NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
536513 |
2lbj   |
17563 | cing | 2-parsed | STAR | entry | full | 370 |
data_2lbj_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lbj
_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_2lbj 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lbj
_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 2lbj "Master copy" parsed_2lbj
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lbj
_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 2lbj.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lbj 1
1 2lbj.mr . . XPLOR/CNS 2 distance NOE simple 211 parsed_2lbj 1
1 2lbj.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 28 parsed_2lbj 1
1 2lbj.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 131 parsed_2lbj 1
1 2lbj.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lbj 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_2lbj
_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 31-MAR-11 2LBJ
*TITLE GLYCYL-TRNA(GCC) ANTICODON STEM-LOOP FROM BACILLUS SUBTILIS
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: RNA (5'-
*COMPND 3 R(*GP*GP*GP*CP*CP*UP*UP*GP*CP*CP*AP*AP*GP*GP*UP*CP*C)-3');
*COMPND 4 CHAIN: A;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES
*KEYWDS ANTICODON STEM-LOOP, RNA
*EXPDTA SOLUTION NMR
*NUMMDL 8
*AUTHOR A.T.CHANG, E.P.NIKONOWICZ
*REVDAT 1 04-APR-12 2LBJ 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2lbj
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_2lbj 1
2 1 . . . parsed_2lbj 1
3 1 . . . parsed_2lbj 1
4 1 . . . parsed_2lbj 1
5 1 . . . parsed_2lbj 1
6 1 . . . parsed_2lbj 1
7 1 . . . parsed_2lbj 1
8 1 . . . parsed_2lbj 1
9 1 . . . parsed_2lbj 1
10 1 . . . parsed_2lbj 1
11 1 . . . parsed_2lbj 1
12 1 . . . parsed_2lbj 1
13 1 . . . parsed_2lbj 1
14 1 . . . parsed_2lbj 1
15 1 . . . parsed_2lbj 1
16 1 . . . parsed_2lbj 1
17 1 . . . parsed_2lbj 1
18 1 . . . parsed_2lbj 1
19 1 . . . parsed_2lbj 1
20 1 . . . parsed_2lbj 1
21 1 . . . parsed_2lbj 1
22 1 . . . parsed_2lbj 1
23 1 . . . parsed_2lbj 1
24 1 . . . parsed_2lbj 1
25 1 . . . parsed_2lbj 1
26 1 . . . parsed_2lbj 1
27 1 . . . parsed_2lbj 1
28 1 . . . parsed_2lbj 1
29 1 . . . parsed_2lbj 1
30 1 . . . parsed_2lbj 1
31 1 . . . parsed_2lbj 1
32 1 . . . parsed_2lbj 1
33 1 . . . parsed_2lbj 1
34 1 . . . parsed_2lbj 1
35 1 . . . parsed_2lbj 1
36 1 . . . parsed_2lbj 1
37 1 . . . parsed_2lbj 1
38 1 . . . parsed_2lbj 1
39 1 . . . parsed_2lbj 1
40 1 . . . parsed_2lbj 1
41 1 . . . parsed_2lbj 1
42 1 . . . parsed_2lbj 1
43 1 . . . parsed_2lbj 1
44 1 . . . parsed_2lbj 1
45 1 . . . parsed_2lbj 1
46 1 . . . parsed_2lbj 1
47 1 . . . parsed_2lbj 1
48 1 . . . parsed_2lbj 1
49 1 . . . parsed_2lbj 1
50 1 . . . parsed_2lbj 1
51 1 . . . parsed_2lbj 1
52 1 . . . parsed_2lbj 1
53 1 . . . parsed_2lbj 1
54 1 . . . parsed_2lbj 1
55 1 . . . parsed_2lbj 1
56 1 . . . parsed_2lbj 1
57 1 . . . parsed_2lbj 1
58 1 . . . parsed_2lbj 1
59 1 . . . parsed_2lbj 1
60 1 . . . parsed_2lbj 1
61 1 . . . parsed_2lbj 1
62 1 . . . parsed_2lbj 1
63 1 . . . parsed_2lbj 1
64 1 . . . parsed_2lbj 1
65 1 . . . parsed_2lbj 1
66 1 . . . parsed_2lbj 1
67 1 . . . parsed_2lbj 1
68 1 . . . parsed_2lbj 1
