NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
29907 |
1bjh   |
cing | 2-parsed | STAR | entry | full | 232 |
data_1bjh_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1bjh
_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_1bjh 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1bjh
_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 1bjh "Master copy" parsed_1bjh
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1bjh
_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 1bjh.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1bjh 1
1 1bjh.mr . . DISCOVER 2 distance "hydrogen bond" simple 11 parsed_1bjh 1
1 1bjh.mr . . DISCOVER 3 distance NOE simple 159 parsed_1bjh 1
1 1bjh.mr . . DISCOVER 4 distance "general distance" simple 13 parsed_1bjh 1
1 1bjh.mr . . DISCOVER 5 "dihedral angle" "Not applicable" "Not applicable" 49 parsed_1bjh 1
1 1bjh.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1bjh 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_1bjh
_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 DEOXYRIBONUCLEIC ACID 25-JUL-97 1BJH
*TITLE HAIRPIN LOOPS CONSISTING OF SINGLE ADENINE RESIDUES
*TITLE 2 CLOSED BY SHEARED A(DOT)A AND G(DOT)G PAIRS FORMED BY THE
*TITLE 3 DNA TRIPLETS AAA AND GAG: SOLUTION STRUCTURE OF THE
*TITLE 4 D(GTACAAAGTAC) HAIRPIN, NMR, 16 STRUCTURES
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: DNA (GTACAAAGTAC) HAIRPIN;
*COMPND 3 CHAIN: NULL;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES
*KEYWDS DNA LOOP, SHEARED A:A, AAA LOOP, SINGLE RESIDUE LOOP,
*KEYWDS 2 DEOXYRIBONUCLEIC ACID
*EXPDTA NMR, 16 STRUCTURES
*AUTHOR S.-H.CHOU,L.ZHU,Z.GAO,J.-W.CHENG,B.R.REID
*REVDAT 1 03-DEC-97 1BJH 0
!BIOSYM restraint 1
!
;
save_
save_Discover_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bjh
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_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_1bjh 1
2 1 . . . parsed_1bjh 1
3 1 . . . parsed_1bjh 1
4 1 . . . parsed_1bjh 1
5 1 . . . parsed_1bjh 1
6 1 . . . parsed_1bjh 1
7 1 . . . parsed_1bjh 1
8 1 . . . parsed_1bjh 1
9 1 . . . parsed_1bjh 1
10 1 . . . parsed_1bjh 1
11 1 . . . parsed_1bjh 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 1 G5' H1 parsed_1bjh 1
1 1 2 . . . . . . . . 1 11 C3' N3 parsed_1bjh 1
2 1 1 . . . . . . . . 1 1 G5' H22 parsed_1bjh 1
2 1 2 . . . . . . . . 1 11 C3' O2 parsed_1bjh 1
3 1 1 . . . . . . . . 1 1 G5' O6 parsed_1bjh 1
3 1 2 . . . . . . . . 1 11 C3' H42 parsed_1bjh 1
4 1 1 . . . . . . . . 1 2 T H3 parsed_1bjh 1
4 1 2 . . . . . . . . 1 10 A N1 parsed_1bjh 1
5 1 1 . . . . . . . . 1 2 T O4 parsed_1bjh 1
5 1 2 . . . . . . . . 1 10 A H61 parsed_1bjh 1
6 1 1 . . . . . . . . 1 3 A N1 parsed_1bjh 1
6 1 2 . . . . . . . . 1 9 T H3 parsed_1bjh 1
7 1 1 . . . . . . . . 1 3 A H61 parsed_1bjh 1
7 1 2 . . . . . . . . 1 9 T O4 parsed_1bjh 1
8 1 1 . . . . . . . . 1 4 C N3 parsed_1bjh 1
8 1 2 . . . . . . . . 1 8 G H1 parsed_1bjh 1
9 1 1 . . . . . . . . 1 4 C O2 parsed_1bjh 1
9 1 2 . . . . . . . . 1 8 G H22 parsed_1bjh 1
10 1 1 . . . . . . . . 1 4 C H42 parsed_1bjh 1
10 1 2 . . . . . . . . 1 8 G O6 parsed_1bjh 1
11 1 1 . . . . . . . . 1 5 A N3 parsed_1bjh 1
11 1 2 . . . . . . . . 1 7 A H62 parsed_1bjh 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.80 2.50 parsed_1bjh 1
2 1 . . . . . . 1.80 2.50 parsed_1bjh 1
3 1 . . . . . . 1.80 2.50 parsed_1bjh 1
4 1 . . . . . . 1.80 2.10 parsed_1bjh 1
5 1 . . . . . . 1.80 2.10 parsed_1bjh 1
6 1 . . . . . . 1.80 2.10 parsed_1bjh 1
7 1 . . . . . . 1.80 2.10 parsed_1bjh 1
8 1 . . . . . . 1.80 2.10 parsed_1bjh 1
9 1 . . . . . . 1.80 2.10 parsed_1bjh 1
10 1 . . . . . . 1.80 2.10 parsed_1bjh 1
11 1 . . . . . . 1.80 2.50 parsed_1bjh 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1
;
distance
Distance Force-Constant Max.
