Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
35782 | 1ma2 RC | 5486 | cing | 2-parsed | STAR | entry | full | 158 |
data_1ma2_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1ma2
_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_1ma2 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1ma2
_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 1ma2 "Master copy" parsed_1ma2
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1ma2
_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 1ma2.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ma2 1
1 1ma2.mr . . XPLOR/CNS 2 distance NOE simple 150 parsed_1ma2 1
1 1ma2.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 8 parsed_1ma2 1
1 1ma2.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ma2 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_1ma2
_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 ANTIMICROBIAL PROTEIN 31-JUL-02 1MA2
*TITLE TACHYPLESIN I WILD TYPE PEPTIDE NMR STRUCTURE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: TACHYPLESIN I;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED
*SOURCE 4 USING FMOC SOLID STATE SYNTHESIS. THE SEQUENCE OF THE
*SOURCE 5 PEPTIDE IS NATURALLY FOUND IN TACHYPLEUS TRIDENTATUS
*SOURCE 6 (JAPANESE HORESHOE CRAB).
*KEYWDS TACHYPLESIN, BETA HAIRPIN, DISULFIDE BRIDGE, ANTI-MICROBIAL
*KEYWDS 2 PEPTIDE
*EXPDTA NMR, 31 STRUCTURES
*AUTHOR A.LAEDERACH, A.H.ANDREOTTI, D.B.FULTON
*REVDAT 1 16-OCT-02 1MA2 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1ma2
_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_1ma2 1
2 1 . . . parsed_1ma2 1
3 1 . . . parsed_1ma2 1
4 1 . . . parsed_1ma2 1
5 1 . . . parsed_1ma2 1
6 1 . . . parsed_1ma2 1
7 1 . . . parsed_1ma2 1
8 1 . . . parsed_1ma2 1
9 1 . . . parsed_1ma2 1
10 1 . . . parsed_1ma2 1
11 1 . . . parsed_1ma2 1
12 1 . . . parsed_1ma2 1
13 1 . . . parsed_1ma2 1
14 1 . . . parsed_1ma2 1
15 1 . . . parsed_1ma2 1
16 1 . . . parsed_1ma2 1
17 1 . . . parsed_1ma2 1
18 1 . . . parsed_1ma2 1
19 1 . . . parsed_1ma2 1
20 1 . . . parsed_1ma2 1
21 1 . . . parsed_1ma2 1
22 1 . . . parsed_1ma2 1
23 1 . . . parsed_1ma2 1
24 1 . . . parsed_1ma2 1
25 1 . . . parsed_1ma2 1
26 1 . . . parsed_1ma2 1
27 1 . . . parsed_1ma2 1
28 1 . . . parsed_1ma2 1
29 1 . . . parsed_1ma2 1
30 1 . . . parsed_1ma2 1
31 1 . . . parsed_1ma2 1
32 1 . . . parsed_1ma2 1
33 1 . . . parsed_1ma2 1
34 1 . . . parsed_1ma2 1
35 1 . . . parsed_1ma2 1
36 1 . . . parsed_1ma2 1
37 1 . . . parsed_1ma2 1
38 1 . . . parsed_1ma2 1
39 1 . . . parsed_1ma2 1
40 1 . . . parsed_1ma2 1
41 1 . . . parsed_1ma2 1
42 1 . . . parsed_1ma2 1
43 1 . . . parsed_1ma2 1
44 1 . . . parsed_1ma2 1
45 1 . . . parsed_1ma2 1
46 1 . . . parsed_1ma2 1
47 1 . . . parsed_1ma2 1
48 1 . . . parsed_1ma2 1
49 1 . . . parsed_1ma2 1
50 1 . . . parsed_1ma2 1
51 1 . . . parsed_1ma2 1
52 1 . . . parsed_1ma2 1
53 1 . . . parsed_1ma2 1
54 1 . . . parsed_1ma2 1
55 1 . . . parsed_1ma2 1
56 1 . . . parsed_1ma2 1
57 1 . . . parsed_1ma2 1
58 1 . . . parsed_1ma2 1
59 1 . . . parsed_1ma2 1
60 1 . . . parsed_1ma2 1
61 1 . . . parsed_1ma2 1
62 1 . . . parsed_1ma2 1
63 1 . . . parsed_1ma2 1
64 1 . . . parsed_1ma2 1
65 1 . . . parsed_1ma2 1
66 1 . . . parsed_1ma2 1
67 1 . . . parsed_1ma2 1
68 1 . . . parsed_1ma2 1
69 1 . . . parsed_1ma2 1
70 1 . . . parsed_1ma2 1
71 1 . . . parsed_1ma2 1
72 1 . . . parsed_1ma2 1
73 1 . . . parsed_1ma2 1
74 1 . . . parsed_1ma2 1
75 1 . . . parsed_1ma2 1
76 1 . . . parsed_1ma2 1
77 1 . . . parsed_1ma2 1
78 1 . . . parsed_1ma2 1
79 1 . . . parsed_1ma2 1
80 1 . . . parsed_1ma2 1
81 1 . . . parsed_1ma2 1
82 1 . . . parsed_1ma2 1
83 1 . . . parsed_1ma2 1
84 1 . . . parsed_1ma2 1
85 1 . . . parsed_1ma2 1
86 1 . . . parsed_1ma2 1
87 1 . . . parsed_1ma2 1
88 1 . . . parsed_1ma2 1
89 1 . . . parsed_1ma2 1
90 1 . . . parsed_1ma2 1
91 1 . . . parsed_1ma2 1
92 1 . . . parsed_1ma2 1
93 1 . . . parsed_1ma2 1
94 1 . . . parsed_1ma2 1
95 1 . . . parsed_1ma2 1
96 1 . . . parsed_1ma2 1
97 1 . . . parsed_1ma2 1
98 1 . . . parsed_1ma2 1
99 1 . . . parsed_1ma2 1
100 1 . . . parsed_1ma2 1
101 1 . . . parsed_1ma2 1
102 1 . . . parsed_1ma2 1
103 1 . . . parsed_1ma2 1
104 1 . . . parsed_1ma2 1
105 1 . . . parsed_1ma2 1
106 1 . . . parsed_1ma2 1
107 1 . . . parsed_1ma2 1
108 1 . . . parsed_1ma2 1
109 1 . . . parsed_1ma2 1
110 1 . . . parsed_1ma2 1
111 1 . . . parsed_1ma2 1
112 1 . . . parsed_1ma2 1
113 1 . . . parsed_1ma2 1
114 1 . . . parsed_1ma2 1
115 1 . . . parsed_1ma2 1
116 1 . . . parsed_1ma2 1
117 1 . . . parsed_1ma2 1
118 1 . . . parsed_1ma2 1
119 1 . . . parsed_1ma2 1
120 1 . . . parsed_1ma2 1
121 1 . . . parsed_1ma2 1
122 1 . . . parsed_1ma2 1
123 1 . . . parsed_1ma2 1
124 1 . . . parsed_1ma2 1
125 1 . . . parsed_1ma2 1
126 1 . . . parsed_1ma2 1
127 1 . . . parsed_1ma2 1
