6.50 parsed_2l2x 1
53 1 . . . . . 4.19 1.11 6.50 parsed_2l2x 1
54 1 . . . . . 2.65 1.95 3.35 parsed_2l2x 1
55 1 . . . . . 3.05 2.12 3.98 parsed_2l2x 1
56 1 . . . . . 2.13 1.68 2.58 parsed_2l2x 1
57 1 . . . . . 5.39 1.03 6.50 parsed_2l2x 1
58 1 . . . . . 4.90 1.29 6.50 parsed_2l2x 1
59 1 . . . . . 3.29 2.21 4.37 parsed_2l2x 1
60 1 . . . . . 4.19 1.56 6.50 parsed_2l2x 1
61 1 . . . . . 3.34 2.23 4.45 parsed_2l2x 1
62 1 . . . . . 3.84 1.63 6.05 parsed_2l2x 1
63 1 . . . . . 3.13 1.90 4.36 parsed_2l2x 1
64 1 . . . . . 3.85 2.00 5.70 parsed_2l2x 1
65 1 . . . . . 5.00 1.24 6.50 parsed_2l2x 1
66 1 . . . . . 3.82 1.63 6.01 parsed_2l2x 1
67 1 . . . . . 2.03 1.62 2.44 parsed_2l2x 1
68 1 . . . . . 2.73 1.98 3.48 parsed_2l2x 1
69 1 . . . . . 3.89 1.24 6.50 parsed_2l2x 1
70 1 . . . . . 3.49 1.96 5.02 parsed_2l2x 1
71 1 . . . . . 3.69 1.64 5.74 parsed_2l2x 1
72 1 . . . . . 3.29 1.67 4.91 parsed_2l2x 1
73 1 . . . . . 3.65 2.32 4.98 parsed_2l2x 1
74 1 . . . . . 3.56 1.34 5.78 parsed_2l2x 1
75 1 . . . . . 1.88 1.53 2.23 parsed_2l2x 1
76 1 . . . . . 5.62 0.09 6.50 parsed_2l2x 1
77 1 . . . . . 4.52 1.45 6.50 parsed_2l2x 1
78 1 . . . . . 3.67 1.98 5.36 parsed_2l2x 1
79 1 . . . . . 2.08 1.65 2.51 parsed_2l2x 1
80 1 . . . . . 3.26 2.20 4.32 parsed_2l2x 1
81 1 . . . . . 3.60 1.65 5.55 parsed_2l2x 1
82 1 . . . . . 4.08 1.59 6.50 parsed_2l2x 1
83 1 . . . . . 4.49 1.46 6.50 parsed_2l2x 1
84 1 . . . . . 4.02 1.60 6.44 parsed_2l2x 1
85 1 . . . . . 3.09 1.42 4.76 parsed_2l2x 1
86 1 . . . . . 2.49 1.87 3.11 parsed_2l2x 1
87 1 . . . . . 3.50 1.97 5.03 parsed_2l2x 1
88 1 . . . . . 3.87 2.00 5.74 parsed_2l2x 1
89 1 . . . . . 3.07 2.13 4.01 parsed_2l2x 1
90 1 . . . . . 3.50 1.36 5.64 parsed_2l2x 1
91 1 . . . . . 3.24 1.67 4.81 parsed_2l2x 1
92 1 . . . . . 3.51 1.66 5.36 parsed_2l2x 1
93 1 . . . . . 4.76 1.37 6.50 parsed_2l2x 1
94 1 . . . . . 4.27 1.54 6.50 parsed_2l2x 1
95 1 . . . . . 3.82 1.99 5.65 parsed_2l2x 1
96 1 . . . . . 4.40 1.49 6.50 parsed_2l2x 1
97 1 . . . . . 4.48 1.47 6.50 parsed_2l2x 1
98 1 . . . . . 3.56 2.29 4.83 parsed_2l2x 1
99 1 . . . . . 2.66 1.95 3.37 parsed_2l2x 1
100 1 . . . . . 4.40 1.49 6.50 parsed_2l2x 1
101 1 . . . . . 4.11 1.57 6.50 parsed_2l2x 1
102 1 . . . . . 4.46 1.47 6.50 parsed_2l2x 1
103 1 . . . . . 3.09 2.13 4.05 parsed_2l2x 1
104 1 . . . . . 3.81 1.99 5.63 parsed_2l2x 1
105 1 . . . . . 4.99 1.25 6.50 parsed_2l2x 1
106 1 . . . . . 2.21 1.72 2.70 parsed_2l2x 1
107 1 . . . . . 3.25 2.20 4.30 parsed_2l2x 1
108 1 . . . . . 5.27 0.41 6.50 parsed_2l2x 1
109 1 . . . . . 2.80 2.02 3.58 parsed_2l2x 1
110 1 . . . . . 2.81 2.02 3.60 parsed_2l2x 1
111 1 . . . . . 3.30 1.94 4.66 parsed_2l2x 1
112 1 . . . . . 2.44 1.84 3.04 parsed_2l2x 1
113 1 . . . . . 3.55 2.29 4.81 parsed_2l2x 1
