NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
31667 |
1esh   |
cing | 2-parsed | STAR | entry | full | 296 |
data_1esh_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1esh
_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_1esh 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1esh
_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 1esh "Master copy" parsed_1esh
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1esh
_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 1esh.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 20 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 3 distance NOE simple 164 parsed_1esh 1
1 1esh.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 35 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 16 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 7 "dihedral angle" "Not applicable" "Not applicable" 12 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 12 parsed_1esh 1
1 1esh.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 37 parsed_1esh 1
1 1esh.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1esh 1
1 1esh.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1esh 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_1esh
_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 RNA 10-APR-00 1ESH
TITLE THE SOLUTION STRUCTURE OF THE STEM LOOP C 5'AUA3' TRILOOP
TITLE 2 OF BROME MOSAIC VIRUS (+) STRAND RNA
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: RNA (5'-R(*GP*GP*UP*GP*CP*AP*UP*AP*GP*CP*AP*CP*C)
COMPND 3 -3');
COMPND 4 CHAIN: A;
COMPND 5 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 OTHER_DETAILS: SEQUENCE OCCURS NATURALLY IN BROME MOSAIC
SOURCE 4 VIRUS EXCEPT FOR THE TERMINAL TWO GC BPS
KEYWDS RNA, TRILOOP, STEM-LOOP, BROME MOSAIC VIRUS
EXPDTA NMR
AUTHOR C.-H.KIM, C.C.KAO, I.TINOCO JR.
REVDAT 1 24-APR-00 1ESH 0
slc13.noe{slc13.noe for refinement and minimization}
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1esh
_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_1esh 1
2 1 . . . parsed_1esh 1
3 1 . . . parsed_1esh 1
4 1 . . . parsed_1esh 1
5 1 . . . parsed_1esh 1
6 1 . . . parsed_1esh 1
7 1 . . . parsed_1esh 1
8 1 . . . parsed_1esh 1
9 1 . . . parsed_1esh 1
10 1 . . . parsed_1esh 1
11 1 . . . parsed_1esh 1
12 1 . . . parsed_1esh 1
13 1 . . . parsed_1esh 1
14 1 . . . parsed_1esh 1
15 1 . . . parsed_1esh 1
16 1 . . . parsed_1esh 1
17 1 . . . parsed_1esh 1
18 1 . . . parsed_1esh 1
19 1 . . . parsed_1esh 1
20 1 . . . parsed_1esh 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 . . . . . . . . . 13 . h41 parsed_1esh 1
1 1 2 . . . . . . . . . 1 . o6 parsed_1esh 1
2 1 1 . . . . . . . . . 13 . n3 parsed_1esh 1
2 1 2 . . . . . . . . . 1 . h21 parsed_1esh 1
3 1 1 . . . . . . . . . 13 . o2 parsed_1esh 1
3 1 2 . . . . . . . . . 1 . h21 parsed_1esh 1
4 1 1 . . . . . . . . . 13 . n3 parsed_1esh 1
4 1 2 . . . . . . . . . 1 . h1 parsed_1esh 1
5 1 1 . . . . . . . . . 12 . h41 parsed_1esh 1
5 1 2 . . . . . . . . . 2 . o6 parsed_1esh 1
6 1 1 . . . . . . . . . 12 . n3 parsed_1esh 1
6 1 2 . . . . . . . . . 2 . h21 parsed_1esh 1
7 1 1 . . . . . . . . . 12 . o2 parsed_1esh 1
7 1 2 . . . . . . . . . 2 . h21 parsed_1esh 1
8 1 1 . . . . . . . . . 12 . n3 parsed_1esh 1
8 1 2 . . . . . . . . . 2 . h1 parsed_1esh 1
9 1 1 . . . . . . . . . 11 . h2 parsed_1esh 1
9 1 2 . . . . . . . . . 3 . o2 parsed_1esh 1
10 1 1 . . . . . . . . . 11 . n1 parsed_1esh 1
10 1 2 . . . . . . . . . 3 . h3 parsed_1esh 1
11 1 1 . . . . . . . . . 11 . h61 parsed_1esh 1
11 1 2 . . . . . . . . . 3 . o4 parsed_1esh 1
12 1 1 . . . . . . . . . 11 . h2 parsed_1esh 1
12 1 2 . . . . . . . . . 3 . h3 parsed_1esh 1
13 1 1 . . . . . . . . . 10 . h41 parsed_1esh 1
13 1 2 . . . . . . . . . 4 . o6 parsed_1esh 1
14 1 1 . . . . . . . . . 10 . n3 parsed_1esh 1
14 1 2 . . . . . . . . . 4 . h21 parsed_1esh 1
15 1 1 . . . . . . . . . 10 . o2 parsed_1esh 1
15 1 2 . . . . . . . . . 4 . h21 parsed_1esh 1
16 1 1 . . . . . . . . . 10 . n3 parsed_1esh 1
16 1 2 . . . . . . . . . 4 . h1 parsed_1esh 1
17 1 1 . . . . . . . . . 5 . h41 parsed_1esh 1
17 1 2 . . . . . . . . . 9 . o6 parsed_1esh 1
18 1 1 . . . . . . . . . 5 . n3 parsed_1esh 1
18 1 2 . . . . . . . . . 9 . h21 parsed_1esh 1
19 1 1 . . . . . . . . . 5 . o2 parsed_1esh 1
19 1 2 . . . . . . . . . 9 . h21 parsed_1esh 1
20 1 1 . . . . . . . . . 5 . n3 parsed_1esh 1
20 1 2 . . . . . . . . . 9 . h1 parsed_1esh 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 . . . . . 1.7 1.6 1.8 parsed_1esh 1
2 1 . . . . . 3.0 2.9 3.1 parsed_1esh 1
3 1 . . . . . 2.0 1.9 2.1 parsed_1esh 1
4 1 . . . . . 1.9 1.8 2.0 parsed_1esh 1
5 1 . . . . . 1.7 1.6 1.8 parsed_1esh 1
6 1 . . . . . 3.0 2.9 3.1 parsed_1esh 1
7 1 . . . . . 2.0 1.9 2.1 parsed_1esh 1
8 1 . . . . . 1.9 1.8 2.0 parsed_1esh 1
9 1 . . . . . 3.2 3.1 3.3 parsed_1esh 1
10 1 . . . . . 1.9 1.8 2.0 parsed_1esh 1
11 1 . . . . . 1.8 1.7 1.9 parsed_1esh 1
12 1 . . . . . 2.9 2.8 3.0 parsed_1esh 1
13 1 . . . . . 1.7 1.6 1.8 parsed_1esh 1
14 1 . . . . . 3.0 2.9 3.1 parsed_1esh 1
15 1 . . . . . 2.0 1.9 2.1 parsed_1esh 1
16 1 . . . . . 1.9 1.8 2.0 parsed_1esh 1
17 1 . . . . . 1.7 1.6 1.8 parsed_1esh 1
18 1 . . . . . 3.0 2.9 3.1 parsed_1esh 1
19 1 . . . . . 2.0 1.9 2.1 parsed_1esh 1
20 1 . . . . . 1.9 1.8 2.0 parsed_1esh 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 "BASE PAIRING - based on standard H-bond distances" 1 1 1 1 parsed_1esh 1
2 "base pair G1-C13" 3 2 3 2 parsed_1esh 1
3 "base pair G2-C12" 9 2 9 2 parsed_1esh 1
4 "base pairing U3-A11" 15 7 15 7 parsed_1esh 1
5 "base pair G4-C10" 21 9 21 9 parsed_1esh 1
6 "base pair C5-G9" 27 3 27 3 parsed_1esh 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1esh
_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_1esh 2
2 1 . . . parsed_1esh 2
3 1 . . . parsed_1esh 2
4 1 . . . parsed_1esh 2
5 1 . . . parsed_1esh 2
6 1 . . . parsed_1esh 2
7 1 . . . parsed_1esh 2
8 1 . . . parsed_1esh 2
9 1 . . . parsed_1esh 2
10 1 . . . parsed_1esh 2
11 1 . . . parsed_1esh 2
12 1 . . . parsed_1esh 2
13 1 . . . parsed_1esh 2
14 1 . . . parsed_1esh 2
15 1 . . . parsed_1esh 2
16 1 . . . parsed_1esh 2
17 1 . . . parsed_1esh 2
18 1 . . . parsed_1esh 2
19 1 . . . parsed_1esh 2
20 1 . . . parsed_1esh 2
21 1 . . . parsed_1esh 2
22 1 . . . parsed_1esh 2
23 1 . . . parsed_1esh 2
24 1 . . . parsed_1esh 2
25 1 . . . parsed_1esh 2
26 1 . . . parsed_1esh 2
27 1 . . . parsed_1esh 2
28 1 . . . parsed_1esh 2
29 1 . . . parsed_1esh 2
30 1 . . . parsed_1esh 2
31 1 . . . parsed_1esh 2
32 1 . . . parsed_1esh 2
33 1 . . . parsed_1esh 2
34 1 . . . parsed_1esh 2