ATOM #1 ATOM #2 Lower Upper Lower Upper Force
------------- -------------- ----- ----- ------ ----- -----
;
1 1 4 79 parsed_1bjh 1
stop_
save_
save_Discover_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bjh
_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 . . . parsed_1bjh 2
2 1 . . . parsed_1bjh 2
3 1 . . . parsed_1bjh 2
4 1 . . . parsed_1bjh 2
5 1 . . . parsed_1bjh 2
6 1 . . . parsed_1bjh 2
7 1 . . . parsed_1bjh 2
8 1 . . . parsed_1bjh 2
9 1 . . . parsed_1bjh 2
10 1 . . . parsed_1bjh 2
11 1 . . . parsed_1bjh 2
12 1 . . . parsed_1bjh 2
13 1 . . . parsed_1bjh 2
14 1 . . . parsed_1bjh 2
15 1 . . . parsed_1bjh 2
16 1 . . . parsed_1bjh 2
17 1 . . . parsed_1bjh 2
18 1 . . . parsed_1bjh 2
19 1 . . . parsed_1bjh 2
20 1 . . . parsed_1bjh 2
21 1 . . . parsed_1bjh 2
22 1 . . . parsed_1bjh 2
23 1 . . . parsed_1bjh 2
24 1 . . . parsed_1bjh 2
25 1 . . . parsed_1bjh 2
26 1 . . . parsed_1bjh 2
27 1 . . . parsed_1bjh 2
28 1 . . . parsed_1bjh 2
29 1 . . . parsed_1bjh 2
30 1 . . . parsed_1bjh 2
31 1 . . . parsed_1bjh 2
32 1 . . . parsed_1bjh 2
33 1 . . . parsed_1bjh 2
34 1 . . . parsed_1bjh 2
35 1 . . . parsed_1bjh 2
36 1 . . . parsed_1bjh 2
37 1 . . . parsed_1bjh 2
38 1 . . . parsed_1bjh 2
39 1 . . . parsed_1bjh 2
40 1 . . . parsed_1bjh 2
41 1 . . . parsed_1bjh 2
42 1 . . . parsed_1bjh 2
43 1 . . . parsed_1bjh 2
44 1 . . . parsed_1bjh 2
45 1 . . . parsed_1bjh 2
46 1 . . . parsed_1bjh 2
47 1 . . . parsed_1bjh 2
48 1 . . . parsed_1bjh 2
49 1 . . . parsed_1bjh 2
50 1 . . . parsed_1bjh 2
51 1 . . . parsed_1bjh 2
52 1 . . . parsed_1bjh 2
53 1 . . . parsed_1bjh 2
54 1 . . . parsed_1bjh 2
55 1 . . . parsed_1bjh 2
56 1 . . . parsed_1bjh 2
57 1 . . . parsed_1bjh 2
58 1 . . . parsed_1bjh 2
59 1 . . . parsed_1bjh 2
60 1 . . . parsed_1bjh 2
61 1 . . . parsed_1bjh 2
62 1 . . . parsed_1bjh 2
63 1 . . . parsed_1bjh 2
64 1 . . . parsed_1bjh 2
65 1 . . . parsed_1bjh 2
66 1 . . . parsed_1bjh 2
67 1 . . . parsed_1bjh 2
68 1 . . . parsed_1bjh 2
69 1 . . . parsed_1bjh 2
70 1 . . . parsed_1bjh 2
71 1 . . . parsed_1bjh 2
72 1 . . . parsed_1bjh 2
73 1 . . . parsed_1bjh 2
74 1 . . . parsed_1bjh 2
75 1 . . . parsed_1bjh 2
76 1 . . . parsed_1bjh 2
77 1 . . . parsed_1bjh 2
78 1 . . . parsed_1bjh 2
79 1 . . . parsed_1bjh 2
80 1 . . . parsed_1bjh 2
81 1 . . . parsed_1bjh 2
82 1 . . . parsed_1bjh 2
83 1 . . . parsed_1bjh 2
84 1 . . . parsed_1bjh 2
85 1 . . . parsed_1bjh 2
86 1 . . . parsed_1bjh 2
87 1 . . . parsed_1bjh 2
88 1 . . . parsed_1bjh 2
89 1 . . . parsed_1bjh 2
90 1 . . . parsed_1bjh 2
91 1 . . . parsed_1bjh 2
92 1 . . . parsed_1bjh 2
93 1 . . . parsed_1bjh 2
94 1 . . . parsed_1bjh 2
95 1 . . . parsed_1bjh 2
96 1 . . . parsed_1bjh 2
97 1 . . . parsed_1bjh 2
98 1 . . . parsed_1bjh 2
99 1 . . . parsed_1bjh 2
100 1 . . . parsed_1bjh 2
101 1 . . . parsed_1bjh 2
102 1 . . . parsed_1bjh 2
103 1 . . . parsed_1bjh 2
104 1 . . . parsed_1bjh 2
105 1 . . . parsed_1bjh 2
106 1 . . . parsed_1bjh 2
107 1 . . . parsed_1bjh 2
108 1 . . . parsed_1bjh 2
109 1 . . . parsed_1bjh 2
110 1 . . . parsed_1bjh 2
111 1 . . . parsed_1bjh 2
112 1 . . . parsed_1bjh 2
113 1 . . . parsed_1bjh 2
114 1 . . . parsed_1bjh 2
115 1 . . . parsed_1bjh 2
116 1 . . . parsed_1bjh 2
117 1 . . . parsed_1bjh 2
118 1 . . . parsed_1bjh 2
119 1 . . . parsed_1bjh 2
120 1 . . . parsed_1bjh 2
121 1 . . . parsed_1bjh 2
122 1 . . . parsed_1bjh 2
123 1 . . . parsed_1bjh 2
124 1 . . . parsed_1bjh 2
125 1 . . . parsed_1bjh 2
126 1 . . . parsed_1bjh 2
127 1 . . . parsed_1bjh 2
128 1 . . . parsed_1bjh 2
129 1 . . . parsed_1bjh 2
130 1 . . . parsed_1bjh 2
131 1 . . . parsed_1bjh 2
132 1 . . . parsed_1bjh 2
133 1 . . . parsed_1bjh 2
134 1 . . . parsed_1bjh 2
135 1 . . . parsed_1bjh 2
136 1 . . . parsed_1bjh 2
137 1 . . . parsed_1bjh 2
138 1 . . . parsed_1bjh 2
139 1 . . . parsed_1bjh 2
140 1 . . . parsed_1bjh 2
141 1 . . . parsed_1bjh 2
142 1 . . . parsed_1bjh 2
143 1 . . . parsed_1bjh 2
144 1 . . . parsed_1bjh 2
145 1 . . . parsed_1bjh 2
146 1 . . . parsed_1bjh 2
147 1 . . . parsed_1bjh 2
148 1 . . . parsed_1bjh 2
149 1 . . . parsed_1bjh 2
150 1 . . . parsed_1bjh 2
151 1 . . . parsed_1bjh 2
152 1 . . . parsed_1bjh 2
153 1 . . . parsed_1bjh 2
154 1 . . . parsed_1bjh 2
155 1 . . . parsed_1bjh 2
156 1 . . . parsed_1bjh 2
157 1 . . . parsed_1bjh 2
158 1 . . . parsed_1bjh 2
159 1 . . . parsed_1bjh 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . 1 1 G5' H1 parsed_1bjh 2
1 1 2 . . . . . . . . 1 2 T H3 parsed_1bjh 2
2 1 1 . . . . . . . . 1 2 T H3 parsed_1bjh 2
2 1 2 . . . . . . . . 1 9 T H3 parsed_1bjh 2
3 1 1 . . . . . . . . 1 9 T H3 parsed_1bjh 2
3 1 2 . . . . . . . . 1 8 G H1 parsed_1bjh 2
4 1 1 . . . . . . . . 1 2 T H3 parsed_1bjh 2
4 1 2 . . . . . . . . 1 10 A H2 parsed_1bjh 2
5 1 1 . . . . . . . . 1 9 T H3 parsed_1bjh 2
5 1 2 . . . . . . . . 1 3 A H2 parsed_1bjh 2
6 1 1 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
6 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
7 1 1 . . . . . . . . 1 10 A H8 parsed_1bjh 2
7 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
8 1 1 . . . . . . . . 1 9 T H6 parsed_1bjh 2
8 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
9 1 1 . . . . . . . . 1 8 G H8 parsed_1bjh 2
9 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
10 1 1 . . . . . . . . 1 7 A H8 parsed_1bjh 2
10 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