69 1 . . . parsed_2lbj 1
70 1 . . . parsed_2lbj 1
71 1 . . . parsed_2lbj 1
72 1 . . . parsed_2lbj 1
73 1 . . . parsed_2lbj 1
74 1 . . . parsed_2lbj 1
75 1 . . . parsed_2lbj 1
76 1 . . . parsed_2lbj 1
77 1 . . . parsed_2lbj 1
78 1 . . . parsed_2lbj 1
79 1 . . . parsed_2lbj 1
80 1 . . . parsed_2lbj 1
81 1 . . . parsed_2lbj 1
82 1 . . . parsed_2lbj 1
83 1 . . . parsed_2lbj 1
84 1 . . . parsed_2lbj 1
85 1 . . . parsed_2lbj 1
86 1 . . . parsed_2lbj 1
87 1 . . . parsed_2lbj 1
88 1 . . . parsed_2lbj 1
89 1 . . . parsed_2lbj 1
90 1 . . . parsed_2lbj 1
91 1 . . . parsed_2lbj 1
92 1 . . . parsed_2lbj 1
93 1 . . . parsed_2lbj 1
94 1 . . . parsed_2lbj 1
95 1 . . . parsed_2lbj 1
96 1 . . . parsed_2lbj 1
97 1 . . . parsed_2lbj 1
98 1 . . . parsed_2lbj 1
99 1 . . . parsed_2lbj 1
100 1 . . . parsed_2lbj 1
101 1 . . . parsed_2lbj 1
102 1 . . . parsed_2lbj 1
103 1 . . . parsed_2lbj 1
104 1 . . . parsed_2lbj 1
105 1 . . . parsed_2lbj 1
106 1 . . . parsed_2lbj 1
107 1 . . . parsed_2lbj 1
108 1 . . . parsed_2lbj 1
109 1 . . . parsed_2lbj 1
110 1 . . . parsed_2lbj 1
111 1 . . . parsed_2lbj 1
112 1 . . . parsed_2lbj 1
113 1 . . . parsed_2lbj 1
114 1 . . . parsed_2lbj 1
115 1 . . . parsed_2lbj 1
116 1 . . . parsed_2lbj 1
117 1 . . . parsed_2lbj 1
118 1 . . . parsed_2lbj 1
119 1 . . . parsed_2lbj 1
120 1 . . . parsed_2lbj 1
121 1 . . . parsed_2lbj 1
122 1 . . . parsed_2lbj 1
123 1 . . . parsed_2lbj 1
124 1 . . . parsed_2lbj 1
125 1 . . . parsed_2lbj 1
126 1 . . . parsed_2lbj 1
127 1 . . . parsed_2lbj 1
128 1 . . . parsed_2lbj 1
129 1 . . . parsed_2lbj 1
130 1 . . . parsed_2lbj 1
131 1 . . . parsed_2lbj 1
132 1 . . . parsed_2lbj 1
133 1 . . . parsed_2lbj 1
134 1 . . . parsed_2lbj 1
135 1 . . . parsed_2lbj 1
136 1 . . . parsed_2lbj 1
137 1 . . . parsed_2lbj 1
138 1 . . . parsed_2lbj 1
139 1 . . . parsed_2lbj 1
140 1 . . . parsed_2lbj 1
141 1 . . . parsed_2lbj 1
142 1 . . . parsed_2lbj 1
143 1 . . . parsed_2lbj 1
144 1 . . . parsed_2lbj 1
145 1 . . . parsed_2lbj 1
146 1 . . . parsed_2lbj 1
147 1 . . . parsed_2lbj 1
148 1 . . . parsed_2lbj 1
149 1 . . . parsed_2lbj 1
150 1 . . . parsed_2lbj 1
151 1 . . . parsed_2lbj 1
152 1 . . . parsed_2lbj 1
153 1 . . . parsed_2lbj 1
154 1 . . . parsed_2lbj 1
155 1 . . . parsed_2lbj 1
156 1 . . . parsed_2lbj 1
157 1 . . . parsed_2lbj 1
158 1 . . . parsed_2lbj 1
159 1 . . . parsed_2lbj 1
160 1 . . . parsed_2lbj 1
161 1 . . . parsed_2lbj 1
162 1 . . . parsed_2lbj 1
163 1 . . . parsed_2lbj 1
164 1 . . . parsed_2lbj 1
165 1 . . . parsed_2lbj 1
166 1 . . . parsed_2lbj 1
167 1 . . . parsed_2lbj 1
168 1 . . . parsed_2lbj 1
169 1 . . . parsed_2lbj 1
170 1 . . . parsed_2lbj 1
171 1 . . . parsed_2lbj 1
172 1 . . . parsed_2lbj 1
173 1 . . . parsed_2lbj 1
174 1 . . . parsed_2lbj 1
175 1 . . . parsed_2lbj 1
176 1 . . . parsed_2lbj 1
177 1 . . . parsed_2lbj 1
178 1 . . . parsed_2lbj 1
179 1 . . . parsed_2lbj 1
180 1 . . . parsed_2lbj 1
181 1 . . . parsed_2lbj 1
182 1 . . . parsed_2lbj 1
183 1 . . . parsed_2lbj 1
184 1 . . . parsed_2lbj 1
185 1 . . . parsed_2lbj 1
186 1 . . . parsed_2lbj 1
187 1 . . . parsed_2lbj 1
188 1 . . . parsed_2lbj 1
189 1 . . . parsed_2lbj 1
190 1 . . . parsed_2lbj 1
191 1 . . . parsed_2lbj 1