35 1 . . . parsed_1esh 2
36 1 . . . parsed_1esh 2
37 1 . . . parsed_1esh 2
38 1 . . . parsed_1esh 2
39 1 . . . parsed_1esh 2
40 1 . . . parsed_1esh 2
41 1 . . . parsed_1esh 2
42 1 . . . parsed_1esh 2
43 1 . . . parsed_1esh 2
44 1 . . . parsed_1esh 2
45 1 . . . parsed_1esh 2
46 1 . . . parsed_1esh 2
47 1 . . . parsed_1esh 2
48 1 . . . parsed_1esh 2
49 1 . . . parsed_1esh 2
50 1 . . . parsed_1esh 2
51 1 . . . parsed_1esh 2
52 1 . . . parsed_1esh 2
53 1 . . . parsed_1esh 2
54 1 . . . parsed_1esh 2
55 1 . . . parsed_1esh 2
56 1 . . . parsed_1esh 2
57 1 . . . parsed_1esh 2
58 1 . . . parsed_1esh 2
59 1 . . . parsed_1esh 2
60 1 . . . parsed_1esh 2
61 1 . . . parsed_1esh 2
62 1 . . . parsed_1esh 2
63 1 . . . parsed_1esh 2
64 1 . . . parsed_1esh 2
65 1 . . . parsed_1esh 2
66 1 . . . parsed_1esh 2
67 1 . . . parsed_1esh 2
68 1 . . . parsed_1esh 2
69 1 . . . parsed_1esh 2
70 1 . . . parsed_1esh 2
71 1 . . . parsed_1esh 2
72 1 . . . parsed_1esh 2
73 1 . . . parsed_1esh 2
74 1 . . . parsed_1esh 2
75 1 . . . parsed_1esh 2
76 1 . . . parsed_1esh 2
77 1 . . . parsed_1esh 2
78 1 . . . parsed_1esh 2
79 1 . . . parsed_1esh 2
80 1 . . . parsed_1esh 2
81 1 . . . parsed_1esh 2
82 1 . . . parsed_1esh 2
83 1 . . . parsed_1esh 2
84 1 . . . parsed_1esh 2
85 1 . . . parsed_1esh 2
86 1 . . . parsed_1esh 2
87 1 . . . parsed_1esh 2
88 1 . . . parsed_1esh 2
89 1 . . . parsed_1esh 2
90 1 . . . parsed_1esh 2
91 1 . . . parsed_1esh 2
92 1 . . . parsed_1esh 2
93 1 . . . parsed_1esh 2
94 1 . . . parsed_1esh 2
95 1 . . . parsed_1esh 2
96 1 . . . parsed_1esh 2
97 1 . . . parsed_1esh 2
98 1 . . . parsed_1esh 2
99 1 . . . parsed_1esh 2
100 1 . . . parsed_1esh 2
101 1 . . . parsed_1esh 2
102 1 . . . parsed_1esh 2
103 1 . . . parsed_1esh 2
104 1 . . . parsed_1esh 2
105 1 . . . parsed_1esh 2
106 1 . . . parsed_1esh 2
107 1 . . . parsed_1esh 2
108 1 . . . parsed_1esh 2
109 1 . . . parsed_1esh 2
110 1 . . . parsed_1esh 2
111 1 . . . parsed_1esh 2
112 1 . . . parsed_1esh 2
113 1 . . . parsed_1esh 2
114 1 . . . parsed_1esh 2
115 1 . . . parsed_1esh 2
116 1 . . . parsed_1esh 2
117 1 . . . parsed_1esh 2
118 1 . . . parsed_1esh 2
119 1 . . . parsed_1esh 2
120 1 . . . parsed_1esh 2
121 1 . . . parsed_1esh 2
122 1 . . . parsed_1esh 2
123 1 . . . parsed_1esh 2
124 1 . . . parsed_1esh 2
125 1 . . . parsed_1esh 2
126 1 . . . parsed_1esh 2
127 1 . . . parsed_1esh 2
128 1 . . . parsed_1esh 2
129 1 . . . parsed_1esh 2
130 1 . . . parsed_1esh 2
131 1 . . . parsed_1esh 2
132 1 . . . parsed_1esh 2
133 1 . . . parsed_1esh 2
134 1 . . . parsed_1esh 2
135 1 . . . parsed_1esh 2
136 1 . . . parsed_1esh 2
137 1 . . . parsed_1esh 2
138 1 . . . parsed_1esh 2
139 1 . . . parsed_1esh 2
140 1 . . . parsed_1esh 2
141 1 . . . parsed_1esh 2
142 1 . . . parsed_1esh 2
143 1 . . . parsed_1esh 2
144 1 . . . parsed_1esh 2
145 1 . . . parsed_1esh 2
146 1 . . . parsed_1esh 2
147 1 . . . parsed_1esh 2
148 1 . . . parsed_1esh 2
149 1 . . . parsed_1esh 2
150 1 . . . parsed_1esh 2
151 1 . . . parsed_1esh 2
152 1 . . . parsed_1esh 2
153 1 . . . parsed_1esh 2
154 1 . . . parsed_1esh 2
155 1 . . . parsed_1esh 2
156 1 . . . parsed_1esh 2
157 1 . . . parsed_1esh 2
158 1 . . . parsed_1esh 2
159 1 . . . parsed_1esh 2
160 1 . . . parsed_1esh 2
161 1 . . . parsed_1esh 2
162 1 . . . parsed_1esh 2
163 1 . . . parsed_1esh 2
164 1 . . . parsed_1esh 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 . . . . . . . . . 2 . h1 parsed_1esh 2
1 1 2 . . . . . . . . . 3 . h3 parsed_1esh 2
2 1 1 . . . . . . . . . 3 . h3 parsed_1esh 2
2 1 2 . . . . . . . . . 4 . h1 parsed_1esh 2
3 1 1 . . . . . . . . . 4 . h1 parsed_1esh 2
3 1 2 . . . . . . . . . 9 . h1 parsed_1esh 2
4 1 1 . . . . . . . . . 2 . h1 parsed_1esh 2
4 1 2 . . . . . . . . . 12 . h41 parsed_1esh 2
5 1 1 . . . . . . . . . 2 . h1 parsed_1esh 2
5 1 2 . . . . . . . . . 12 . h42 parsed_1esh 2
6 1 1 . . . . . . . . . 3 . h3 parsed_1esh 2
6 1 2 . . . . . . . . . 11 . h2 parsed_1esh 2
7 1 1 . . . . . . . . . 4 . h1 parsed_1esh 2
7 1 2 . . . . . . . . . 10 . h41 parsed_1esh 2
8 1 1 . . . . . . . . . 4 . h1 parsed_1esh 2
8 1 2 . . . . . . . . . 10 . h42 parsed_1esh 2
9 1 1 . . . . . . . . . 9 . h1 parsed_1esh 2
9 1 2 . . . . . . . . . 5 . h41 parsed_1esh 2
10 1 1 . . . . . . . . . 9 . h1 parsed_1esh 2
10 1 2 . . . . . . . . . 5 . h42 parsed_1esh 2
11 1 1 . . . . . . . . . 9 . h1 parsed_1esh 2
11 1 2 . . . . . . . . . 6 . h1' parsed_1esh 2
12 1 1 . . . . . . . . . 9 . h1 parsed_1esh 2
12 1 2 . . . . . . . . . 8 . h2 parsed_1esh 2
13 1 1 . . . . . . . . . 1 . h1' parsed_1esh 2
13 1 2 . . . . . . . . . 1 . h2'' parsed_1esh 2
14 1 1 . . . . . . . . . 1 . h8 parsed_1esh 2
14 1 2 . . . . . . . . . 1 . h1' parsed_1esh 2
15 1 1 . . . . . . . . . 1 . h8 parsed_1esh 2
15 1 2 . . . . . . . . . 1 . h2'' parsed_1esh 2
16 1 1 . . . . . . . . . 1 . h8 parsed_1esh 2
16 1 2 . . . . . . . . . 1 . h3' parsed_1esh 2
17 1 1 . . . . . . . . . 1 . h8 parsed_1esh 2
17 1 2 . . . . . . . . . 2 . h8 parsed_1esh 2
18 1 1 . . . . . . . . . 1 . h8 parsed_1esh 2
18 1 2 . . . . . . . . . 1 . h4' parsed_1esh 2
19 1 1 . . . . . . . . . 2 . h1' parsed_1esh 2
19 1 2 . . . . . . . . . 2 . h2'' parsed_1esh 2
20 1 1 . . . . . . . . . 2 . h1' parsed_1esh 2
20 1 2 . . . . . . . . . 3 . h5 parsed_1esh 2
21 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
21 1 2 . . . . . . . . . 1 . h1' parsed_1esh 2
22 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
22 1 2 . . . . . . . . . 2 . h1' parsed_1esh 2
23 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
23 1 2 . . . . . . . . . 1 . h2'' parsed_1esh 2
24 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
24 1 2 . . . . . . . . . 1 . h3' parsed_1esh 2
25 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
25 1 2 . . . . . . . . . 2 . h3' parsed_1esh 2
26 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
26 1 2 . . . . . . . . . 3 . h6 parsed_1esh 2
27 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
27 1 2 . . . . . . . . . 3 . h5 parsed_1esh 2
28 1 1 . . . . . . . . . 2 . h8 parsed_1esh 2
28 1 2 . . . . . . . . . 2 . h4' parsed_1esh 2
29 1 1 . . . . . . . . . 3 . h1' parsed_1esh 2
29 1 2 . . . . . . . . . 3 . h2'' parsed_1esh 2
30 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
30 1 2 . . . . . . . . . 2 . h1' parsed_1esh 2
31 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
31 1 2 . . . . . . . . . 3 . h1' parsed_1esh 2
32 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
32 1 2 . . . . . . . . . 2 . h2'' parsed_1esh 2
33 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
33 1 2 . . . . . . . . . 3 . h2'' parsed_1esh 2