11 1 1 . . . . . . . . 1 6 A H8 parsed_1bjh 2
11 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
12 1 1 . . . . . . . . 1 5 A H8 parsed_1bjh 2
12 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
13 1 1 . . . . . . . . 1 4 C H6 parsed_1bjh 2
13 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
14 1 1 . . . . . . . . 1 3 A H8 parsed_1bjh 2
14 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
15 1 1 . . . . . . . . 1 2 T H6 parsed_1bjh 2
15 1 2 . . . . . . . . 1 1 G5' H8 parsed_1bjh 2
16 1 1 . . . . . . . . 1 5 A H2 parsed_1bjh 2
16 1 2 . . . . . . . . 1 6 A H2 parsed_1bjh 2
17 1 1 . . . . . . . . 1 6 A H2 parsed_1bjh 2
17 1 2 . . . . . . . . 1 7 A H2 parsed_1bjh 2
18 1 1 . . . . . . . . 1 5 A H2 parsed_1bjh 2
18 1 2 . . . . . . . . 1 7 A H2 parsed_1bjh 2
19 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 2
19 1 2 . . . . . . . . 1 1 G5' H8 parsed_1bjh 2
20 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 2
20 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
21 1 1 . . . . . . . . 1 2 T H1' parsed_1bjh 2
21 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
22 1 1 . . . . . . . . 1 2 T H1' parsed_1bjh 2
22 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
23 1 1 . . . . . . . . 1 3 A H1' parsed_1bjh 2
23 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
24 1 1 . . . . . . . . 1 3 A H1' parsed_1bjh 2
24 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
25 1 1 . . . . . . . . 1 4 C H1' parsed_1bjh 2
25 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
26 1 1 . . . . . . . . 1 4 C H1' parsed_1bjh 2
26 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
27 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
27 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
28 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
28 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
29 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
29 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
30 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
30 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
31 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
31 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
32 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
32 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
33 1 1 . . . . . . . . 1 8 G H1' parsed_1bjh 2
33 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
34 1 1 . . . . . . . . 1 8 G H1' parsed_1bjh 2
34 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
35 1 1 . . . . . . . . 1 9 T H1' parsed_1bjh 2
35 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
36 1 1 . . . . . . . . 1 9 T H1' parsed_1bjh 2
36 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
37 1 1 . . . . . . . . 1 10 A H1' parsed_1bjh 2
37 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
38 1 1 . . . . . . . . 1 10 A H1' parsed_1bjh 2
38 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
39 1 1 . . . . . . . . 1 11 C3' H1' parsed_1bjh 2
39 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
40 1 1 . . . . . . . . 1 3 A H2 parsed_1bjh 2
40 1 2 . . . . . . . . 1 10 A H1' parsed_1bjh 2
41 1 1 . . . . . . . . 1 3 A H2 parsed_1bjh 2
41 1 2 . . . . . . . . 1 4 C H1' parsed_1bjh 2
42 1 1 . . . . . . . . 1 10 A H2 parsed_1bjh 2
42 1 2 . . . . . . . . 1 11 C3' H1' parsed_1bjh 2
43 1 1 . . . . . . . . 1 10 A H2 parsed_1bjh 2
43 1 2 . . . . . . . . 1 3 A H1' parsed_1bjh 2
44 1 1 . . . . . . . . 1 6 A H2 parsed_1bjh 2
44 1 2 . . . . . . . . 1 5 A H1' parsed_1bjh 2
45 1 1 . . . . . . . . 1 6 A H2 parsed_1bjh 2
45 1 2 . . . . . . . . 1 7 A H1' parsed_1bjh 2
46 1 1 . . . . . . . . 1 5 A H2 parsed_1bjh 2
46 1 2 . . . . . . . . 1 6 A H1' parsed_1bjh 2
47 1 1 . . . . . . . . 1 5 A H2 parsed_1bjh 2
47 1 2 . . . . . . . . 1 7 A H1' parsed_1bjh 2
48 1 1 . . . . . . . . 1 5 A H2 parsed_1bjh 2
48 1 2 . . . . . . . . 1 8 G H1' parsed_1bjh 2
49 1 1 . . . . . . . . 1 5 A H2 parsed_1bjh 2
49 1 2 . . . . . . . . 1 4 C H5 parsed_1bjh 2
50 1 1 . . . . . . . . 1 7 A H2 parsed_1bjh 2
50 1 2 . . . . . . . . 1 6 A H1' parsed_1bjh 2
51 1 1 . . . . . . . . 1 7 A H2 parsed_1bjh 2
51 1 2 . . . . . . . . 1 8 G H1' parsed_1bjh 2
52 1 1 . . . . . . . . 1 7 A H2 parsed_1bjh 2
52 1 2 . . . . . . . . 1 6 A H4' parsed_1bjh 2
53 1 1 . . . . . . . . 1 7 A H2 parsed_1bjh 2
53 1 2 . . . . . . . . 1 6 A H5'1 parsed_1bjh 2
54 1 1 . . . . . . . . 1 7 A H2 parsed_1bjh 2
54 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 2
55 1 1 . . . . . . . . 1 7 A H8 parsed_1bjh 2
55 1 2 . . . . . . . . 1 6 A H3' parsed_1bjh 2
56 1 1 . . . . . . . . 1 1 G5' H5'1 parsed_1bjh 2
56 1 2 . . . . . . . . 1 1 G5' H8 parsed_1bjh 2
57 1 1 . . . . . . . . 1 1 G5' H5'2 parsed_1bjh 2
57 1 2 . . . . . . . . 1 1 G5' H8 parsed_1bjh 2
58 1 1 . . . . . . . . 1 2 T H5'1 parsed_1bjh 2
58 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
59 1 1 . . . . . . . . 1 2 T H5'2 parsed_1bjh 2
59 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
60 1 1 . . . . . . . . 1 3 A H5'2 parsed_1bjh 2
60 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
61 1 1 . . . . . . . . 1 3 A H5'1 parsed_1bjh 2
61 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
62 1 1 . . . . . . . . 1 4 C H5'2 parsed_1bjh 2
62 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