114 1 . . . . . 4.53 1.46 6.50 parsed_2l2x 1
115 1 . . . . . 3.50 2.28 4.72 parsed_2l2x 1
116 1 . . . . . 5.07 0.56 6.50 parsed_2l2x 1
117 1 . . . . . 3.92 1.62 6.22 parsed_2l2x 1
118 1 . . . . . 5.29 1.09 6.50 parsed_2l2x 1
119 1 . . . . . 5.17 0.50 6.50 parsed_2l2x 1
120 1 . . . . . 3.09 2.14 4.04 parsed_2l2x 1
121 1 . . . . . 3.59 2.30 4.88 parsed_2l2x 1
122 1 . . . . . 3.63 1.98 5.28 parsed_2l2x 1
123 1 . . . . . 3.39 2.24 4.54 parsed_2l2x 1
124 1 . . . . . 2.96 2.09 3.83 parsed_2l2x 1
125 1 . . . . . 5.35 0.34 6.50 parsed_2l2x 1
126 1 . . . . . 3.42 2.25 4.59 parsed_2l2x 1
127 1 . . . . . 3.72 2.33 5.11 parsed_2l2x 1
128 1 . . . . . 2.71 1.97 3.45 parsed_2l2x 1
129 1 . . . . . 4.50 1.47 6.50 parsed_2l2x 1
130 1 . . . . . 2.97 2.09 3.85 parsed_2l2x 1
131 1 . . . . . 3.42 2.25 4.59 parsed_2l2x 1
132 1 . . . . . 5.10 1.19 6.50 parsed_2l2x 1
133 1 . . . . . 2.90 2.06 3.74 parsed_2l2x 1
134 1 . . . . . 4.72 1.37 6.50 parsed_2l2x 1
135 1 . . . . . 3.26 2.19 4.33 parsed_2l2x 1
136 1 . . . . . 2.56 1.91 3.21 parsed_2l2x 1
137 1 . . . . . 5.12 1.19 6.50 parsed_2l2x 1
138 1 . . . . . 2.45 1.85 3.05 parsed_2l2x 1
139 1 . . . . . 3.55 1.98 5.12 parsed_2l2x 1
140 1 . . . . . 4.91 0.68 6.50 parsed_2l2x 1
141 1 . . . . . 4.64 1.42 6.50 parsed_2l2x 1
142 1 . . . . . 3.80 1.63 5.97 parsed_2l2x 1
143 1 . . . . . 4.28 1.07 6.50 parsed_2l2x 1
144 1 . . . . . 3.46 2.27 4.65 parsed_2l2x 1
145 1 . . . . . 2.49 1.87 3.11 parsed_2l2x 1
146 1 . . . . . 3.18 1.91 4.45 parsed_2l2x 1
147 1 . . . . . 2.57 1.91 3.23 parsed_2l2x 1
148 1 . . . . . 3.20 2.18 4.22 parsed_2l2x 1
149 1 . . . . . 2.58 1.92 3.24 parsed_2l2x 1
150 1 . . . . . 3.99 2.00 5.98 parsed_2l2x 1
151 1 . . . . . 2.86 2.04 3.68 parsed_2l2x 1
152 1 . . . . . 4.25 1.10 6.50 parsed_2l2x 1
153 1 . . . . . 3.37 2.24 4.50 parsed_2l2x 1
154 1 . . . . . 3.76 1.64 5.88 parsed_2l2x 1
155 1 . . . . . 3.24 1.40 5.08 parsed_2l2x 1
156 1 . . . . . 3.98 1.60 6.36 parsed_2l2x 1
157 1 . . . . . 3.51 2.28 4.74 parsed_2l2x 1
158 1 . . . . . 4.63 1.42 6.50 parsed_2l2x 1
159 1 . . . . . 3.70 1.99 5.41 parsed_2l2x 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Intraresidue NOEs" 1 1 1 19 parsed_2l2x 1
2 "# Sequential NOEs" 56 1 56 17 parsed_2l2x 1
3 "# Medium and long range NOEs" 121 1 121 28 parsed_2l2x 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2l2x
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 2 . OR parsed_2l2x 2
1 2 . 3 . parsed_2l2x 2
1 3 . . . parsed_2l2x 2
2 1 2 . OR parsed_2l2x 2
2 2 . 3 . parsed_2l2x 2
2 3 . . . parsed_2l2x 2
3 1 2 . OR parsed_2l2x 2
3 2 . 3 . parsed_2l2x 2
3 3 . . . parsed_2l2x 2
4 1 2 . OR parsed_2l2x 2
4 2 . 3 . parsed_2l2x 2
4 3 . . . parsed_2l2x 2