34 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
34 1 2 . . . . . . . . . 3 . h5 parsed_1esh 2
35 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
35 1 2 . . . . . . . . . 4 . h8 parsed_1esh 2
36 1 1 . . . . . . . . . 3 . h6 parsed_1esh 2
36 1 2 . . . . . . . . . 3 . h3' parsed_1esh 2
37 1 1 . . . . . . . . . 4 . h1' parsed_1esh 2
37 1 2 . . . . . . . . . 4 . h2'' parsed_1esh 2
38 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
38 1 2 . . . . . . . . . 4 . h1' parsed_1esh 2
39 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
39 1 2 . . . . . . . . . 3 . h1' parsed_1esh 2
40 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
40 1 2 . . . . . . . . . 3 . h2'' parsed_1esh 2
41 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
41 1 2 . . . . . . . . . 3 . h3' parsed_1esh 2
42 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
42 1 2 . . . . . . . . . 4 . h2'' parsed_1esh 2
43 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
43 1 2 . . . . . . . . . 4 . h3' parsed_1esh 2
44 1 1 . . . . . . . . . 4 . h8 parsed_1esh 2
44 1 2 . . . . . . . . . 5 . h6 parsed_1esh 2
45 1 1 . . . . . . . . . 5 . h1' parsed_1esh 2
45 1 2 . . . . . . . . . 5 . h2'' parsed_1esh 2
46 1 1 . . . . . . . . . 5 . h1' parsed_1esh 2
46 1 2 . . . . . . . . . 4 . h2'' parsed_1esh 2
47 1 1 . . . . . . . . . 5 . h1' parsed_1esh 2
47 1 2 . . . . . . . . . 5 . h5 parsed_1esh 2
48 1 1 . . . . . . . . . 5 . h5 parsed_1esh 2
48 1 2 . . . . . . . . . 4 . h2'' parsed_1esh 2
49 1 1 . . . . . . . . . 5 . h5 parsed_1esh 2
49 1 2 . . . . . . . . . 4 . h3' parsed_1esh 2
50 1 1 . . . . . . . . . 5 . h5 parsed_1esh 2
50 1 2 . . . . . . . . . 5 . h6 parsed_1esh 2
51 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
51 1 2 . . . . . . . . . 4 . h2'' parsed_1esh 2
52 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
52 1 2 . . . . . . . . . 5 . h2'' parsed_1esh 2
53 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
53 1 2 . . . . . . . . . 4 . h1' parsed_1esh 2
54 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
54 1 2 . . . . . . . . . 4 . h3' parsed_1esh 2
55 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
55 1 2 . . . . . . . . . 5 . h3' parsed_1esh 2
56 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
56 1 2 . . . . . . . . . 5 . h1' parsed_1esh 2
57 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
57 1 2 . . . . . . . . . 6 . h8 parsed_1esh 2
58 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
58 1 2 . . . . . . . . . 5 . h4' parsed_1esh 2
59 1 1 . . . . . . . . . 5 . h6 parsed_1esh 2
59 1 2 . . . . . . . . . 5 . h5' parsed_1esh 2
60 1 1 . . . . . . . . . 6 . h1' parsed_1esh 2
60 1 2 . . . . . . . . . 5 . h5' parsed_1esh 2
61 1 1 . . . . . . . . . 6 . h1' parsed_1esh 2
61 1 2 . . . . . . . . . 6 . h2'' parsed_1esh 2
62 1 1 . . . . . . . . . 6 . h1' parsed_1esh 2
62 1 2 . . . . . . . . . 6 . h5' parsed_1esh 2
63 1 1 . . . . . . . . . 6 . h1' parsed_1esh 2
63 1 2 . . . . . . . . . 7 . h4' parsed_1esh 2
64 1 1 . . . . . . . . . 6 . h1' parsed_1esh 2
64 1 2 . . . . . . . . . 7 . h2'' parsed_1esh 2
65 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
65 1 2 . . . . . . . . . 5 . h2'' parsed_1esh 2
66 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
66 1 2 . . . . . . . . . 6 . h2'' parsed_1esh 2
67 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
67 1 2 . . . . . . . . . 6 . h1' parsed_1esh 2
68 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
68 1 2 . . . . . . . . . 5 . h1' parsed_1esh 2
69 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
69 1 2 . . . . . . . . . 5 . h4' parsed_1esh 2
70 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
70 1 2 . . . . . . . . . 5 . h3' parsed_1esh 2
71 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
71 1 2 . . . . . . . . . 6 . h3' parsed_1esh 2
72 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
72 1 2 . . . . . . . . . 6 . h4' parsed_1esh 2
73 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
73 1 2 . . . . . . . . . 6 . h5' parsed_1esh 2
74 1 1 . . . . . . . . . 6 . h8 parsed_1esh 2
74 1 2 . . . . . . . . . 5 . h5' parsed_1esh 2
75 1 1 . . . . . . . . . 6 . h2 parsed_1esh 2
75 1 2 . . . . . . . . . 6 . h1' parsed_1esh 2
76 1 1 . . . . . . . . . 6 . h2 parsed_1esh 2
76 1 2 . . . . . . . . . 6 . h2'' parsed_1esh 2
77 1 1 . . . . . . . . . 7 . h1' parsed_1esh 2
77 1 2 . . . . . . . . . 7 . h2'' parsed_1esh 2
78 1 1 . . . . . . . . . 7 . h1' parsed_1esh 2
78 1 2 . . . . . . . . . 7 . h3' parsed_1esh 2
79 1 1 . . . . . . . . . 7 . h1' parsed_1esh 2
79 1 2 . . . . . . . . . 7 . h4' parsed_1esh 2
80 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
80 1 2 . . . . . . . . . 7 . h5 parsed_1esh 2
81 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
81 1 2 . . . . . . . . . 7 . h2'' parsed_1esh 2
82 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
82 1 2 . . . . . . . . . 7 . h1' parsed_1esh 2
83 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
83 1 2 . . . . . . . . . 6 . h1' parsed_1esh 2
84 1 1 . . . . . . . . . 7 . h5 parsed_1esh 2
84 1 2 . . . . . . . . . 6 . h1' parsed_1esh 2
85 1 1 . . . . . . . . . 7 . h5 parsed_1esh 2
85 1 2 . . . . . . . . . 6 . h4' parsed_1esh 2
86 1 1 . . . . . . . . . 7 . h5 parsed_1esh 2
86 1 2 . . . . . . . . . 7 . h2'' parsed_1esh 2
87 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
87 1 2 . . . . . . . . . 7 . h3' parsed_1esh 2
88 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
88 1 2 . . . . . . . . . 6 . h2'' parsed_1esh 2
89 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
89 1 2 . . . . . . . . . 6 . h3' parsed_1esh 2
90 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
90 1 2 . . . . . . . . . 6 . h4' parsed_1esh 2
91 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
91 1 2 . . . . . . . . . 7 . h4' parsed_1esh 2
92 1 1 . . . . . . . . . 7 . h6 parsed_1esh 2
92 1 2 . . . . . . . . . 7 . h5' parsed_1esh 2
93 1 1 . . . . . . . . . 8 . h1' parsed_1esh 2
93 1 2 . . . . . . . . . 8 . h2'' parsed_1esh 2
94 1 1 . . . . . . . . . 8 . h1' parsed_1esh 2
94 1 2 . . . . . . . . . 7 . h4' parsed_1esh 2
95 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
95 1 2 . . . . . . . . . 7 . h1' parsed_1esh 2
96 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
96 1 2 . . . . . . . . . 7 . h2'' parsed_1esh 2
97 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
97 1 2 . . . . . . . . . 8 . h1' parsed_1esh 2
98 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
98 1 2 . . . . . . . . . 8 . h2'' parsed_1esh 2