63 1 1 . . . . . . . . 1 4 C H5'1 parsed_1bjh 2
63 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
64 1 1 . . . . . . . . 1 5 A H5'2 parsed_1bjh 2
64 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
65 1 1 . . . . . . . . 1 5 A H5'1 parsed_1bjh 2
65 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
66 1 1 . . . . . . . . 1 8 G H5'2 parsed_1bjh 2
66 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
67 1 1 . . . . . . . . 1 8 G H5'1 parsed_1bjh 2
67 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
68 1 1 . . . . . . . . 1 9 T H5'2 parsed_1bjh 2
68 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
69 1 1 . . . . . . . . 1 9 T H5'1 parsed_1bjh 2
69 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
70 1 1 . . . . . . . . 1 10 A H5'2 parsed_1bjh 2
70 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
71 1 1 . . . . . . . . 1 10 A H5'1 parsed_1bjh 2
71 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
72 1 1 . . . . . . . . 1 11 C3' H5'2 parsed_1bjh 2
72 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
73 1 1 . . . . . . . . 1 11 C3' H5'1 parsed_1bjh 2
73 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
74 1 1 . . . . . . . . 1 6 A H5'2 parsed_1bjh 2
74 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
75 1 1 . . . . . . . . 1 6 A H5'1 parsed_1bjh 2
75 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
76 1 1 . . . . . . . . 1 1 G5' H2'2 parsed_1bjh 2
76 1 2 . . . . . . . . 1 1 G5' H8 parsed_1bjh 2
77 1 1 . . . . . . . . 1 1 G5' H2'1 parsed_1bjh 2
77 1 2 . . . . . . . . 1 1 G5' H8 parsed_1bjh 2
78 1 1 . . . . . . . . 1 1 G5' H2'2 parsed_1bjh 2
78 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
79 1 1 . . . . . . . . 1 1 G5' H2'1 parsed_1bjh 2
79 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
80 1 1 . . . . . . . . 1 2 T H2'2 parsed_1bjh 2
80 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
81 1 1 . . . . . . . . 1 2 T H2'1 parsed_1bjh 2
81 1 2 . . . . . . . . 1 2 T H6 parsed_1bjh 2
82 1 1 . . . . . . . . 1 2 T H2'2 parsed_1bjh 2
82 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
83 1 1 . . . . . . . . 1 2 T H2'1 parsed_1bjh 2
83 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
84 1 1 . . . . . . . . 1 3 A H2'2 parsed_1bjh 2
84 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
85 1 1 . . . . . . . . 1 3 A H2'1 parsed_1bjh 2
85 1 2 . . . . . . . . 1 3 A H8 parsed_1bjh 2
86 1 1 . . . . . . . . 1 3 A H2'2 parsed_1bjh 2
86 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
87 1 1 . . . . . . . . 1 3 A H2'1 parsed_1bjh 2
87 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
88 1 1 . . . . . . . . 1 4 C H2'2 parsed_1bjh 2
88 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
89 1 1 . . . . . . . . 1 4 C H2'1 parsed_1bjh 2
89 1 2 . . . . . . . . 1 4 C H6 parsed_1bjh 2
90 1 1 . . . . . . . . 1 4 C H2'2 parsed_1bjh 2
90 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
91 1 1 . . . . . . . . 1 4 C H2'1 parsed_1bjh 2
91 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
92 1 1 . . . . . . . . 1 5 A H2'2 parsed_1bjh 2
92 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
93 1 1 . . . . . . . . 1 5 A H2'1 parsed_1bjh 2
93 1 2 . . . . . . . . 1 5 A H8 parsed_1bjh 2
94 1 1 . . . . . . . . 1 5 A H2'2 parsed_1bjh 2
94 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
95 1 1 . . . . . . . . 1 5 A H2'1 parsed_1bjh 2
95 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
96 1 1 . . . . . . . . 1 6 A H2'2 parsed_1bjh 2
96 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
97 1 1 . . . . . . . . 1 6 A H2'1 parsed_1bjh 2
97 1 2 . . . . . . . . 1 6 A H8 parsed_1bjh 2
98 1 1 . . . . . . . . 1 6 A H2'2 parsed_1bjh 2
98 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
99 1 1 . . . . . . . . 1 6 A H2'1 parsed_1bjh 2
99 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
100 1 1 . . . . . . . . 1 7 A H2'2 parsed_1bjh 2
100 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
101 1 1 . . . . . . . . 1 7 A H2'1 parsed_1bjh 2
101 1 2 . . . . . . . . 1 7 A H8 parsed_1bjh 2
102 1 1 . . . . . . . . 1 7 A H2'2 parsed_1bjh 2
102 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
103 1 1 . . . . . . . . 1 7 A H2'1 parsed_1bjh 2
103 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
104 1 1 . . . . . . . . 1 8 G H2'2 parsed_1bjh 2
104 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
105 1 1 . . . . . . . . 1 8 G H2'1 parsed_1bjh 2
105 1 2 . . . . . . . . 1 8 G H8 parsed_1bjh 2
106 1 1 . . . . . . . . 1 8 G H2'2 parsed_1bjh 2
106 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
107 1 1 . . . . . . . . 1 8 G H2'1 parsed_1bjh 2
107 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
108 1 1 . . . . . . . . 1 9 T H2'2 parsed_1bjh 2
108 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
109 1 1 . . . . . . . . 1 9 T H2'1 parsed_1bjh 2
109 1 2 . . . . . . . . 1 9 T H6 parsed_1bjh 2
110 1 1 . . . . . . . . 1 9 T H2'2 parsed_1bjh 2
110 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
111 1 1 . . . . . . . . 1 9 T H2'1 parsed_1bjh 2
111 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
112 1 1 . . . . . . . . 1 10 A H2'2 parsed_1bjh 2
112 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
113 1 1 . . . . . . . . 1 10 A H2'1 parsed_1bjh 2
113 1 2 . . . . . . . . 1 10 A H8 parsed_1bjh 2
114 1 1 . . . . . . . . 1 10 A H2'2 parsed_1bjh 2