192 1 . . . parsed_2lbj 1
193 1 . . . parsed_2lbj 1
194 1 . . . parsed_2lbj 1
195 1 . . . parsed_2lbj 1
196 1 . . . parsed_2lbj 1
197 1 . . . parsed_2lbj 1
198 1 . . . parsed_2lbj 1
199 1 . . . parsed_2lbj 1
200 1 . . . parsed_2lbj 1
201 1 . . . parsed_2lbj 1
202 1 . . . parsed_2lbj 1
203 1 . . . parsed_2lbj 1
204 1 . . . parsed_2lbj 1
205 1 . . . parsed_2lbj 1
206 1 . . . parsed_2lbj 1
207 1 . . . parsed_2lbj 1
208 1 . . . parsed_2lbj 1
209 1 . . . parsed_2lbj 1
210 1 . . . parsed_2lbj 1
211 1 . . . parsed_2lbj 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 . H8 parsed_2lbj 1
1 1 2 . . . . . . . . . 1 . H1' parsed_2lbj 1
2 1 1 . . . . . . . . . 1 . H1' parsed_2lbj 1
2 1 2 . . . . . . . . . 2 . H8 parsed_2lbj 1
3 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
3 1 2 . . . . . . . . . 2 . H1' parsed_2lbj 1
4 1 1 . . . . . . . . . 2 . H1' parsed_2lbj 1
4 1 2 . . . . . . . . . 3 . H8 parsed_2lbj 1
5 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
5 1 2 . . . . . . . . . 3 . H1' parsed_2lbj 1
6 1 1 . . . . . . . . . 3 . H1' parsed_2lbj 1
6 1 2 . . . . . . . . . 4 . H6 parsed_2lbj 1
7 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
7 1 2 . . . . . . . . . 4 . H1' parsed_2lbj 1
8 1 1 . . . . . . . . . 4 . H1' parsed_2lbj 1
8 1 2 . . . . . . . . . 5 . H6 parsed_2lbj 1
9 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
9 1 2 . . . . . . . . . 5 . H1' parsed_2lbj 1
10 1 1 . . . . . . . . . 5 . H1' parsed_2lbj 1
10 1 2 . . . . . . . . . 6 . H6 parsed_2lbj 1
11 1 1 . . . . . . . . . 6 . H6 parsed_2lbj 1
11 1 2 . . . . . . . . . 6 . H1' parsed_2lbj 1
12 1 1 . . . . . . . . . 6 . H1' parsed_2lbj 1
12 1 2 . . . . . . . . . 7 . H6 parsed_2lbj 1
13 1 1 . . . . . . . . . 7 . H6 parsed_2lbj 1
13 1 2 . . . . . . . . . 7 . H1' parsed_2lbj 1
14 1 1 . . . . . . . . . 7 . H1' parsed_2lbj 1
14 1 2 . . . . . . . . . 8 . H8 parsed_2lbj 1
15 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
15 1 2 . . . . . . . . . 8 . H1' parsed_2lbj 1
16 1 1 . . . . . . . . . 8 . H1' parsed_2lbj 1
16 1 2 . . . . . . . . . 9 . H6 parsed_2lbj 1
17 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
17 1 2 . . . . . . . . . 9 . H1' parsed_2lbj 1
18 1 1 . . . . . . . . . 9 . H1' parsed_2lbj 1
18 1 2 . . . . . . . . . 10 . H6 parsed_2lbj 1
19 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
19 1 2 . . . . . . . . . 10 . H1' parsed_2lbj 1
20 1 1 . . . . . . . . . 10 . H1' parsed_2lbj 1
20 1 2 . . . . . . . . . 11 . H8 parsed_2lbj 1
21 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
21 1 2 . . . . . . . . . 11 . H1' parsed_2lbj 1
22 1 1 . . . . . . . . . 11 . H1' parsed_2lbj 1
22 1 2 . . . . . . . . . 12 . H8 parsed_2lbj 1
23 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
23 1 2 . . . . . . . . . 12 . H1' parsed_2lbj 1
24 1 1 . . . . . . . . . 12 . H1' parsed_2lbj 1
24 1 2 . . . . . . . . . 13 . H8 parsed_2lbj 1
25 1 1 . . . . . . . . . 13 . H8 parsed_2lbj 1
25 1 2 . . . . . . . . . 13 . H1' parsed_2lbj 1
26 1 1 . . . . . . . . . 13 . H1' parsed_2lbj 1
26 1 2 . . . . . . . . . 14 . H8 parsed_2lbj 1
27 1 1 . . . . . . . . . 14 . H8 parsed_2lbj 1
27 1 2 . . . . . . . . . 14 . H1' parsed_2lbj 1