99 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
99 1 2 . . . . . . . . . 8 . h3' parsed_1esh 2
100 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
100 1 2 . . . . . . . . . 7 . h4' parsed_1esh 2
101 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
101 1 2 . . . . . . . . . 9 . h1' parsed_1esh 2
102 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
102 1 2 . . . . . . . . . 8 . h4' parsed_1esh 2
103 1 1 . . . . . . . . . 8 . h8 parsed_1esh 2
103 1 2 . . . . . . . . . 8 . h5' parsed_1esh 2
104 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
104 1 2 . . . . . . . . . 6 . h1' parsed_1esh 2
105 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
105 1 2 . . . . . . . . . 8 . h1' parsed_1esh 2
106 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
106 1 2 . . . . . . . . . 8 . h3' parsed_1esh 2
107 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
107 1 2 . . . . . . . . . 5 . h2'' parsed_1esh 2
108 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
108 1 2 . . . . . . . . . 5 . h1' parsed_1esh 2
109 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
109 1 2 . . . . . . . . . 7 . h1' parsed_1esh 2
110 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
110 1 2 . . . . . . . . . 7 . h4' parsed_1esh 2
111 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
111 1 2 . . . . . . . . . 7 . h5' parsed_1esh 2
112 1 1 . . . . . . . . . 8 . h2 parsed_1esh 2
112 1 2 . . . . . . . . . 6 . h2'' parsed_1esh 2
113 1 1 . . . . . . . . . 9 . h1' parsed_1esh 2
113 1 2 . . . . . . . . . 9 . h2'' parsed_1esh 2
114 1 1 . . . . . . . . . 9 . h1' parsed_1esh 2
114 1 2 . . . . . . . . . 8 . h2'' parsed_1esh 2
115 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
115 1 2 . . . . . . . . . 9 . h1' parsed_1esh 2
116 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
116 1 2 . . . . . . . . . 9 . h2'' parsed_1esh 2
117 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
117 1 2 . . . . . . . . . 9 . h3' parsed_1esh 2
118 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
118 1 2 . . . . . . . . . 9 . h4' parsed_1esh 2
119 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
119 1 2 . . . . . . . . . 10 . h5 parsed_1esh 2
120 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
120 1 2 . . . . . . . . . 10 . h6 parsed_1esh 2
121 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
121 1 2 . . . . . . . . . 8 . h5' parsed_1esh 2
122 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
122 1 2 . . . . . . . . . 8 . h5'' parsed_1esh 2
123 1 1 . . . . . . . . . 9 . h8 parsed_1esh 2
123 1 2 . . . . . . . . . 9 . h5' parsed_1esh 2
124 1 1 . . . . . . . . . 10 . h1' parsed_1esh 2
124 1 2 . . . . . . . . . 10 . h2'' parsed_1esh 2
125 1 1 . . . . . . . . . 10 . h1' parsed_1esh 2
125 1 2 . . . . . . . . . 10 . h5 parsed_1esh 2
126 1 1 . . . . . . . . . 10 . h5 parsed_1esh 2
126 1 2 . . . . . . . . . 9 . h2'' parsed_1esh 2
127 1 1 . . . . . . . . . 10 . h5 parsed_1esh 2
127 1 2 . . . . . . . . . 11 . h2'' parsed_1esh 2
128 1 1 . . . . . . . . . 10 . h6 parsed_1esh 2
128 1 2 . . . . . . . . . 10 . h5 parsed_1esh 2
129 1 1 . . . . . . . . . 10 . h6 parsed_1esh 2
129 1 2 . . . . . . . . . 9 . h1' parsed_1esh 2
130 1 1 . . . . . . . . . 10 . h6 parsed_1esh 2
130 1 2 . . . . . . . . . 9 . h2'' parsed_1esh 2
131 1 1 . . . . . . . . . 10 . h6 parsed_1esh 2
131 1 2 . . . . . . . . . 9 . h4' parsed_1esh 2
132 1 1 . . . . . . . . . 10 . h6 parsed_1esh 2
132 1 2 . . . . . . . . . 10 . h1' parsed_1esh 2
133 1 1 . . . . . . . . . 10 . h6 parsed_1esh 2
133 1 2 . . . . . . . . . 10 . h2'' parsed_1esh 2
134 1 1 . . . . . . . . . 11 . h1' parsed_1esh 2
134 1 2 . . . . . . . . . 11 . h2'' parsed_1esh 2
135 1 1 . . . . . . . . . 11 . h1' parsed_1esh 2
135 1 2 . . . . . . . . . 12 . h5 parsed_1esh 2
136 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
136 1 2 . . . . . . . . . 11 . h1' parsed_1esh 2
137 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
137 1 2 . . . . . . . . . 11 . h2'' parsed_1esh 2
138 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
138 1 2 . . . . . . . . . 11 . h3' parsed_1esh 2
139 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
139 1 2 . . . . . . . . . 11 . h4' parsed_1esh 2
140 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
140 1 2 . . . . . . . . . 10 . h1' parsed_1esh 2
141 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
141 1 2 . . . . . . . . . 10 . h2'' parsed_1esh 2
142 1 1 . . . . . . . . . 11 . h8 parsed_1esh 2
142 1 2 . . . . . . . . . 10 . h6 parsed_1esh 2
143 1 1 . . . . . . . . . 11 . h2 parsed_1esh 2
143 1 2 . . . . . . . . . 4 . h1' parsed_1esh 2
144 1 1 . . . . . . . . . 11 . h2 parsed_1esh 2
144 1 2 . . . . . . . . . 12 . h1' parsed_1esh 2
145 1 1 . . . . . . . . . 11 . h2 parsed_1esh 2
145 1 2 . . . . . . . . . 11 . h1' parsed_1esh 2
146 1 1 . . . . . . . . . 12 . h1' parsed_1esh 2
146 1 2 . . . . . . . . . 12 . h2'' parsed_1esh 2
147 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
147 1 2 . . . . . . . . . 12 . h5 parsed_1esh 2
148 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
148 1 2 . . . . . . . . . 11 . h8 parsed_1esh 2
149 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
149 1 2 . . . . . . . . . 11 . h1' parsed_1esh 2
150 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
150 1 2 . . . . . . . . . 11 . h2'' parsed_1esh 2
151 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
151 1 2 . . . . . . . . . 12 . h1' parsed_1esh 2
152 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
152 1 2 . . . . . . . . . 12 . h2' parsed_1esh 2
153 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
153 1 2 . . . . . . . . . 12 . h3' parsed_1esh 2
154 1 1 . . . . . . . . . 12 . h6 parsed_1esh 2
154 1 2 . . . . . . . . . 12 . h4' parsed_1esh 2
155 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
155 1 2 . . . . . . . . . 13 . h5 parsed_1esh 2
156 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
156 1 2 . . . . . . . . . 12 . h6 parsed_1esh 2
157 1 1 . . . . . . . . . 13 . h1' parsed_1esh 2
157 1 2 . . . . . . . . . 13 . h2'' parsed_1esh 2
158 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
158 1 2 . . . . . . . . . 12 . h2'' parsed_1esh 2
159 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
159 1 2 . . . . . . . . . 12 . h1' parsed_1esh 2
160 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
160 1 2 . . . . . . . . . 13 . h1' parsed_1esh 2
161 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
161 1 2 . . . . . . . . . 13 . h2'' parsed_1esh 2
162 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