114 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
115 1 1 . . . . . . . . 1 10 A H2'1 parsed_1bjh 2
115 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
116 1 1 . . . . . . . . 1 11 C3' H2'2 parsed_1bjh 2
116 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
117 1 1 . . . . . . . . 1 11 C3' H2'1 parsed_1bjh 2
117 1 2 . . . . . . . . 1 11 C3' H6 parsed_1bjh 2
118 1 1 . . . . . . . . 1 7 A H8 parsed_1bjh 2
118 1 2 . . . . . . . . 1 6 A H4' parsed_1bjh 2
119 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
119 1 2 . . . . . . . . 1 6 A H1' parsed_1bjh 2
120 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
120 1 2 . . . . . . . . 1 6 A H3' parsed_1bjh 2
121 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
121 1 2 . . . . . . . . 1 7 A H3' parsed_1bjh 2
122 1 1 . . . . . . . . 1 4 C H1' parsed_1bjh 2
122 1 2 . . . . . . . . 1 5 A H4' parsed_1bjh 2
123 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
123 1 2 . . . . . . . . 1 6 A H4' parsed_1bjh 2
124 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
124 1 2 . . . . . . . . 1 7 A H4' parsed_1bjh 2
125 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
125 1 2 . . . . . . . . 1 8 G H4' parsed_1bjh 2
126 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 2
126 1 2 . . . . . . . . 1 1 G5' H5'1 parsed_1bjh 2
127 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 2
127 1 2 . . . . . . . . 1 1 G5' H5'2 parsed_1bjh 2
128 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 2
128 1 2 . . . . . . . . 1 2 T H5'1 parsed_1bjh 2
129 1 1 . . . . . . . . 1 2 T H1' parsed_1bjh 2
129 1 2 . . . . . . . . 1 3 A H5'1 parsed_1bjh 2
130 1 1 . . . . . . . . 1 3 A H1' parsed_1bjh 2
130 1 2 . . . . . . . . 1 4 C H5'1 parsed_1bjh 2
131 1 1 . . . . . . . . 1 4 C H1' parsed_1bjh 2
131 1 2 . . . . . . . . 1 5 A H5'1 parsed_1bjh 2
132 1 1 . . . . . . . . 1 4 C H1' parsed_1bjh 2
132 1 2 . . . . . . . . 1 5 A H5'2 parsed_1bjh 2
133 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
133 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 2
134 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
134 1 2 . . . . . . . . 1 6 A H5'1 parsed_1bjh 2
135 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
135 1 2 . . . . . . . . 1 7 A H5'2 parsed_1bjh 2
136 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
136 1 2 . . . . . . . . 1 7 A H5'1 parsed_1bjh 2
137 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
137 1 2 . . . . . . . . 1 7 A H5'2 parsed_1bjh 2
138 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
138 1 2 . . . . . . . . 1 8 G H5'1 parsed_1bjh 2
139 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
139 1 2 . . . . . . . . 1 8 G H5'2 parsed_1bjh 2
140 1 1 . . . . . . . . 1 8 G H1' parsed_1bjh 2
140 1 2 . . . . . . . . 1 9 T H5'1 parsed_1bjh 2
141 1 1 . . . . . . . . 1 9 T H1' parsed_1bjh 2
141 1 2 . . . . . . . . 1 10 A H5'1 parsed_1bjh 2
142 1 1 . . . . . . . . 1 10 A H1' parsed_1bjh 2
142 1 2 . . . . . . . . 1 11 C3' H5'1 parsed_1bjh 2
143 1 1 . . . . . . . . 1 5 A H3' parsed_1bjh 2
143 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 2
144 1 1 . . . . . . . . 1 5 A H3' parsed_1bjh 2
144 1 2 . . . . . . . . 1 6 A H5'1 parsed_1bjh 2
145 1 1 . . . . . . . . 1 11 C3' H5 parsed_1bjh 2
145 1 2 . . . . . . . . 1 11 C3' H2'1 parsed_1bjh 2
146 1 1 . . . . . . . . 1 11 C3' H5 parsed_1bjh 2
146 1 2 . . . . . . . . 1 11 C3' H2'2 parsed_1bjh 2
147 1 1 . . . . . . . . 1 11 C3' H1' parsed_1bjh 2
147 1 2 . . . . . . . . 1 11 C3' H2'1 parsed_1bjh 2
148 1 1 . . . . . . . . 1 10 A H1' parsed_1bjh 2
148 1 2 . . . . . . . . 1 10 A H2'1 parsed_1bjh 2
149 1 1 . . . . . . . . 1 9 T H1' parsed_1bjh 2
149 1 2 . . . . . . . . 1 9 T H2'1 parsed_1bjh 2
150 1 1 . . . . . . . . 1 8 G H1' parsed_1bjh 2
150 1 2 . . . . . . . . 1 8 G H2'1 parsed_1bjh 2
151 1 1 . . . . . . . . 1 7 A H1' parsed_1bjh 2
151 1 2 . . . . . . . . 1 7 A H2'1 parsed_1bjh 2
152 1 1 . . . . . . . . 1 6 A H1' parsed_1bjh 2
152 1 2 . . . . . . . . 1 6 A H2'1 parsed_1bjh 2
153 1 1 . . . . . . . . 1 5 A H1' parsed_1bjh 2
153 1 2 . . . . . . . . 1 5 A H2'1 parsed_1bjh 2
154 1 1 . . . . . . . . 1 4 C H1' parsed_1bjh 2
154 1 2 . . . . . . . . 1 4 C H2'1 parsed_1bjh 2
155 1 1 . . . . . . . . 1 3 A H1' parsed_1bjh 2
155 1 2 . . . . . . . . 1 3 A H2'1 parsed_1bjh 2
156 1 1 . . . . . . . . 1 2 T H1' parsed_1bjh 2
156 1 2 . . . . . . . . 1 2 T H2'1 parsed_1bjh 2
157 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 2
157 1 2 . . . . . . . . 1 1 G5' H2'1 parsed_1bjh 2
158 1 1 . . . . . . . . 1 6 A H3' parsed_1bjh 2
158 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 2
159 1 1 . . . . . . . . 1 6 A H3' parsed_1bjh 2
159 1 2 . . . . . . . . 1 6 A H5'1 parsed_1bjh 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 . . . . . . 3.20 4.90 parsed_1bjh 2
2 1 . . . . . . 3.40 4.60 parsed_1bjh 2
3 1 . . . . . . 3.40 4.60 parsed_1bjh 2
4 1 . . . . . . 2.80 3.10 parsed_1bjh 2
5 1 . . . . . . 2.80 3.10 parsed_1bjh 2
6 1 . . . . . . 3.50 5.80 parsed_1bjh 2
7 1 . . . . . . 4.00 5.20 parsed_1bjh 2
8 1 . . . . . . 4.00 5.20 parsed_1bjh 2
9 1 . . . . . . 4.00 10.00 parsed_1bjh 2
10 1 . . . . . . 5.00 10.00 parsed_1bjh 2
11 1 . . . . . . 3.80 4.70 parsed_1bjh 2
12 1 . . . . . . 4.00 5.20 parsed_1bjh 2
13 1 . . . . . . 4.00 5.20 parsed_1bjh 2