128 1 . . . parsed_1ma2 1
129 1 . . . parsed_1ma2 1
130 1 . . . parsed_1ma2 1
131 1 . . . parsed_1ma2 1
132 1 . . . parsed_1ma2 1
133 1 . . . parsed_1ma2 1
134 1 . . . parsed_1ma2 1
135 1 . . . parsed_1ma2 1
136 1 . . . parsed_1ma2 1
137 1 . . . parsed_1ma2 1
138 1 . . . parsed_1ma2 1
139 1 . . . parsed_1ma2 1
140 1 . . . parsed_1ma2 1
141 1 . . . parsed_1ma2 1
142 1 . . . parsed_1ma2 1
143 1 . . . parsed_1ma2 1
144 1 . . . parsed_1ma2 1
145 1 . . . parsed_1ma2 1
146 1 . . . parsed_1ma2 1
147 1 . . . parsed_1ma2 1
148 1 . . . parsed_1ma2 1
149 1 . . . parsed_1ma2 1
150 1 . . . parsed_1ma2 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 1 . HZ3 parsed_1ma2 1
1 1 2 . . . . . . . . . 1 . HA parsed_1ma2 1
2 1 1 . . . . . . . . . 1 . HZ3 parsed_1ma2 1
2 1 2 . . . . . . . . . 1 . HB# parsed_1ma2 1
3 1 1 . . . . . . . . . 1 . HZ3 parsed_1ma2 1
3 1 2 . . . . . . . . . 1 . HD# parsed_1ma2 1
4 1 1 . . . . . . . . . 1 . HZ3 parsed_1ma2 1
4 1 2 . . . . . . . . . 1 . HE# parsed_1ma2 1
5 1 1 . . . . . . . . . 1 . HZ3 parsed_1ma2 1
5 1 2 . . . . . . . . . 1 . HG# parsed_1ma2 1
6 1 1 . . . . . . . . . 2 . HN parsed_1ma2 1
6 1 2 . . . . . . . . . 1 . HA parsed_1ma2 1
7 1 1 . . . . . . . . . 2 . HD# parsed_1ma2 1
7 1 2 . . . . . . . . . 2 . HA parsed_1ma2 1
8 1 1 . . . . . . . . . 2 . HD# parsed_1ma2 1
8 1 2 . . . . . . . . . 2 . HB# parsed_1ma2 1
9 1 1 . . . . . . . . . 2 . HE1 parsed_1ma2 1
9 1 2 . . . . . . . . . 2 . HD# parsed_1ma2 1
10 1 1 . . . . . . . . . 2 . HN parsed_1ma2 1
10 1 2 . . . . . . . . . 2 . HA parsed_1ma2 1
11 1 1 . . . . . . . . . 2 . HN parsed_1ma2 1
11 1 2 . . . . . . . . . 2 . HB# parsed_1ma2 1
12 1 1 . . . . . . . . . 2 . HZ2 parsed_1ma2 1
12 1 2 . . . . . . . . . 2 . HH2 parsed_1ma2 1
13 1 1 . . . . . . . . . 2 . HZ3 parsed_1ma2 1
13 1 2 . . . . . . . . . 2 . HE3 parsed_1ma2 1
14 1 1 . . . . . . . . . 3 . HN parsed_1ma2 1
14 1 2 . . . . . . . . . 2 . HA parsed_1ma2 1
15 1 1 . . . . . . . . . 2 . HN parsed_1ma2 1
15 1 2 . . . . . . . . . 3 . HN parsed_1ma2 1
16 1 1 . . . . . . . . . 3 . HA parsed_1ma2 1
16 1 2 . . . . . . . . . 3 . HB# parsed_1ma2 1
17 1 1 . . . . . . . . . 3 . HA parsed_1ma2 1
17 1 2 . . . . . . . . . 3 . HB# parsed_1ma2 1
18 1 1 . . . . . . . . . 3 . HN parsed_1ma2 1
18 1 2 . . . . . . . . . 3 . HA parsed_1ma2 1
19 1 1 . . . . . . . . . 3 . HN parsed_1ma2 1
19 1 2 . . . . . . . . . 3 . HB# parsed_1ma2 1
20 1 1 . . . . . . . . . 3 . HN parsed_1ma2 1
20 1 2 . . . . . . . . . 3 . HB# parsed_1ma2 1
21 1 1 . . . . . . . . . 4 . HN parsed_1ma2 1
21 1 2 . . . . . . . . . 3 . HA parsed_1ma2 1
22 1 1 . . . . . . . . . 4 . HN parsed_1ma2 1
22 1 2 . . . . . . . . . 3 . HB# parsed_1ma2 1
23 1 1 . . . . . . . . . 4 . HD# parsed_1ma2 1
23 1 2 . . . . . . . . . 4 . HB# parsed_1ma2 1
24 1 1 . . . . . . . . . 4 . HD# parsed_1ma2 1
24 1 2 . . . . . . . . . 4 . HE# parsed_1ma2 1
25 1 1 . . . . . . . . . 4 . HN parsed_1ma2 1
25 1 2 . . . . . . . . . 4 . HA parsed_1ma2 1
26 1 1 . . . . . . . . . 4 . HN parsed_1ma2 1
26 1 2 . . . . . . . . . 4 . HB# parsed_1ma2 1
27 1 1 . . . . . . . . . 5 . HN parsed_1ma2 1
27 1 2 . . . . . . . . . 4 . HA parsed_1ma2 1
28 1 1 . . . . . . . . . 5 . HE parsed_1ma2 1
28 1 2 . . . . . . . . . 5 . HA parsed_1ma2 1
29 1 1 . . . . . . . . . 5 . HE parsed_1ma2 1
29 1 2 . . . . . . . . . 5 . HB# parsed_1ma2 1
30 1 1 . . . . . . . . . 5 . HE parsed_1ma2 1
30 1 2 . . . . . . . . . 5 . HD# parsed_1ma2 1
31 1 1 . . . . . . . . . 5 . HE parsed_1ma2 1
31 1 2 . . . . . . . . . 5 . HG# parsed_1ma2 1
32 1 1 . . . . . . . . . 5 . HN parsed_1ma2 1
32 1 2 . . . . . . . . . 5 . HA parsed_1ma2 1
33 1 1 . . . . . . . . . 5 . HN parsed_1ma2 1
33 1 2 . . . . . . . . . 5 . HB# parsed_1ma2 1
34 1 1 . . . . . . . . . 5 . HN parsed_1ma2 1
34 1 2 . . . . . . . . . 5 . HB# parsed_1ma2 1
35 1 1 . . . . . . . . . 5 . HN parsed_1ma2 1
35 1 2 . . . . . . . . . 5 . HD# parsed_1ma2 1
36 1 1 . . . . . . . . . 5 . HN parsed_1ma2 1
36 1 2 . . . . . . . . . 5 . HG# parsed_1ma2 1
37 1 1 . . . . . . . . . 6 . HN parsed_1ma2 1
37 1 2 . . . . . . . . . 5 . HA parsed_1ma2 1
38 1 1 . . . . . . . . . 6 . HN parsed_1ma2 1
38 1 2 . . . . . . . . . 5 . HG# parsed_1ma2 1
39 1 1 . . . . . . . . . 6 . HN parsed_1ma2 1
39 1 2 . . . . . . . . . 6 . HA parsed_1ma2 1
40 1 1 . . . . . . . . . 6 . HN parsed_1ma2 1
40 1 2 . . . . . . . . . 6 . HB parsed_1ma2 1
41 1 1 . . . . . . . . . 6 . HN parsed_1ma2 1
41 1 2 . . . . . . . . . 6 . hg1# parsed_1ma2 1
42 1 1 . . . . . . . . . 7 . HN parsed_1ma2 1
42 1 2 . . . . . . . . . 6 . HA parsed_1ma2 1
43 1 1 . . . . . . . . . 7 . HA parsed_1ma2 1
43 1 2 . . . . . . . . . 7 . HB# parsed_1ma2 1
44 1 1 . . . . . . . . . 7 . HA parsed_1ma2 1
44 1 2 . . . . . . . . . 7 . HB# parsed_1ma2 1
45 1 1 . . . . . . . . . 7 . HN parsed_1ma2 1