162 1 2 . . . . . . . . . 13 . h3' parsed_1esh 2
163 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
163 1 2 . . . . . . . . . 12 . h3' parsed_1esh 2
164 1 1 . . . . . . . . . 13 . h6 parsed_1esh 2
164 1 2 . . . . . . . . . 13 . h4' parsed_1esh 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 1.8 5.0 parsed_1esh 2
2 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
3 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
4 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
5 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
6 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
7 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
8 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
9 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
10 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
11 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
12 1 . . . . . 1.8 1.8 5.0 parsed_1esh 2
13 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
14 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
15 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
16 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
17 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
18 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
19 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
20 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
21 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
22 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
23 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
24 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
25 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
26 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
27 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
28 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
29 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
30 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
31 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
32 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
33 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
34 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
35 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
36 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
37 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
38 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
39 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
40 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
41 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
42 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
43 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
44 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
45 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
46 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
47 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
48 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
49 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
50 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
51 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
52 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
53 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
54 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
55 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
56 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
57 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
58 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
59 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
60 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
61 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
62 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
63 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
64 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
65 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
66 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
67 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
68 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
69 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
70 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
71 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
72 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
73 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
74 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
75 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
76 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
77 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
78 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
79 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
80 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
81 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
82 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
83 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
84 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
85 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
86 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
87 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
88 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
89 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
90 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
91 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
92 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
93 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
94 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
95 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
96 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
97 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
98 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
99 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
100 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
101 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
102 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
103 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
104 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
105 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
106 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
107 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
108 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
109 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
110 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