28 1 1 . . . . . . . . . 14 . H1' parsed_2lbj 1
28 1 2 . . . . . . . . . 15 . H6 parsed_2lbj 1
29 1 1 . . . . . . . . . 15 . H6 parsed_2lbj 1
29 1 2 . . . . . . . . . 15 . H1' parsed_2lbj 1
30 1 1 . . . . . . . . . 15 . H1' parsed_2lbj 1
30 1 2 . . . . . . . . . 16 . H6 parsed_2lbj 1
31 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
31 1 2 . . . . . . . . . 16 . H1' parsed_2lbj 1
32 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
32 1 2 . . . . . . . . . 17 . H6 parsed_2lbj 1
33 1 1 . . . . . . . . . 17 . H6 parsed_2lbj 1
33 1 2 . . . . . . . . . 17 . H1' parsed_2lbj 1
34 1 1 . . . . . . . . . 1 . H8 parsed_2lbj 1
34 1 2 . . . . . . . . . 2 . H8 parsed_2lbj 1
35 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
35 1 2 . . . . . . . . . 3 . H8 parsed_2lbj 1
36 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
36 1 2 . . . . . . . . . 4 . H6 parsed_2lbj 1
37 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
37 1 2 . . . . . . . . . 6 . H6 parsed_2lbj 1
38 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
38 1 2 . . . . . . . . . 9 . H6 parsed_2lbj 1
39 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
39 1 2 . . . . . . . . . 10 . H6 parsed_2lbj 1
40 1 1 . . . . . . . . . 11 . H2 parsed_2lbj 1
40 1 2 . . . . . . . . . 12 . H2 parsed_2lbj 1
41 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
41 1 2 . . . . . . . . . 12 . H8 parsed_2lbj 1
42 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
42 1 2 . . . . . . . . . 13 . H8 parsed_2lbj 1
43 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
43 1 2 . . . . . . . . . 15 . H6 parsed_2lbj 1
44 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
44 1 2 . . . . . . . . . 17 . H6 parsed_2lbj 1
45 1 1 . . . . . . . . . 1 . H8 parsed_2lbj 1
45 1 2 . . . . . . . . . 1 . H2'' parsed_2lbj 1
46 1 1 . . . . . . . . . 1 . H8 parsed_2lbj 1
46 1 2 . . . . . . . . . 1 . H3' parsed_2lbj 1
47 1 1 . . . . . . . . . 1 . H8 parsed_2lbj 1
47 1 2 . . . . . . . . . 1 . H4' parsed_2lbj 1
48 1 1 . . . . . . . . . 1 . H8 parsed_2lbj 1
48 1 2 . . . . . . . . . 1 . H5' parsed_2lbj 1
49 1 1 . . . . . . . . . 1 . H8 parsed_2lbj 1
49 1 2 . . . . . . . . . 1 . H5'' parsed_2lbj 1
50 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
50 1 2 . . . . . . . . . 1 . H2' parsed_2lbj 1
51 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
51 1 2 . . . . . . . . . 1 . H3' parsed_2lbj 1
52 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
52 1 2 . . . . . . . . . 1 . H4' parsed_2lbj 1
53 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
53 1 2 . . . . . . . . . 2 . H2'' parsed_2lbj 1
54 1 1 . . . . . . . . . 2 . H8 parsed_2lbj 1
54 1 2 . . . . . . . . . 2 . H3' parsed_2lbj 1
55 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
55 1 2 . . . . . . . . . 3 . H2'' parsed_2lbj 1
56 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
56 1 2 . . . . . . . . . 3 . H5'' parsed_2lbj 1
57 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
57 1 2 . . . . . . . . . 3 . H3' parsed_2lbj 1
58 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
58 1 2 . . . . . . . . . 3 . H5' parsed_2lbj 1
59 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
59 1 2 . . . . . . . . . 2 . H2'' parsed_2lbj 1