5 1 2 . OR parsed_2l2x 2
5 2 . 3 . parsed_2l2x 2
5 3 . . . parsed_2l2x 2
6 1 2 . OR parsed_2l2x 2
6 2 . 3 . parsed_2l2x 2
6 3 . . . parsed_2l2x 2
7 1 2 . OR parsed_2l2x 2
7 2 . 3 . parsed_2l2x 2
7 3 . . . parsed_2l2x 2
8 1 2 . OR parsed_2l2x 2
8 2 . 3 . parsed_2l2x 2
8 3 . . . parsed_2l2x 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 2 1 . . . . . . . . . 0 . H13 parsed_2l2x 2
1 2 2 . . . . . . . . . 0 . HC3 parsed_2l2x 2
1 3 1 . . . . . . . . . 3 . HB2 parsed_2l2x 2
1 3 2 . . . . . . . . . 0 . HC3 parsed_2l2x 2
2 2 1 . . . . . . . . . 0 . H14# parsed_2l2x 2
2 2 2 . . . . . . . . . 0 . HC3 parsed_2l2x 2
2 3 1 . . . . . . . . . 7 . HB parsed_2l2x 2
2 3 2 . . . . . . . . . 0 . HC3 parsed_2l2x 2
3 2 1 . . . . . . . . . 0 . H14# parsed_2l2x 2
3 2 2 . . . . . . . . . 0 . HC5 parsed_2l2x 2
3 3 1 . . . . . . . . . 7 . HB parsed_2l2x 2
3 3 2 . . . . . . . . . 0 . HC5 parsed_2l2x 2
4 2 1 . . . . . . . . . 0 . H14# parsed_2l2x 2
4 2 2 . . . . . . . . . 0 . HC6 parsed_2l2x 2
4 3 1 . . . . . . . . . 7 . HB parsed_2l2x 2
4 3 2 . . . . . . . . . 0 . HC6 parsed_2l2x 2
5 2 1 . . . . . . . . . 0 . H14# parsed_2l2x 2
5 2 2 . . . . . . . . . 2 . H parsed_2l2x 2
5 3 1 . . . . . . . . . 7 . HB parsed_2l2x 2
5 3 2 . . . . . . . . . 2 . H parsed_2l2x 2
6 2 1 . . . . . . . . . 0 . H14# parsed_2l2x 2
6 2 2 . . . . . . . . . 6 . HB parsed_2l2x 2
6 3 1 . . . . . . . . . 7 . HB parsed_2l2x 2
6 3 2 . . . . . . . . . 6 . HB parsed_2l2x 2
7 2 1 . . . . . . . . . 7 . HG2# parsed_2l2x 2
7 2 2 . . . . . . . . . 12 . HA parsed_2l2x 2
7 3 1 . . . . . . . . . 7 . HG2# parsed_2l2x 2
7 3 2 . . . . . . . . . 10 . HA parsed_2l2x 2
8 2 1 . . . . . . . . . 12 . HA parsed_2l2x 2
8 2 2 . . . . . . . . . 11 . HB parsed_2l2x 2
8 3 1 . . . . . . . . . 10 . HA parsed_2l2x 2
8 3 2 . . . . . . . . . 11 . HB parsed_2l2x 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 2 . . . . . 2.97 2.09 3.85 parsed_2l2x 2
1 3 . . . . . 2.97 2.09 3.85 parsed_2l2x 2
2 2 . . . . . 2.88 2.05 3.71 parsed_2l2x 2
2 3 . . . . . 2.88 2.05 3.71 parsed_2l2x 2
3 2 . . . . . 2.85 2.04 3.66 parsed_2l2x 2
3 3 . . . . . 2.85 2.04 3.66 parsed_2l2x 2
4 2 . . . . . 4.07 2.00 6.14 parsed_2l2x 2
4 3 . . . . . 4.07 2.00 6.14 parsed_2l2x 2
5 2 . . . . . 3.38 1.38 5.38 parsed_2l2x 2
5 3 . . . . . 3.38 1.38 5.38 parsed_2l2x 2
6 2 . . . . . 4.53 1.45 6.50 parsed_2l2x 2
6 3 . . . . . 4.53 1.45 6.50 parsed_2l2x 2
7 2 . . . . . 4.17 1.56 6.50 parsed_2l2x 2
7 3 . . . . . 4.17 1.56 6.50 parsed_2l2x 2
8 2 . . . . . 4.40 1.50 6.50 parsed_2l2x 2
8 3 . . . . . 4.40 1.50 6.50 parsed_2l2x 2
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Ambiguous NOEs" 1 1 1 16 parsed_2l2x 2
stop_
save_
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