14 1 . . . . . . 4.00 5.20 parsed_1bjh 2
15 1 . . . . . . 3.60 5.90 parsed_1bjh 2
16 1 . . . . . . 3.50 4.50 parsed_1bjh 2
17 1 . . . . . . 4.50 20.00 parsed_1bjh 2
18 1 . . . . . . 4.50 20.00 parsed_1bjh 2
19 1 . . . . . . 3.00 4.40 parsed_1bjh 2
20 1 . . . . . . 3.70 5.30 parsed_1bjh 2
21 1 . . . . . . 3.30 3.80 parsed_1bjh 2
22 1 . . . . . . 3.40 3.80 parsed_1bjh 2
23 1 . . . . . . 3.50 4.00 parsed_1bjh 2
24 1 . . . . . . 3.90 4.20 parsed_1bjh 2
25 1 . . . . . . 3.30 3.70 parsed_1bjh 2
26 1 . . . . . . 4.00 5.20 parsed_1bjh 2
27 1 . . . . . . 3.50 3.80 parsed_1bjh 2
28 1 . . . . . . 3.10 3.40 parsed_1bjh 2
29 1 . . . . . . 3.40 3.80 parsed_1bjh 2
30 1 . . . . . . 4.50 6.00 parsed_1bjh 2
31 1 . . . . . . 3.50 3.90 parsed_1bjh 2
32 1 . . . . . . 3.20 3.90 parsed_1bjh 2
33 1 . . . . . . 3.50 5.00 parsed_1bjh 2
34 1 . . . . . . 3.10 3.50 parsed_1bjh 2
35 1 . . . . . . 3.50 3.80 parsed_1bjh 2
36 1 . . . . . . 3.20 3.70 parsed_1bjh 2
37 1 . . . . . . 3.50 4.00 parsed_1bjh 2
38 1 . . . . . . 2.90 4.40 parsed_1bjh 2
39 1 . . . . . . 2.80 4.40 parsed_1bjh 2
40 1 . . . . . . 4.20 5.20 parsed_1bjh 2
41 1 . . . . . . 4.20 10.00 parsed_1bjh 2
42 1 . . . . . . 3.50 9.40 parsed_1bjh 2
43 1 . . . . . . 4.20 9.40 parsed_1bjh 2
44 1 . . . . . . 4.50 10.00 parsed_1bjh 2
45 1 . . . . . . 4.50 20.00 parsed_1bjh 2
46 1 . . . . . . 3.90 5.00 parsed_1bjh 2
47 1 . . . . . . 4.50 10.00 parsed_1bjh 2
48 1 . . . . . . 4.50 10.00 parsed_1bjh 2
49 1 . . . . . . 4.00 5.00 parsed_1bjh 2
50 1 . . . . . . 4.50 10.00 parsed_1bjh 2
51 1 . . . . . . 3.70 4.60 parsed_1bjh 2
52 1 . . . . . . 4.40 20.00 parsed_1bjh 2
53 1 . . . . . . 4.30 20.00 parsed_1bjh 2
54 1 . . . . . . 4.30 20.00 parsed_1bjh 2
55 1 . . . . . . 4.40 20.00 parsed_1bjh 2
56 1 . . . . . . 3.90 10.00 parsed_1bjh 2
57 1 . . . . . . 3.90 10.00 parsed_1bjh 2
58 1 . . . . . . 4.30 10.00 parsed_1bjh 2
59 1 . . . . . . 4.30 10.00 parsed_1bjh 2
60 1 . . . . . . 4.40 10.00 parsed_1bjh 2
61 1 . . . . . . 4.40 10.00 parsed_1bjh 2
62 1 . . . . . . 4.40 10.00 parsed_1bjh 2
63 1 . . . . . . 4.40 10.00 parsed_1bjh 2
64 1 . . . . . . 4.40 10.00 parsed_1bjh 2
65 1 . . . . . . 4.40 10.00 parsed_1bjh 2
66 1 . . . . . . 4.40 10.00 parsed_1bjh 2
67 1 . . . . . . 4.40 10.00 parsed_1bjh 2
68 1 . . . . . . 4.30 10.00 parsed_1bjh 2
69 1 . . . . . . 4.30 10.00 parsed_1bjh 2
70 1 . . . . . . 4.40 10.00 parsed_1bjh 2
71 1 . . . . . . 4.40 10.00 parsed_1bjh 2
72 1 . . . . . . 3.90 10.00 parsed_1bjh 2
73 1 . . . . . . 3.90 10.00 parsed_1bjh 2
74 1 . . . . . . 4.50 20.00 parsed_1bjh 2
75 1 . . . . . . 4.50 20.00 parsed_1bjh 2
76 1 . . . . . . 2.10 3.50 parsed_1bjh 2
77 1 . . . . . . 3.60 4.80 parsed_1bjh 2
78 1 . . . . . . 2.00 3.30 parsed_1bjh 2
79 1 . . . . . . 2.00 3.30 parsed_1bjh 2
80 1 . . . . . . 2.00 2.20 parsed_1bjh 2
81 1 . . . . . . 3.20 3.80 parsed_1bjh 2
82 1 . . . . . . 3.60 4.40 parsed_1bjh 2
83 1 . . . . . . 2.50 3.00 parsed_1bjh 2
84 1 . . . . . . 2.30 2.50 parsed_1bjh 2
85 1 . . . . . . 3.50 4.00 parsed_1bjh 2
86 1 . . . . . . 3.80 4.60 parsed_1bjh 2
87 1 . . . . . . 2.40 3.00 parsed_1bjh 2
88 1 . . . . . . 2.10 2.30 parsed_1bjh 2
89 1 . . . . . . 3.20 3.60 parsed_1bjh 2
90 1 . . . . . . 3.60 4.00 parsed_1bjh 2
91 1 . . . . . . 2.80 3.20 parsed_1bjh 2
92 1 . . . . . . 2.20 2.40 parsed_1bjh 2
93 1 . . . . . . 2.80 3.20 parsed_1bjh 2
94 1 . . . . . . 4.00 4.60 parsed_1bjh 2
95 1 . . . . . . 2.70 3.40 parsed_1bjh 2
96 1 . . . . . . 2.00 2.30 parsed_1bjh 2
97 1 . . . . . . 3.40 3.80 parsed_1bjh 2
98 1 . . . . . . 5.00 10.00 parsed_1bjh 2
99 1 . . . . . . 5.00 10.00 parsed_1bjh 2
100 1 . . . . . . 2.40 2.90 parsed_1bjh 2
101 1 . . . . . . 3.30 4.00 parsed_1bjh 2
102 1 . . . . . . 3.40 3.90 parsed_1bjh 2
103 1 . . . . . . 2.30 2.80 parsed_1bjh 2
104 1 . . . . . . 2.20 2.30 parsed_1bjh 2
105 1 . . . . . . 3.50 4.00 parsed_1bjh 2
106 1 . . . . . . 3.90 4.30 parsed_1bjh 2
107 1 . . . . . . 2.40 2.80 parsed_1bjh 2
108 1 . . . . . . 2.00 2.20 parsed_1bjh 2
109 1 . . . . . . 3.30 3.80 parsed_1bjh 2
110 1 . . . . . . 3.80 4.30 parsed_1bjh 2
111 1 . . . . . . 2.50 3.00 parsed_1bjh 2
112 1 . . . . . . 2.20 2.40 parsed_1bjh 2
113 1 . . . . . . 3.40 3.80 parsed_1bjh 2
114 1 . . . . . . 3.00 4.30 parsed_1bjh 2
115 1 . . . . . . 2.00 4.20 parsed_1bjh 2
116 1 . . . . . . 2.00 3.10 parsed_1bjh 2
117 1 . . . . . . 2.70 4.30 parsed_1bjh 2
118 1 . . . . . . 3.60 4.00 parsed_1bjh 2
119 1 . . . . . . 4.50 20.00 parsed_1bjh 2
120 1 . . . . . . 4.50 20.00 parsed_1bjh 2
121 1 . . . . . . 4.50 20.00 parsed_1bjh 2
122 1 . . . . . . 3.50 4.50 parsed_1bjh 2
123 1 . . . . . . 4.30 10.00 parsed_1bjh 2
124 1 . . . . . . 4.50 10.00 parsed_1bjh 2
125 1 . . . . . . 3.50 4.50 parsed_1bjh 2
126 1 . . . . . . 4.30 9.00 parsed_1bjh 2
127 1 . . . . . . 4.30 9.00 parsed_1bjh 2
128 1 . . . . . . 2.80 3.20 parsed_1bjh 2
129 1 . . . . . . 2.80 3.20 parsed_1bjh 2
130 1 . . . . . . 2.80 3.20 parsed_1bjh 2
131 1 . . . . . . 2.20 2.60 parsed_1bjh 2
132 1 . . . . . . 3.00 4.00 parsed_1bjh 2
133 1 . . . . . . 4.30 5.00 parsed_1bjh 2
134 1 . . . . . . 4.30 10.00 parsed_1bjh 2
135 1 . . . . . . 4.50 10.00 parsed_1bjh 2
136 1 . . . . . . 4.50 10.00 parsed_1bjh 2
137 1 . . . . . . 4.50 9.00 parsed_1bjh 2
138 1 . . . . . . 2.30 2.80 parsed_1bjh 2
139 1 . . . . . . 3.00 4.00 parsed_1bjh 2
140 1 . . . . . . 2.80 3.20 parsed_1bjh 2