60 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
60 1 2 . . . . . . . . . 2 . H2'' parsed_2lbj 1
61 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
61 1 2 . . . . . . . . . 2 . H3' parsed_2lbj 1
62 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
62 1 2 . . . . . . . . . 2 . H4' parsed_2lbj 1
63 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
63 1 2 . . . . . . . . . 3 . H2'' parsed_2lbj 1
64 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
64 1 2 . . . . . . . . . 3 . H2' parsed_2lbj 1
65 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
65 1 2 . . . . . . . . . 3 . H3' parsed_2lbj 1
66 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
66 1 2 . . . . . . . . . 3 . H4' parsed_2lbj 1
67 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
67 1 2 . . . . . . . . . 3 . H5' parsed_2lbj 1
68 1 1 . . . . . . . . . 4 . H6 parsed_2lbj 1
68 1 2 . . . . . . . . . 3 . H5'' parsed_2lbj 1
69 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
69 1 2 . . . . . . . . . 4 . H2' parsed_2lbj 1
70 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
70 1 2 . . . . . . . . . 4 . H3' parsed_2lbj 1
71 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
71 1 2 . . . . . . . . . 4 . H4' parsed_2lbj 1
72 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
72 1 2 . . . . . . . . . 4 . H5' parsed_2lbj 1
73 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
73 1 2 . . . . . . . . . 4 . H5'' parsed_2lbj 1
74 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
74 1 2 . . . . . . . . . 5 . H5'' parsed_2lbj 1
75 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
75 1 2 . . . . . . . . . 5 . H2'' parsed_2lbj 1
76 1 1 . . . . . . . . . 5 . H6 parsed_2lbj 1
76 1 2 . . . . . . . . . 5 . H3' parsed_2lbj 1
77 1 1 . . . . . . . . . 6 . H6 parsed_2lbj 1
77 1 2 . . . . . . . . . 5 . H2'' parsed_2lbj 1
78 1 1 . . . . . . . . . 6 . H6 parsed_2lbj 1
78 1 2 . . . . . . . . . 6 . H2'' parsed_2lbj 1
79 1 1 . . . . . . . . . 6 . H6 parsed_2lbj 1
79 1 2 . . . . . . . . . 6 . H3' parsed_2lbj 1
80 1 1 . . . . . . . . . 7 . H6 parsed_2lbj 1
80 1 2 . . . . . . . . . 7 . H2'' parsed_2lbj 1
81 1 1 . . . . . . . . . 7 . H6 parsed_2lbj 1
81 1 2 . . . . . . . . . 7 . H3' parsed_2lbj 1
82 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
82 1 2 . . . . . . . . . 8 . H5'' parsed_2lbj 1
83 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
83 1 2 . . . . . . . . . 7 . H5'' parsed_2lbj 1
84 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
84 1 2 . . . . . . . . . 8 . H5' parsed_2lbj 1
85 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
85 1 2 . . . . . . . . . 7 . H2'' parsed_2lbj 1
86 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
86 1 2 . . . . . . . . . 8 . H3' parsed_2lbj 1
87 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
87 1 2 . . . . . . . . . 7 . H3' parsed_2lbj 1
88 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
88 1 2 . . . . . . . . . 8 . H2'' parsed_2lbj 1
89 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
89 1 2 . . . . . . . . . 9 . H5'' parsed_2lbj 1
90 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
90 1 2 . . . . . . . . . 9 . H5' parsed_2lbj 1