45 1 2 . . . . . . . . . 7 . HA parsed_1ma2 1
46 1 1 . . . . . . . . . 7 . HN parsed_1ma2 1
46 1 2 . . . . . . . . . 7 . HB# parsed_1ma2 1
47 1 1 . . . . . . . . . 7 . HN parsed_1ma2 1
47 1 2 . . . . . . . . . 7 . HB# parsed_1ma2 1
48 1 1 . . . . . . . . . 8 . HD# parsed_1ma2 1
48 1 2 . . . . . . . . . 6 . hg1# parsed_1ma2 1
49 1 1 . . . . . . . . . 8 . HE# parsed_1ma2 1
49 1 2 . . . . . . . . . 6 . hg1# parsed_1ma2 1
50 1 1 . . . . . . . . . 8 . HN parsed_1ma2 1
50 1 2 . . . . . . . . . 7 . HA parsed_1ma2 1
51 1 1 . . . . . . . . . 8 . HN parsed_1ma2 1
51 1 2 . . . . . . . . . 7 . HB# parsed_1ma2 1
52 1 1 . . . . . . . . . 8 . HD# parsed_1ma2 1
52 1 2 . . . . . . . . . 8 . HA parsed_1ma2 1
53 1 1 . . . . . . . . . 8 . HD# parsed_1ma2 1
53 1 2 . . . . . . . . . 8 . HB# parsed_1ma2 1
54 1 1 . . . . . . . . . 8 . HE# parsed_1ma2 1
54 1 2 . . . . . . . . . 8 . HA parsed_1ma2 1
55 1 1 . . . . . . . . . 8 . HE# parsed_1ma2 1
55 1 2 . . . . . . . . . 8 . HB# parsed_1ma2 1
56 1 1 . . . . . . . . . 8 . HD# parsed_1ma2 1
56 1 2 . . . . . . . . . 8 . HE# parsed_1ma2 1
57 1 1 . . . . . . . . . 8 . HN parsed_1ma2 1
57 1 2 . . . . . . . . . 8 . HA parsed_1ma2 1
58 1 1 . . . . . . . . . 8 . HN parsed_1ma2 1
58 1 2 . . . . . . . . . 8 . HB# parsed_1ma2 1
59 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
59 1 2 . . . . . . . . . 8 . HA parsed_1ma2 1
60 1 1 . . . . . . . . . 9 . HE parsed_1ma2 1
60 1 2 . . . . . . . . . 9 . HA parsed_1ma2 1
61 1 1 . . . . . . . . . 9 . HE parsed_1ma2 1
61 1 2 . . . . . . . . . 9 . HB# parsed_1ma2 1
62 1 1 . . . . . . . . . 9 . HE parsed_1ma2 1
62 1 2 . . . . . . . . . 9 . HB# parsed_1ma2 1
63 1 1 . . . . . . . . . 9 . HE parsed_1ma2 1
63 1 2 . . . . . . . . . 9 . HG# parsed_1ma2 1
64 1 1 . . . . . . . . . 9 . HE parsed_1ma2 1
64 1 2 . . . . . . . . . 9 . HG# parsed_1ma2 1
65 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
65 1 2 . . . . . . . . . 9 . HA parsed_1ma2 1
66 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
66 1 2 . . . . . . . . . 9 . HB# parsed_1ma2 1
67 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
67 1 2 . . . . . . . . . 9 . HB# parsed_1ma2 1
68 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
68 1 2 . . . . . . . . . 9 . HD# parsed_1ma2 1
69 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
69 1 2 . . . . . . . . . 9 . HG# parsed_1ma2 1
70 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
70 1 2 . . . . . . . . . 9 . HG# parsed_1ma2 1
71 1 1 . . . . . . . . . 10 . HN parsed_1ma2 1
71 1 2 . . . . . . . . . 9 . HA parsed_1ma2 1
72 1 1 . . . . . . . . . 9 . HN parsed_1ma2 1
72 1 2 . . . . . . . . . 10 . HN parsed_1ma2 1
73 1 1 . . . . . . . . . 10 . HN parsed_1ma2 1
73 1 2 . . . . . . . . . 10 . HA# parsed_1ma2 1
74 1 1 . . . . . . . . . 10 . HN parsed_1ma2 1
74 1 2 . . . . . . . . . 10 . HA# parsed_1ma2 1
75 1 1 . . . . . . . . . 8 . HN parsed_1ma2 1
75 1 2 . . . . . . . . . 11 . HN parsed_1ma2 1
76 1 1 . . . . . . . . . 10 . HN parsed_1ma2 1
76 1 2 . . . . . . . . . 11 . hg2# parsed_1ma2 1
77 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
77 1 2 . . . . . . . . . 10 . HA# parsed_1ma2 1
78 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
78 1 2 . . . . . . . . . 10 . HA# parsed_1ma2 1
79 1 1 . . . . . . . . . 10 . HN parsed_1ma2 1
79 1 2 . . . . . . . . . 11 . HN parsed_1ma2 1
80 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
80 1 2 . . . . . . . . . 11 . HA parsed_1ma2 1
81 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
81 1 2 . . . . . . . . . 11 . hd1# parsed_1ma2 1
82 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
82 1 2 . . . . . . . . . 11 . HG1# parsed_1ma2 1
83 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
83 1 2 . . . . . . . . . 11 . HG1# parsed_1ma2 1
84 1 1 . . . . . . . . . 11 . HN parsed_1ma2 1
84 1 2 . . . . . . . . . 11 . hg2# parsed_1ma2 1
85 1 1 . . . . . . . . . 8 . HN parsed_1ma2 1
85 1 2 . . . . . . . . . 12 . HA parsed_1ma2 1
86 1 1 . . . . . . . . . 12 . HN parsed_1ma2 1
86 1 2 . . . . . . . . . 11 . HA parsed_1ma2 1
87 1 1 . . . . . . . . . 12 . HA parsed_1ma2 1
87 1 2 . . . . . . . . . 12 . HB# parsed_1ma2 1
88 1 1 . . . . . . . . . 12 . HA parsed_1ma2 1
88 1 2 . . . . . . . . . 12 . HB# parsed_1ma2 1
89 1 1 . . . . . . . . . 12 . HN parsed_1ma2 1
89 1 2 . . . . . . . . . 12 . HA parsed_1ma2 1
90 1 1 . . . . . . . . . 12 . HN parsed_1ma2 1
90 1 2 . . . . . . . . . 12 . HB# parsed_1ma2 1
91 1 1 . . . . . . . . . 12 . HN parsed_1ma2 1
91 1 2 . . . . . . . . . 12 . HB# parsed_1ma2 1
92 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
92 1 2 . . . . . . . . . 6 . HN parsed_1ma2 1
93 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
93 1 2 . . . . . . . . . 7 . HA parsed_1ma2 1
94 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