111 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
112 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
113 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
114 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
115 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
116 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
117 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
118 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
119 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
120 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
121 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
122 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
123 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
124 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
125 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
126 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
127 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
128 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
129 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
130 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
131 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
132 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
133 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
134 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
135 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
136 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
137 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
138 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
139 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
140 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
141 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
142 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
143 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
144 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
145 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
146 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
147 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
148 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
149 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
150 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
151 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
152 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
153 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
154 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
155 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
156 1 . . . . . 3.0 3.0 7.0 parsed_1esh 2
157 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
158 1 . . . . . 1.8 1.8 3.2 parsed_1esh 2
159 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
160 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
161 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
162 1 . . . . . 2.0 2.0 4.0 parsed_1esh 2
163 1 . . . . . 2.5 2.5 5.0 parsed_1esh 2
164 1 . . . . . 3.0 3.0 7.0 parsed_1esh 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 "DISTANCE RESTRICTIONS FOR EXCHANGEABLE PROTONS FROM THE H2O NOESY" 1 1 1 1 parsed_1esh 2
2 "from 200ms H2O NOESY at 20c and 300ms H2O NOESY at 10c" 3 1 3 1 parsed_1esh 2
3 "imino proton to imino proton" 5 1 5 1 parsed_1esh 2
4 "imino proton to amino proton A h2 proton aromatic proton, or" 11 3 11 3 parsed_1esh 2
5 "Distance restriction for nonexchangeable protons from D2O NOESY" 23 1 23 1 parsed_1esh 2
6 G1 25 1 25 1 parsed_1esh 2
7 G2 33 1 33 1 parsed_1esh 2
8 U3 46 1 46 1 parsed_1esh 2
9 G4 60 1 60 1 parsed_1esh 2
10 C5 71 1 71 1 parsed_1esh 2
11 A6 89 1 89 1 parsed_1esh 2
12 U7 109 1 109 1 parsed_1esh 2
13 A8 129 1 129 1 parsed_1esh 2
14 G9 154 1 154 1 parsed_1esh 2
15 C10 169 1 169 1 parsed_1esh 2
16 A11 182 1 182 1 parsed_1esh 2
17 C12 197 1 197 1 parsed_1esh 2
18 C13 209 1 209 1 parsed_1esh 2
stop_
save_
save_MR_file_comment_4
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1esh
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 4
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
slc13.dihed {Torsion angle constraints of slc-13 RNA}
{used for refinement and minimization }
constraints
dihedral
reset
;
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1esh
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 1 . h22 . 1 . n2 . 1 . c2 . 1 . n3 parsed_1esh 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 2 . h22 . 2 . n2 . 2 . c2 . 2 . n3 parsed_1esh 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 4 . h22 . 4 . n2 . 4 . c2 . 4 . n3 parsed_1esh 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 9 . h22 . 9 . n2 . 9 . c2 . 9 . n3 parsed_1esh 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 5 . h42 . 5 . n4 . 5 . c4 . 5 . c5 parsed_1esh 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 10 . h42 . 10 . n4 . 10 . c4 . 10 . c5 parsed_1esh 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 12 . h42 . 12 . n4 . 12 . c4 . 12 . c5 parsed_1esh 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 13 . h42 . 13 . n4 . 13 . c4 . 13 . c5 parsed_1esh 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 6 . h62 . 6 . n6 . 6 . c6 . 6 . c5 parsed_1esh 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 8 . h62 . 8 . n6 . 8 . c6 . 8 . c5 parsed_1esh 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 11 . h62 . 11 . n6 . 11 . c6 . 11 . c5 parsed_1esh 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 2 . c4' . 2 . o4' . 2 . c1' . 2 . c2' parsed_1esh 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 -17 . . 2 . o4' . 2 . c1' . 2 . c2' . 2 . c3' parsed_1esh 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31 41 . . 2 . c1' . 2 . c2' . 2 . c3' . 2 . c4' parsed_1esh 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41 -31 . . 2 . c2' . 2 . c3' . 2 . c4' . 2 . o4' parsed_1esh 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 3 . c4' . 3 . o4' . 3 . c1' . 3 . c2' parsed_1esh 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 -17 . . 3 . o4' . 3 . c1' . 3 . c2' . 3 . c3' parsed_1esh 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31 41 . . 3 . c1' . 3 . c2' . 3 . c3' . 3 . c4' parsed_1esh 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41 -31 . . 3 . c2' . 3 . c3' . 3 . c4' . 3 . o4' parsed_1esh 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 4 . c4' . 4 . o4' . 4 . c1' . 4 . c2' parsed_1esh 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 -17 . . 4 . o4' . 4 . c1' . 4 . c2' . 