141 1 . . . . . . 2.80 3.20 parsed_1bjh 2
142 1 . . . . . . 2.30 3.70 parsed_1bjh 2
143 1 . . . . . . 4.50 10.00 parsed_1bjh 2
144 1 . . . . . . 4.50 10.00 parsed_1bjh 2
145 1 . . . . . . 3.50 5.50 parsed_1bjh 2
146 1 . . . . . . 3.50 5.50 parsed_1bjh 2
147 1 . . . . . . 2.00 2.95 parsed_1bjh 2
148 1 . . . . . . 2.20 2.45 parsed_1bjh 2
149 1 . . . . . . 2.20 2.35 parsed_1bjh 2
150 1 . . . . . . 2.20 2.45 parsed_1bjh 2
151 1 . . . . . . 2.20 2.45 parsed_1bjh 2
152 1 . . . . . . 2.20 2.45 parsed_1bjh 2
153 1 . . . . . . 2.20 2.45 parsed_1bjh 2
154 1 . . . . . . 2.20 2.45 parsed_1bjh 2
155 1 . . . . . . 2.20 2.35 parsed_1bjh 2
156 1 . . . . . . 2.20 2.35 parsed_1bjh 2
157 1 . . . . . . 1.80 2.80 parsed_1bjh 2
158 1 . . . . . . 2.40 2.70 parsed_1bjh 2
159 1 . . . . . . 3.60 4.00 parsed_1bjh 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 "1:C_4:H1' 1:A_5:H3' 4.00 5.00 29.808 29.808 100.0" 149 1 149 80 parsed_1bjh 2
2 "1:A_7:H1' 1:G_8:H3' 4.00 5.00 29.808 29.808 100.0" 152 1 152 80 parsed_1bjh 2
stop_
save_
save_Discover_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bjh
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1bjh 3
2 1 . . . parsed_1bjh 3
3 1 . . . parsed_1bjh 3
4 1 . . . parsed_1bjh 3
5 1 . . . parsed_1bjh 3
6 1 . . . parsed_1bjh 3
7 1 . . . parsed_1bjh 3
8 1 . . . parsed_1bjh 3
9 1 . . . parsed_1bjh 3
10 1 . . . parsed_1bjh 3
11 1 . . . parsed_1bjh 3
12 1 . . . parsed_1bjh 3
13 1 . . . parsed_1bjh 3
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . 1 1 G5' H8 parsed_1bjh 3
1 1 2 . . . . . . . . 1 2 T C5M parsed_1bjh 3
2 1 1 . . . . . . . . 1 8 G H8 parsed_1bjh 3
2 1 2 . . . . . . . . 1 9 T C5M parsed_1bjh 3
3 1 1 . . . . . . . . 1 1 G5' H3' parsed_1bjh 3
3 1 2 . . . . . . . . 1 2 T C5M parsed_1bjh 3
4 1 1 . . . . . . . . 1 8 G H3' parsed_1bjh 3
4 1 2 . . . . . . . . 1 9 T C5M parsed_1bjh 3
5 1 1 . . . . . . . . 1 1 G5' H1' parsed_1bjh 3
5 1 2 . . . . . . . . 1 2 T C5M parsed_1bjh 3
6 1 1 . . . . . . . . 1 8 G H1' parsed_1bjh 3
6 1 2 . . . . . . . . 1 9 T C5M parsed_1bjh 3
7 1 1 . . . . . . . . 1 1 G5' H2'1 parsed_1bjh 3
7 1 2 . . . . . . . . 1 2 T C5M parsed_1bjh 3
8 1 1 . . . . . . . . 1 1 G5' H2'2 parsed_1bjh 3
8 1 2 . . . . . . . . 1 2 T C5M parsed_1bjh 3
9 1 1 . . . . . . . . 1 7 A H3' parsed_1bjh 3
9 1 2 . . . . . . . . 1 7 A H2'2 parsed_1bjh 3
10 1 1 . . . . . . . . 1 6 A H2'2 parsed_1bjh 3
10 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 3
11 1 1 . . . . . . . . 1 6 A H3' parsed_1bjh 3
11 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 3
12 1 1 . . . . . . . . 1 6 A H4' parsed_1bjh 3
12 1 2 . . . . . . . . 1 6 A H5'1 parsed_1bjh 3
13 1 1 . . . . . . . . 1 6 A H4' parsed_1bjh 3
13 1 2 . . . . . . . . 1 6 A H5'2 parsed_1bjh 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 3.60 6.00 parsed_1bjh 3
2 1 . . . . . . 4.10 6.00 parsed_1bjh 3
3 1 . . . . . . 3.30 4.20 parsed_1bjh 3
4 1 . . . . . . 3.50 5.20 parsed_1bjh 3
5 1 . . . . . . 4.40 8.50 parsed_1bjh 3
6 1 . . . . . . 4.40 8.00 parsed_1bjh 3
7 1 . . . . . . 3.50 4.90 parsed_1bjh 3
8 1 . . . . . . 2.00 3.40 parsed_1bjh 3
9 1 . . . . . . 2.50 2.80 parsed_1bjh 3
10 1 . . . . . . 3.80 4.50 parsed_1bjh 3
11 1 . . . . . . 2.80 3.50 parsed_1bjh 3
12 1 . . . . . . 2.50 2.80 parsed_1bjh 3
13 1 . . . . . . 2.20 2.50 parsed_1bjh 3
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 methal 1 1 1 7 parsed_1bjh 3
stop_
save_
save_Discover_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1bjh
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 6 A O3' 1 7 A P 1 7 A O5' 1 7 A C5' parsed_1bjh 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 7 A O5' 1 7 A C5' 1 7 A C4' 1 7 A C3' parsed_1bjh 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 7 A C4' 1 7 A C3' 1 7 A O3' 1 8 G P parsed_1bjh 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 7 A C3' 1 7 A O3' 1 8 G P 1 8 G O5' parsed_1bjh 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 5 A O3' 1 6 A P 1 6 A O5' 1 6 A C5' parsed_1bjh 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150.0 . 1 6 A P 1 6 A O5' 1 6 A C5' 1 6 A C4' parsed_1bjh 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 6 A O5' 1 6 A C5' 1 6 A C4' 1 6 A C3' parsed_1bjh 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 6 A C4' 1 6 A C3' 1 6 A O3' 1 7 A P parsed_1bjh 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 6 A C3' 1 6 A O3' 1 7 A P 1 7 A O5' parsed_1bjh 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 4 C O3' 1 5 A P 1 5 A O5' 1 5 A C5' parsed_1bjh 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 5 A P 1 5 A O5' 1 5 A C5' 1 5 A C4' parsed_1bjh 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 5 A O5' 1 5 A C5' 1 5 A C4' 1 5 A C3' parsed_1bjh 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 5 A C4' 1 5 A C3' 1 5 A O3' 1 6 A P parsed_1bjh 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 5 A C3' 1 5 A O3' 1 6 A P 1 6 A O5' parsed_1bjh 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 3 A O3' 1 4 C P 1 4 C O5' 1 4 C C5' parsed_1bjh 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 4 C P 1 4 C O5' 1 4 C C5' 1 4 C C4' parsed_1bjh 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 4 C O5' 1 4 C C5' 1 4 C C4' 1 4 C C3' parsed_1bjh 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 4 C C4' 1 4 C C3' 1 4 C O3' 1 5 A P parsed_1bjh 