94 1 2 . . . . . . . . . 11 . hd1# parsed_1ma2 1
95 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
95 1 2 . . . . . . . . . 11 . hg2# parsed_1ma2 1
96 1 1 . . . . . . . . . 13 . HE# parsed_1ma2 1
96 1 2 . . . . . . . . . 11 . hd1# parsed_1ma2 1
97 1 1 . . . . . . . . . 13 . HE# parsed_1ma2 1
97 1 2 . . . . . . . . . 11 . hg2# parsed_1ma2 1
98 1 1 . . . . . . . . . 12 . HN parsed_1ma2 1
98 1 2 . . . . . . . . . 13 . HA parsed_1ma2 1
99 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
99 1 2 . . . . . . . . . 12 . HA parsed_1ma2 1
100 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
100 1 2 . . . . . . . . . 12 . HB# parsed_1ma2 1
101 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
101 1 2 . . . . . . . . . 13 . HA parsed_1ma2 1
102 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
102 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
103 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
103 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
104 1 1 . . . . . . . . . 13 . HE# parsed_1ma2 1
104 1 2 . . . . . . . . . 13 . HA parsed_1ma2 1
105 1 1 . . . . . . . . . 13 . HE# parsed_1ma2 1
105 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
106 1 1 . . . . . . . . . 13 . HE# parsed_1ma2 1
106 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
107 1 1 . . . . . . . . . 13 . HD# parsed_1ma2 1
107 1 2 . . . . . . . . . 13 . HE# parsed_1ma2 1
108 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
108 1 2 . . . . . . . . . 13 . HA parsed_1ma2 1
109 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
109 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
110 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
110 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
111 1 1 . . . . . . . . . 13 . HN parsed_1ma2 1
111 1 2 . . . . . . . . . 13 . HD# parsed_1ma2 1
112 1 1 . . . . . . . . . 5 . HG# parsed_1ma2 1
112 1 2 . . . . . . . . . 14 . HB# parsed_1ma2 1
113 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
113 1 2 . . . . . . . . . 13 . HA parsed_1ma2 1
114 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
114 1 2 . . . . . . . . . 13 . HB# parsed_1ma2 1
115 1 1 . . . . . . . . . 14 . HE parsed_1ma2 1
115 1 2 . . . . . . . . . 14 . HG# parsed_1ma2 1
116 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
116 1 2 . . . . . . . . . 14 . HA parsed_1ma2 1
117 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
117 1 2 . . . . . . . . . 14 . HB# parsed_1ma2 1
118 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
118 1 2 . . . . . . . . . 14 . HB# parsed_1ma2 1
119 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
119 1 2 . . . . . . . . . 14 . HD# parsed_1ma2 1
120 1 1 . . . . . . . . . 14 . HN parsed_1ma2 1
120 1 2 . . . . . . . . . 14 . HG# parsed_1ma2 1
121 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
121 1 2 . . . . . . . . . 5 . HA parsed_1ma2 1
122 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
122 1 2 . . . . . . . . . 14 . HA parsed_1ma2 1
123 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
123 1 2 . . . . . . . . . 14 . HB# parsed_1ma2 1
124 1 1 . . . . . . . . . 15 . HE parsed_1ma2 1
124 1 2 . . . . . . . . . 15 . HA parsed_1ma2 1
125 1 1 . . . . . . . . . 15 . HE parsed_1ma2 1
125 1 2 . . . . . . . . . 15 . HD# parsed_1ma2 1
126 1 1 . . . . . . . . . 15 . HE parsed_1ma2 1
126 1 2 . . . . . . . . . 15 . HG# parsed_1ma2 1
127 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
127 1 2 . . . . . . . . . 15 . HA parsed_1ma2 1
128 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
128 1 2 . . . . . . . . . 15 . HB# parsed_1ma2 1
129 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
129 1 2 . . . . . . . . . 15 . HB# parsed_1ma2 1
130 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
130 1 2 . . . . . . . . . 15 . HD# parsed_1ma2 1
131 1 1 . . . . . . . . . 15 . HN parsed_1ma2 1
131 1 2 . . . . . . . . . 15 . HG# parsed_1ma2 1
132 1 1 . . . . . . . . . 16 . HA parsed_1ma2 1
132 1 2 . . . . . . . . . 3 . HA parsed_1ma2 1
133 1 1 . . . . . . . . . 16 . HN parsed_1ma2 1
133 1 2 . . . . . . . . . 15 . HA parsed_1ma2 1
134 1 1 . . . . . . . . . 16 . HA parsed_1ma2 1
134 1 2 . . . . . . . . . 16 . HB# parsed_1ma2 1
135 1 1 . . . . . . . . . 16 . HA parsed_1ma2 1
135 1 2 . . . . . . . . . 16 . HB# parsed_1ma2 1
136 1 1 . . . . . . . . . 16 . HN parsed_1ma2 1
136 1 2 . . . . . . . . . 16 . HA parsed_1ma2 1
137 1 1 . . . . . . . . . 16 . HN parsed_1ma2 1
137 1 2 . . . . . . . . . 16 . HB# parsed_1ma2 1
138 1 1 . . . . . . . . . 16 . HN parsed_1ma2 1
138 1 2 . . . . . . . . . 16 . HB# parsed_1ma2 1
139 1 1 . . . . . . . . . 2 . HE3 parsed_1ma2 1
139 1 2 . . . . . . . . . 17 . HA parsed_1ma2 1
140 1 1 . . . . . . . . . 2 . HZ3 parsed_1ma2 1