4 . c3' parsed_1esh 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31 41 . . 4 . c1' . 4 . c2' . 4 . c3' . 4 . c4' parsed_1esh 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41 -31 . . 4 . c2' . 4 . c3' . 4 . c4' . 4 . o4' parsed_1esh 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 10 . c4' . 10 . o4' . 10 . c1' . 10 . c2' parsed_1esh 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 -17 . . 10 . o4' . 10 . c1' . 10 . c2' . 10 . c3' parsed_1esh 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31 41 . . 10 . c1' . 10 . c2' . 10 . c3' . 10 . c4' parsed_1esh 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41 -31 . . 10 . c2' . 10 . c3' . 10 . c4' . 10 . o4' parsed_1esh 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 11 . c4' . 11 . o4' . 11 . c1' . 11 . c2' parsed_1esh 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 -17 . . 11 . o4' . 11 . c1' . 11 . c2' . 11 . c3' parsed_1esh 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31 41 . . 11 . c1' . 11 . c2' . 11 . c3' . 11 . c4' parsed_1esh 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41 -31 . . 11 . c2' . 11 . c3' . 11 . c4' . 11 . o4' parsed_1esh 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -5 5 . . 12 . c4' . 12 . o4' . 12 . c1' . 12 . c2' parsed_1esh 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 -17 . . 12 . o4' . 12 . c1' . 12 . c2' . 12 . c3' parsed_1esh 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31 41 . . 12 . c1' . 12 . c2' . 12 . c3' . 12 . c4' parsed_1esh 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41 -31 . . 12 . c2' . 12 . c3' . 12 . c4' . 12 . o4' parsed_1esh 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 "Keep G amino groups in the plane of the base" 1 1 1 1 parsed_1esh 1
2 "Keep C amino groups in the plane of the base" 12 1 12 1 parsed_1esh 1
3 "Keep A amino groups in the plane of the base" 23 1 23 1 parsed_1esh 1
4 "Make some nucleotides c3'-endo, restrain v0, v1,v2, and v3 instead of delta" 31 1 31 1 parsed_1esh 1
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1esh
_Torsion_angle_constraint_list.ID 2
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 0 . . 1 . c4' . 1 . o4' . 1 . c1' . 1 . c2' parsed_1esh 2
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10 40 . . 1 . o4' . 1 . c1' . 1 . c2' . 1 . c3' parsed_1esh 2
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35 35 . . 1 . c1' . 1 . c2' . 1 . c3' . 1 . c4' parsed_1esh 2
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 40 . . 1 . c2' . 1 . c3' . 1 . c4' . 1 . o4' parsed_1esh 2
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 0 . . 5 . c4' . 5 . o4' . 5 . c1' . 5 . c2' parsed_1esh 2
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10 40 . . 5 . o4' . 5 . c1' . 5 . c2' . 5 . c3' parsed_1esh 2
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35 35 . . 5 . c1' . 5 . c2' . 5 . c3' . 5 . c4' parsed_1esh 2
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 40 . . 5 . c2' . 5 . c3' . 5 . c4' . 5 . o4' parsed_1esh 2
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 0 . . 8 . c4' . 8 . o4' . 8 . c1' . 8 . c2' parsed_1esh 2
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10 40 . . 8 . o4' . 8 . c1' . 8 . c2' . 8 . c3' parsed_1esh 2
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35 35 . . 8 . c1' . 8 . c2' . 8 . c3' . 8 . c4' parsed_1esh 2
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 40 . . 8 . c2' . 8 . c3' . 8 . c4' . 8 . o4' parsed_1esh 2
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 0 . . 13 . c4' . 13 . o4' . 13 . c1' . 13 . c2' parsed_1esh 2
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10 40 . . 13 . o4' . 13 . c1' . 13 . c2' . 13 . c3' parsed_1esh 2
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35 35 . . 13 . c1' . 13 . c2' . 13 . c3' . 13 . c4' parsed_1esh 2
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40 40 . . 13 . c2' . 13 . c3' . 13 . c4' . 13 . o4' parsed_1esh 2
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 "Sugar puckering between 2'-endo and 3'-endo" 1 1 1 1 parsed_1esh 2
stop_
save_
save_CNS/XPLOR_dihedral_7
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1esh
_Torsion_angle_constraint_list.ID 3
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 7
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -23 -13 . . 6 . c4' . 6 . o4' . 6 . c1' . 6 . c2' parsed_1esh 3
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29 39 . . 6 . o4' . 6 . c1' . 6 . c2' . 6 . c3' parsed_1esh 3
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42 -32 . . 6 . c1' . 6 . c2' . 6 . c3' . 6 . c4' parsed_1esh 3
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21 31 . . 6 . c2' . 6 . c3' . 6 . c4' . 6 . o4' parsed_1esh 3
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -23 -13 . . 7 . c4' . 7 . o4' . 7 . c1' . 7 . c2' parsed_1esh 3
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29 39 . . 7 . o4' . 7 . c1' . 7 . c2' . 7 . c3' parsed_1esh 3
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42 -32 . . 7 . c1' . 7 . c2' . 7 . c3' . 7 . c4' parsed_1esh 3
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21 31 . . 7 . c2' . 7 . c3' . 7 . c4' . 7 . o4' parsed_1esh 3
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -23 -13 . . 9 . c4' . 9 . o4' . 9 . c1' . 9 . c2' parsed_1esh 3
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 29 39 . . 9 . o4' . 9 . c1' . 9 . c2' . 9 . c3' parsed_1esh 3
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42 -32 . . 9 . c1' . 9 . c2' . 9 . c3' . 9 . c4' parsed_1esh 3
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21 31 . . 9 . c2' . 9 . c3' . 9 . c4' . 9 . o4' parsed_1esh 3
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 "sugar puckering of 2'-endo" 1 1 1 1 parsed_1esh 3
stop_
save_
save_CNS/XPLOR_dihedral_8
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1esh
_Torsion_angle_constraint_list.ID 4
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 8
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 1 . o4' . 1 . c1' . 1 . n9 . 1 . c4 parsed_1esh 4
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 2 . o4' . 2 . c1' . 2 . n9 . 2 . c4 parsed_1esh 4
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 3 . o4' . 3 . c1' . 3 . n1 . 3 . c2 parsed_1esh 4
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 4 . o4' . 4 . c1' . 4 . n9 . 4 . c4 parsed_1esh 4
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 5 . o4' . 5 . c1' . 5 . n1 . 5 . c2 parsed_1esh 4
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 6 . o4' . 6 . c1' . 6 . n9 . 6 . c4 parsed_1esh 4