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 4 C C3' 1 4 C O3' 1 5 A P 1 5 A O5' parsed_1bjh 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 2 T O3' 1 3 A P 1 3 A O5' 1 3 A C5' parsed_1bjh 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 3 A P 1 3 A O5' 1 3 A C5' 1 3 A C4' parsed_1bjh 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 3 A O5' 1 3 A C5' 1 3 A C4' 1 3 A C3' parsed_1bjh 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 3 A C4' 1 3 A C3' 1 3 A O3' 1 4 C P parsed_1bjh 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 3 A C3' 1 3 A O3' 1 4 C P 1 4 C O5' parsed_1bjh 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 1 G5' O3' 1 2 T P 1 2 T O5' 1 2 T C5' parsed_1bjh 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 2 T P 1 2 T O5' 1 2 T C5' 1 2 T C4' parsed_1bjh 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 2 T O5' 1 2 T C5' 1 2 T C4' 1 2 T C3' parsed_1bjh 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 2 T C4' 1 2 T C3' 1 2 T O3' 1 3 A P parsed_1bjh 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 2 T C3' 1 2 T O3' 1 3 A P 1 3 A O5' parsed_1bjh 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 -110.0 . 1 1 G5' C4' 1 1 G5' C3' 1 1 G5' O3' 1 2 T P parsed_1bjh 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 1 G5' C3' 1 1 G5' O3' 1 2 T P 1 2 T O5' parsed_1bjh 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 7 A O3' 1 8 G P 1 8 G O5' 1 8 G C5' parsed_1bjh 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 8 G P 1 8 G O5' 1 8 G C5' 1 8 G C4' parsed_1bjh 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 8 G O5' 1 8 G C5' 1 8 G C4' 1 8 G C3' parsed_1bjh 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 8 G C4' 1 8 G C3' 1 8 G O3' 1 9 T P parsed_1bjh 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 8 G C3' 1 8 G O3' 1 9 T P 1 9 T O5' parsed_1bjh 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 8 G O3' 1 9 T P 1 9 T O5' 1 9 T C5' parsed_1bjh 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 9 T P 1 9 T O5' 1 9 T C5' 1 9 T C4' parsed_1bjh 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 9 T O5' 1 9 T C5' 1 9 T C4' 1 9 T C3' parsed_1bjh 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 9 T C4' 1 9 T C3' 1 9 T O3' 1 10 A P parsed_1bjh 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 9 T C3' 1 9 T O3' 1 10 A P 1 10 A O5' parsed_1bjh 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 9 T O3' 1 10 A P 1 10 A O5' 1 10 A C5' parsed_1bjh 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 10 A P 1 10 A O5' 1 10 A C5' 1 10 A C4' parsed_1bjh 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 10 A O5' 1 10 A C5' 1 10 A C4' 1 10 A C3' parsed_1bjh 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 10 A C4' 1 10 A C3' 1 10 A O3' 1 11 C3' P parsed_1bjh 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 10 A C3' 1 10 A O3' 1 11 C3' P 1 11 C3' O5' parsed_1bjh 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 10 A O3' 1 11 C3' P 1 11 C3' O5' 1 11 C3' C5' parsed_1bjh 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 -100.0 . 1 11 C3' P 1 11 C3' O5' 1 11 C3' C5' 1 11 C3' C4' parsed_1bjh 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10.0 110.0 . 1 11 C3' O5' 1 11 C3' C5' 1 11 C3' C4' 1 11 C3' C3' parsed_1bjh 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1
;
NMR_dihedral
7A
alpha
;
1 1 3 6 parsed_1bjh 1
2
;
beta temp
1:A_7:P 1:A_7:O5' 1:A_7:C5' 1:A_7:C4' 30.0 90.0 10.00 10.00 100.00
gamma
;
5 1 7 6 parsed_1bjh 1
3 epsilo 9 1 9 7 parsed_1bjh 1
4 zeta 11 1 11 5 parsed_1bjh 1
5
;
!
!
6A
Alpha
;
13 1 16 6 parsed_1bjh 1
6 "beta temp" 18 1 18 10 parsed_1bjh 1
7 gamma 20 1 20 6 parsed_1bjh 1
8 epsilo 22 1 22 7 parsed_1bjh 1
9 zeta 24 1 24 5 parsed_1bjh 1
10
;
!
!
5A
alpha
;
26 1 29 6 parsed_1bjh 1
11 "beta temp" 31 1 31 10 parsed_1bjh 1
12 gamma 33 1 33 6 parsed_1bjh 1
13 epsilo 35 1 35 7 parsed_1bjh 1
14 zeta 37 1 37 5 parsed_1bjh 1
15
;
!
!
4C
alpha
;
39 1 42 6 parsed_1bjh 1
16 "beta temp" 44 1 44 10 parsed_1bjh 1
17 gamma 46 1 46 6 parsed_1bjh 1
18 epsilo 48 1 48 7 parsed_1bjh 1
19 zeta 50 1 50 5 parsed_1bjh 1
20
;
!
!
3A
alpha
;
52 1 55 6 parsed_1bjh 1
21 "beta temp" 57 1 57 10 parsed_1bjh 1
22 gamma 59 1 59 6 parsed_1bjh 1
23 epsilo 61 1 61 7 parsed_1bjh 1
24 zeta 63 1 63 5 parsed_1bjh 1
25
;
!
!
2T
alpha
;
65 1 68 6 parsed_1bjh 1
26 "beta temp" 70 1 70 10 parsed_1bjh 1
27 gamma 72 1 72 6 parsed_1bjh 1
28 epsilo 74 1 74 7 parsed_1bjh 1
29 zeta 76 1 76 5 parsed_1bjh 1
30
;
!
!
1G
epsilo
;
78 1 81 7 parsed_1bjh 1
31 zeta 83 1 83 5 parsed_1bjh 1
32
;
!
!
8G
alpha
;
85 1 88 6 parsed_1bjh 1
33 "beta temp" 90 1 90 10 parsed_1bjh 1
34 gamma 92 1 92 6 parsed_1bjh 1
35 epsilo 94 1 94 7 parsed_1bjh 1
36 zeta 96 1 96 5 parsed_1bjh 1
37
;
!
!
9T
alpha
;
98 1 101 6 parsed_1bjh 1
38 "beta temp" 103 1 103 10 parsed_1bjh 1
39 gamma 105 1 105 6 parsed_1bjh 1
40 epsilo 107 1 107 7 parsed_1bjh 1
41 zeta 109 1 109 5 parsed_1bjh 1
42
;
!
!
10A
alpha
;
111 1 114 6 parsed_1bjh 1
43 "beta temp" 116 1 116 10 parsed_1bjh 1
44 gamma 118 1 118 6 parsed_1bjh 1
45 epsilo 120 1 120 7 parsed_1bjh 1
46 zeta 122 1 122 5 parsed_1bjh 1
47
;
!
!
11C
alpha
;
124 1 127 6 parsed_1bjh 1
48 "beta temp" 129 1 129 10 parsed_1bjh 1
49 gamma 131 1 131 6 parsed_1bjh 1
stop_
save_
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