140 1 2 . . . . . . . . . 17 . HA parsed_1ma2 1
141 1 1 . . . . . . . . . 17 . HN parsed_1ma2 1
141 1 2 . . . . . . . . . 16 . HA parsed_1ma2 1
142 1 1 . . . . . . . . . 17 . HN parsed_1ma2 1
142 1 2 . . . . . . . . . 16 . HB# parsed_1ma2 1
143 1 1 . . . . . . . . . 17 . HN parsed_1ma2 1
143 1 2 . . . . . . . . . 16 . HB# parsed_1ma2 1
144 1 1 . . . . . . . . . 17 . HE parsed_1ma2 1
144 1 2 . . . . . . . . . 17 . HA parsed_1ma2 1
145 1 1 . . . . . . . . . 17 . HE parsed_1ma2 1
145 1 2 . . . . . . . . . 17 . HB# parsed_1ma2 1
146 1 1 . . . . . . . . . 17 . HE parsed_1ma2 1
146 1 2 . . . . . . . . . 17 . HD# parsed_1ma2 1
147 1 1 . . . . . . . . . 17 . HE parsed_1ma2 1
147 1 2 . . . . . . . . . 17 . HG# parsed_1ma2 1
148 1 1 . . . . . . . . . 17 . HN parsed_1ma2 1
148 1 2 . . . . . . . . . 17 . HA parsed_1ma2 1
149 1 1 . . . . . . . . . 17 . HN parsed_1ma2 1
149 1 2 . . . . . . . . . 17 . HB# parsed_1ma2 1
150 1 1 . . . . . . . . . 17 . HN parsed_1ma2 1
150 1 2 . . . . . . . . . 17 . HD# parsed_1ma2 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 . . . . . 5 1.8 5.0 parsed_1ma2 1
2 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
3 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
4 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
5 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
6 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
7 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
8 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
9 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
10 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
11 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
12 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
13 1 . . . . . 2.8 1.8 2.8 parsed_1ma2 1
14 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
15 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
16 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
17 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
18 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
19 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
20 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
21 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
22 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
23 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
24 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
25 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
26 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
27 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
28 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
29 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
30 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
31 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
32 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
33 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
34 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
35 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
36 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
37 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
38 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
39 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
40 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
41 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
42 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
43 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
44 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
45 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
46 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
47 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
48 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
49 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
50 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
51 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
52 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
53 1 . . . . . 2.8 1.8 2.8 parsed_1ma2 1
54 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
55 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
56 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
57 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
58 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
59 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
60 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
61 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
62 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
63 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
64 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
65 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
66 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