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 7 . o4' . 7 . c1' . 7 . n1 . 7 . c2 parsed_1esh 4
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 9 . o4' . 9 . c1' . 9 . n9 . 9 . c4 parsed_1esh 4
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 10 . o4' . 10 . c1' . 10 . n1 . 10 . c2 parsed_1esh 4
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 11 . o4' . 11 . c1' . 11 . n9 . 11 . c4 parsed_1esh 4
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 12 . o4' . 12 . c1' . 12 . n1 . 12 . c2 parsed_1esh 4
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210 -110 . . 13 . o4' . 13 . c1' . 13 . n1 . 13 . c2 parsed_1esh 4
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 "Restriction of nucleotides to anti" 1 1 1 1 parsed_1esh 4
stop_
save_
save_CNS/XPLOR_dihedral_9
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1esh
_Torsion_angle_constraint_list.ID 5
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 9
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10 70 . . 8 . o4' . 8 . c1' . 8 . n9 . 8 . c4 parsed_1esh 5
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 2 . p . 2 . o5' . 2 . c5' . 2 . c4' parsed_1esh 5
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 3 . p . 3 . o5' . 3 . c5' . 3 . c4' parsed_1esh 5
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 4 . p . 4 . o5' . 4 . c5' . 4 . c4' parsed_1esh 5
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 10 . p . 10 . o5' . 10 . c5' . 10 . c4' parsed_1esh 5
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 11 . p . 11 . o5' . 11 . c5' . 11 . c4' parsed_1esh 5
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 12 . p . 12 . o5' . 12 . c5' . 12 . c4' parsed_1esh 5
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 13 . p . 13 . o5' . 13 . c5' . 13 . c4' parsed_1esh 5
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 1 . o5' . 1 . c5' . 1 . c4' . 1 . c3' parsed_1esh 5
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 2 . o5' . 2 . c5' . 2 . c4' . 2 . c3' parsed_1esh 5
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 3 . o5' . 3 . c5' . 3 . c4' . 3 . c3' parsed_1esh 5
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 4 . o5' . 4 . c5' . 4 . c4' . 4 . c3' parsed_1esh 5
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 10 . o5' . 10 . c5' . 10 . c4' . 10 . c3' parsed_1esh 5
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 11 . o5' . 11 . c5' . 11 . c4' . 11 . c3' parsed_1esh 5
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 12 . o5' . 12 . c5' . 12 . c4' . 12 . c3' parsed_1esh 5
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25 85 . . 13 . o5' . 13 . c5' . 13 . c4' . 13 . c3' parsed_1esh 5
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 1 . c4' . 1 . c3' . 1 . o3' . 2 . p parsed_1esh 5
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 2 . c4' . 2 . c3' . 2 . o3' . 3 . p parsed_1esh 5
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 3 . c4' . 3 . c3' . 3 . o3' . 4 . p parsed_1esh 5
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 4 . c4' . 4 . c3' . 4 . o3' . 5 . p parsed_1esh 5
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 10 . c4' . 10 . c3' . 10 . o3' . 11 . p parsed_1esh 5
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 11 . c4' . 11 . c3' . 11 . o3' . 12 . p parsed_1esh 5
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -135 . . 12 . c4' . 12 . c3' . 12 . o3' . 13 . p parsed_1esh 5
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 1 . o3' . 2 . p . 2 . o5' . 2 . c5' parsed_1esh 5
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 2 . o3' . 3 . p . 3 . o5' . 3 . c5' parsed_1esh 5
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 3 . o3' . 4 . p . 4 . o5' . 4 . c5' parsed_1esh 5
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 4 . o3' . 5 . p . 5 . o5' . 5 . c5' parsed_1esh 5
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 10 . o3' . 11 . p . 11 . o5' . 11 . c5' parsed_1esh 5
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 11 . o3' . 12 . p . 12 . o5' . 12 . c5' parsed_1esh 5
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 12 . o3' . 13 . p . 13 . o5' . 13 . c5' parsed_1esh 5
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 1 . c3' . 1 . o3' . 2 . p . 2 . o5' parsed_1esh 5
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 2 . c3' . 2 . o3' . 3 . p . 3 . o5' parsed_1esh 5
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 3 . c3' . 3 . o3' . 4 . p . 4 . o5' parsed_1esh 5
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 4 . c3' . 4 . o3' . 5 . p . 5 . o5' parsed_1esh 5
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 10 . c3' . 10 . o3' . 11 . p . 11 . o5' parsed_1esh 5
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 11 . c3' . 11 . o3' . 12 . p . 12 . o5' parsed_1esh 5
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100 -40 . . 12 . c3' . 12 . o3' . 13 . p . 13 . o5' parsed_1esh 5
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 "Restriction of nucleotides to syn" 1 1 1 1 parsed_1esh 5
2 "backbone torsion angle beta - standard A form from Kieft" 6 1 6 1 parsed_1esh 5
3 "used in refinement only" 7 1 7 1 parsed_1esh 5
4 "Restrain all the residues to standard A form except for loop and closing bp" 8 1 8 1 parsed_1esh 5
5 "backbone torsion angle gamma - standard A form from Kieft" 27 1 27 1 parsed_1esh 5
6 "used in refinement only" 28 1 28 1 parsed_1esh 5
7 "Restrain all the residues to standard A form except for loop and closing bp" 29 1 29 1 parsed_1esh 5
8 "backbone torsion angle epsilon- standard A form from Kieft" 49 1 49 1 parsed_1esh 5
9 "used in refinement only" 50 1 50 1 parsed_1esh 5
10 "Restrain all the residues to standard A form except for loop and closing bp" 51 1 51 1 parsed_1esh 5
11 "backbone torsion angle alpha- standard A form from Kieft" 69 1 69 1 parsed_1esh 5
12 "used in refinement only" 70 1 70 1 parsed_1esh 5
13 "Restrain all the stem to standard A form except for loop and closing bp" 71 1 71 1 parsed_1esh 5
14 "backbone torsion angle zeta -standard A form from Michael" 90 1 90 1 parsed_1esh 5
15 "used in refinement only" 91 1 91 1 parsed_1esh 5
16 "Restrain all the stem to standard A form except for loop and closing bp" 92 1 92 1 parsed_1esh 5
stop_
save_
save_MR_file_comment_10
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1esh
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 10
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
end
end
;
save_
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