67 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
68 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
69 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
70 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
71 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
72 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
73 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
74 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
75 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
76 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
77 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
78 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
79 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
80 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
81 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
82 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
83 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
84 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
85 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
86 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
87 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
88 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
89 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
90 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
91 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
92 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
93 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
94 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
95 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
96 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
97 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
98 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
99 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
100 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
101 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
102 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
103 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
104 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
105 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
106 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
107 1 . . . . . 2.8 1.8 2.8 parsed_1ma2 1
108 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
109 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
110 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
111 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
112 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
113 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
114 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
115 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
116 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
117 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
118 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
119 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
120 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
121 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
122 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
123 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
124 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
125 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
126 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
127 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
128 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
129 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
130 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
131 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
132 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
133 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
134 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
135 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
136 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
137 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
138 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
139 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
140 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
141 1 . . . . . 3.4 1.8 3.4 parsed_1ma2 1
142 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
143 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
144 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
145 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
146 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
147 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
148 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
149 1 . . . . . 5 1.8 5.0 parsed_1ma2 1
150 1 . . . . . 5 1.8 5.0 parsed_1ma2 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 "#tpc4h2o0725final.0" 1 66 1 86 parsed_1ma2 1
2 "#tpc4h2o0725final.79" 2 67 2 88 parsed_1ma2 1
3 "#tpc4h2o0725final.80" 3 67 3 88 parsed_1ma2 1
4 "#tpc4h2o0725final.78" 4 67 4 88 parsed_1ma2 1
5 "#tpc4h2o0725final.81" 5 67 5 88 parsed_1ma2 1
6 "#tpc4h2o0725final.1" 6 67 6 87 parsed_1ma2 1
7 "#tpc4h2o0725final.138" 7 66 7 88 parsed_1ma2 1
8 "#tpc4h2o0725final.147" 8 67 8 89 parsed_1ma2 1
9 "#tpc4h2o0725final.35" 9 67 9 88 parsed_1ma2 1
10 "#tpc4h2o0725final.2" 10 65 10 85 parsed_1ma2 1
11 "#tpc4h2o0725final.48" 11 66 11 87 parsed_1ma2 1
12 "#tpc4h2o0725final.133" 12 67 12 89 parsed_1ma2 1
13 "#tpc4h2o0725final.132" 13 67 13 89 parsed_1ma2 1
14 "#tpc4h2o0725final.3" 14 67 14 87 parsed_1ma2 1
15 "#tpc4h2o0725final.145" 15 65 15 87 parsed_1ma2 1
16 "#tpc4h2o0725final.104" 16 66 16 88 parsed_1ma2 1
17 "#tpc4h2o0725final.103" 17 66 17 88 parsed_1ma2 1
18 "#tpc4h2o0725final.4" 18 65 18 85 parsed_1ma2 1
19 "#tpc4h2o0725final.71" 19 66 19 87 parsed_1ma2 1
20 "#tpc4h2o0725final.72" 20 66 20 87 parsed_1ma2 1
21 "#tpc4h2o0725final.5" 21 67 21 87 parsed_1ma2 1
22 "#tpc4h2o0725final.111" 22 66 22 88 parsed_1ma2 1
23 "#tpc4h2o0725final.130" 23 67 23 89 parsed_1ma2 1
24 "#tpc4h2o0725final.131" 24 69 24 91 parsed_1ma2 1
25 "#tpc4h2o0725final.6" 25 67 25 87 parsed_1ma2 1
26 "#tpc4h2o0725final.52" 26 66 26 87 parsed_1ma2 1
27 "#tpc4h2o0725final.7" 27 67 27 87 parsed_1ma2 1
28 "#tpc4h2o0725final.89" 28 65 28 86 parsed_1ma2 1
29 "#tpc4h2o0725final.88" 29 66 29 87 parsed_1ma2 1
30 "#tpc4h2o0725final.90" 30 66 30 87 parsed_1ma2 1
31 "#tpc4h2o0725final.87" 31 66 31 87 parsed_1ma2 1
32 "#tpc4h2o0725final.8" 32 65 32 85 parsed_1ma2 1
33 "#tpc4h2o0725final.66" 33 66 33 87 parsed_1ma2 1
34 "#tpc4h2o0725final.67" 34 66 34 87 parsed_1ma2 1
35 "#tpc4h2o0725final.65" 35 66 35 87 parsed_1ma2 1
36 "#tpc4h2o0725final.68" 36 66 36 87 parsed_1ma2 1
37 "#tpc4h2o0725final.9" 37 67 37 87 parsed_1ma2 1
38 "#tpc4h2o0725final.112" 38 66 38 88 parsed_1ma2 1
39 "#tpc4h2o0725final.10" 39 65 39 86 parsed_1ma2 1
40 "#tpc4h2o0725final.50" 40 65 40 86 parsed_1ma2 1
41 "#tpc4h2o0725final.49" 41 67 41 88 parsed_1ma2 1
42 "#tpc4h2o0725final.11" 42 67 42 88 parsed_1ma2 1
43 "#tpc4h2o0725final.100" 43 66 43 88 parsed_1ma2 1
44 "#tpc4h2o0725final.99" 44 66 44 87 parsed_1ma2 1
45 "#tpc4h2o0725final.12" 45 65 45 86 parsed_1ma2 1
46 "#tpc4h2o0725final.58" 46 68 46 89 parsed_1ma2 1
47 "#tpc4h2o0725final.57" 47 66 47 87 parsed_1ma2 1
48 "#tpc4h2o0725final.150" 48 68 48 90 parsed_1ma2 1
49 "#tpc4h2o0725final.151" 49 68 49 90 parsed_1ma2 1
50 "#tpc4h2o0725final.13" 50 67 50 88 parsed_1ma2 1
51 "#tpc4h2o0725final.108" 51 66 51 88 parsed_1ma2 1
52 "#tpc4h2o0725final.117" 52 66 52 88 parsed_1ma2 1
53 "#tpc4h2o0725final.120" 53 67 53 89 parsed_1ma2 1
54 "#tpc4h2o0725final.118" 54 66 54 88 parsed_1ma2 1
55 "#tpc4h2o0725final.119" 55 67 55 89 parsed_1ma2 1
56 "#tpc4h2o0725final.129" 56 69 56 91 parsed_1ma2 1
57 "#tpc4h2o0725final.14" 57 65 57 86 parsed_1ma2 1
58 "#tpc4h2o0725final.44" 58 68 58 89 parsed_1ma2 1
59 "#tpc4h2o0725final.15" 59 67 59 88 parsed_1ma2 1
60 "#tpc4h2o0725final.82" 60 65 60 86 parsed_1ma2 1
61 "#tpc4h2o0725final.83" 61 66 61 87 parsed_1ma2 1
62 "#tpc4h2o0725final.84" 62 66 62 87 parsed_1ma2 1
63 "#tpc4h2o0725final.85" 63 66 63 87 parsed_1ma2 1
64 "#tpc4h2o0725final.86" 64 66 64 87 parsed_1ma2 1
65 "#tpc4h2o0725final.16" 65 67 65 88 parsed_1ma2 1
66 "#tpc4h2o0725final.38" 66 66 66 87 parsed_1ma2 1
67 "#tpc4h2o0725final.39" 67 66 67 87 parsed_1ma2 1
68 "#tpc4h2o0725final.37" 68 66 68 87 parsed_1ma2 1
69 "#tpc4h2o0725final.40" 69 66 69 87 parsed_1ma2 1
70 "#tpc4h2o0725final.41" 70 66 70 87 parsed_1ma2 1
71 "#tpc4h2o0725final.17" 71 66 71 87 parsed_1ma2 1
72 "#tpc4h2o0725final.139" 72 66 72 88 parsed_1ma2 1
73 "#tpc4h2o0725final.18" 73 68 73 89 parsed_1ma2 1
74 "#tpc4h2o0725final.19" 74 70 74 91 parsed_1ma2 1
75 "#tpc4h2o0725final.140" 75 66 75 88 parsed_1ma2 1
76 "#tpc4h2o0725final.115" 76 69 76 91 parsed_1ma2 1
77 "#tpc4h2o0725final.21" 77 68 77 89 parsed_1ma2 1
78 "#tpc4h2o0725final.20" 78 68 78 89 parsed_1ma2 1
79 "#tpc4h2o0725final.141" 79 69 79 91 parsed_1ma2 1
80 "#tpc4h2o0725final.22" 80 67 80 88 parsed_1ma2 1
81 "#tpc4h2o0725final.77" 81 69 81 90 parsed_1ma2 1
82 "#tpc4h2o0725final.75" 82 69 82 90 parsed_1ma2 1
83 "#tpc4h2o0725final.74" 83 69 83 90 parsed_1ma2 1
84 "#tpc4h2o0725final.76" 84 69 84 90 parsed_1ma2 1
85 "#tpc4h2o0725final.156" 85 66 85 88 parsed_1ma2 1
86 "#tpc4h2o0725final.23" 86 69 86 90 parsed_1ma2 1
87 "#tpc4h2o0725final.102" 87 68 87 90 parsed_1ma2 1
88 "#tpc4h2o0725final.101" 88 68 88 90 parsed_1ma2 1
89 "#tpc4h2o0725final.24" 89 67 89 88 parsed_1ma2 1
90 "#tpc4h2o0725final.69" 90 68 90 89 parsed_1ma2 1
91 "#tpc4h2o0725final.70" 91 68 91 89 parsed_1ma2 1
92 "#tpc4h2o0725final.142" 92 66 92 88 parsed_1ma2 1
93 "#tpc4h2o0725final.25" 93 66 93 87 parsed_1ma2 1
94 "#tpc4h2o0725final.152" 94 70 94 92 parsed_1ma2 1
95 "#tpc4h2o0725final.148" 95 70 95 92 parsed_1ma2 1
96 "#tpc4h2o0725final.153" 96 70 96 92 parsed_1ma2 1
97 "#tpc4h2o0725final.149" 97 70 97 92 parsed_1ma2 1
98 "#tpc4h2o0725final.155" 98 67 98 89 parsed_1ma2 1
99 "#tpc4h2o0725final.127" 99 68 99 90 parsed_1ma2 1
100 "#tpc4h2o0725final.107" 100 68 100 90 parsed_1ma2 1
101 "#tpc4h2o0725final.126" 101 68 101 90 parsed_1ma2 1
102 "#tpc4h2o0725final.122" 102 71 102 93 parsed_1ma2 1
103 "#tpc4h2o0725final.121" 103 71 103 93 parsed_1ma2 1
104 "#tpc4h2o0725final.125" 104 68 104 90 parsed_1ma2 1
105 "#tpc4h2o0725final.124" 105 69 105 91 parsed_1ma2 1
106 "#tpc4h2o0725final.123" 106 69 106 91 parsed_1ma2 1
107 "#tpc4h2o0725final.128" 107 69 107 91 parsed_1ma2 1
108 "#tpc4h2o0725final.26" 108 67 108 88 parsed_1ma2 1
109 "#tpc4h2o0725final.42" 109 68 109 89 parsed_1ma2 1
110 "#tpc4h2o0725final.43" 110 68 110 89 parsed_1ma2 1
111 "#tpc4h2o0725final.143" 111 68 111 90 parsed_1ma2 1
112 "#tpc4h2o0725final.162" 112 68 112 90 parsed_1ma2 1
113 "#tpc4h2o0725final.27" 113 67 113 88 parsed_1ma2 1
114 "#tpc4h2o0725final.159" 114 68 114 90 parsed_1ma2 1
115 "#tpc4h2o0725final.98" 115 68 115 89 parsed_1ma2 1
116 "#tpc4h2o0725final.28" 116 67 116 88 parsed_1ma2 1
117 "#tpc4h2o0725final.62" 117 68 117 89 parsed_1ma2 1
118 "#tpc4h2o0725final.63" 118 68 118 89 parsed_1ma2 1
119 "#tpc4h2o0725final.61" 119 68 119 89 parsed_1ma2 1
120 "#tpc4h2o0725final.64" 120 68 120 89 parsed_1ma2 1
121 "#tpc4h2o0725final.158" 121 66 121 88 parsed_1ma2 1
122 "#tpc4h2o0725final.29" 122 67 122 88 parsed_1ma2 1
123 "#tpc4h2o0725final.116" 123 68 123 90 parsed_1ma2 1
124 "#tpc4h2o0725final.91" 124 67 124 88 parsed_1ma2 1
125 "#tpc4h2o0725final.92" 125 68 125 89 parsed_1ma2 1
126 "#tpc4h2o0725final.93" 126 68 126 89 parsed_1ma2 1
127 "#tpc4h2o0725final.30" 127 67 127 88 parsed_1ma2 1
128 "#tpc4h2o0725final.54" 128 68 128 89 parsed_1ma2 1
129 "#tpc4h2o0725final.55" 129 68 129 89 parsed_1ma2 1
130 "#tpc4h2o0725final.53" 130 68 130 89 parsed_1ma2 1
131 "#tpc4h2o0725final.56" 131 68 131 89 parsed_1ma2 1
132 "#tpc4h2o0725final.161" 132 66 132 88 parsed_1ma2 1
133 "#tpc4h2o0725final.31" 133 69 133 90 parsed_1ma2 1
134 "#tpc4h2o0725final.106" 134 68 134 90 parsed_1ma2 1
135 "#tpc4h2o0725final.105" 135 68 135 90 parsed_1ma2 1
136 "#tpc4h2o0725final.32" 136 67 136 88 parsed_1ma2 1
137 "#tpc4h2o0725final.59" 137 68 137 89 parsed_1ma2 1
138 "#tpc4h2o0725final.60" 138 68 138 89 parsed_1ma2 1
139 "#tpc4h2o0725final.136" 139 67 139 89 parsed_1ma2 1
140 "#tpc4h2o0725final.135" 140 67 140 89 parsed_1ma2 1
141 "#tpc4h2o0725final.33" 141 69 141 90 parsed_1ma2 1
142 "#tpc4h2o0725final.109" 142 68 142 90 parsed_1ma2 1
143 "#tpc4h2o0725final.110" 143 68 143 90 parsed_1ma2 1
144 "#tpc4h2o0725final.97" 144 67 144 88 parsed_1ma2 1
145 "#tpc4h2o0725final.95" 145 68 145 89 parsed_1ma2 1
146 "#tpc4h2o0725final.96" 146 68 146 89 parsed_1ma2 1
147 "#tpc4h2o0725final.94" 147 68 147 89 parsed_1ma2 1
148 "#tpc4h2o0725final.34" 148 67 148 88 parsed_1ma2 1
149 "#tpc4h2o0725final.46" 149 68 149 89 parsed_1ma2 1
150 "#tpc4h2o0725final.45" 150 68 150 89 parsed_1ma2 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1ma2
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1ma2 2
2 1 . . . parsed_1ma2 2
3 1 . . . parsed_1ma2 2
4 1 . . . parsed_1ma2 2
5 1 . . . parsed_1ma2 2
6 1 . . . parsed_1ma2 2
7 1 . . . parsed_1ma2 2
8 1 . . . parsed_1ma2 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 . . . . . . . . . 13 . O parsed_1ma2 2
1 1 2 . . . . . . . . . 6 . HN parsed_1ma2 2
2 1 1 . . . . . . . . . 13 . O parsed_1ma2 2
2 1 2 . . . . . . . . . 6 . N parsed_1ma2 2
3 1 1 . . . . . . . . . 8 . O parsed_1ma2 2
3 1 2 . . . . . . . . . 11 . HN parsed_1ma2 2
4 1 1 . . . . . . . . . 8 . O parsed_1ma2 2
4 1 2 . . . . . . . . . 11 . N parsed_1ma2 2
5 1 1 . . . . . . . . . 11 . O parsed_1ma2 2
5 1 2 . . . . . . . . . 8 . HN parsed_1ma2 2
6 1 1 . . . . . . . . . 11 . O parsed_1ma2 2
6 1 2 . . . . . . . . . 8 . N parsed_1ma2 2
7 1 1 . . . . . . . . . 6 . O parsed_1ma2 2
7 1 2 . . . . . . . . . 13 . HN parsed_1ma2 2
8 1 1 . . . . . . . . . 6 . O parsed_1ma2 2
8 1 2 . . . . . . . . . 13 . N parsed_1ma2 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 1.8 1.5 2.5 parsed_1ma2 2
2 1 . . . . . 2.8 2.4 3.5 parsed_1ma2 2
3 1 . . . . . 1.8 1.5 2.5 parsed_1ma2 2
4 1 . . . . . 2.8 2.4 3.5 parsed_1ma2 2
5 1 . . . . . 1.8 1.5 2.5 parsed_1ma2 2
6 1 . . . . . 2.8 2.4 3.5 parsed_1ma2 2
7 1 . . . . . 1.8 1.5 2.5 parsed_1ma2 2
8 1 . . . . . 2.8 2.4 3.5 parsed_1ma2 2
stop_
save_