91 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
91 1 2 . . . . . . . . . 9 . H3' parsed_2lbj 1
92 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
92 1 2 . . . . . . . . . 9 . H2'' parsed_2lbj 1
93 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
93 1 2 . . . . . . . . . 8 . H3' parsed_2lbj 1
94 1 1 . . . . . . . . . 9 . H6 parsed_2lbj 1
94 1 2 . . . . . . . . . 8 . H2'' parsed_2lbj 1
95 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
95 1 2 . . . . . . . . . 10 . H5' parsed_2lbj 1
96 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
96 1 2 . . . . . . . . . 10 . H5'' parsed_2lbj 1
97 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
97 1 2 . . . . . . . . . 9 . H3' parsed_2lbj 1
98 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
98 1 2 . . . . . . . . . 10 . H2'' parsed_2lbj 1
99 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
99 1 2 . . . . . . . . . 10 . H3' parsed_2lbj 1
100 1 1 . . . . . . . . . 10 . H6 parsed_2lbj 1
100 1 2 . . . . . . . . . 9 . H2'' parsed_2lbj 1
101 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
101 1 2 . . . . . . . . . 10 . H5' parsed_2lbj 1
102 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
102 1 2 . . . . . . . . . 10 . H5'' parsed_2lbj 1
103 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
103 1 2 . . . . . . . . . 11 . H5' parsed_2lbj 1
104 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
104 1 2 . . . . . . . . . 11 . H5'' parsed_2lbj 1
105 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
105 1 2 . . . . . . . . . 10 . H3' parsed_2lbj 1
106 1 1 . . . . . . . . . 11 . H8 parsed_2lbj 1
106 1 2 . . . . . . . . . 11 . H3' parsed_2lbj 1
107 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
107 1 2 . . . . . . . . . 11 . H5'' parsed_2lbj 1
108 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
108 1 2 . . . . . . . . . 11 . H5' parsed_2lbj 1
109 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
109 1 2 . . . . . . . . . 12 . H5'' parsed_2lbj 1
110 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
110 1 2 . . . . . . . . . 12 . H5' parsed_2lbj 1
111 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
111 1 2 . . . . . . . . . 12 . H3' parsed_2lbj 1
112 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
112 1 2 . . . . . . . . . 12 . H2'' parsed_2lbj 1
113 1 1 . . . . . . . . . 12 . H8 parsed_2lbj 1
113 1 2 . . . . . . . . . 11 . H2'' parsed_2lbj 1
114 1 1 . . . . . . . . . 13 . H8 parsed_2lbj 1
114 1 2 . . . . . . . . . 12 . H3' parsed_2lbj 1
115 1 1 . . . . . . . . . 13 . H8 parsed_2lbj 1
115 1 2 . . . . . . . . . 12 . H2'' parsed_2lbj 1
116 1 1 . . . . . . . . . 14 . H8 parsed_2lbj 1
116 1 2 . . . . . . . . . 13 . H2' parsed_2lbj 1
117 1 1 . . . . . . . . . 14 . H8 parsed_2lbj 1
117 1 2 . . . . . . . . . 13 . H4' parsed_2lbj 1
118 1 1 . . . . . . . . . 14 . H8 parsed_2lbj 1
118 1 2 . . . . . . . . . 14 . H3' parsed_2lbj 1
119 1 1 . . . . . . . . . 14 . H8 parsed_2lbj 1
119 1 2 . . . . . . . . . 14 . H2'' parsed_2lbj 1
120 1 1 . . . . . . . . . 15 . H6 parsed_2lbj 1
120 1 2 . . . . . . . . . 14 . H2'' parsed_2lbj 1
121 1 1 . . . . . . . . . 15 . H6 parsed_2lbj 1
121 1 2 . . . . . . . . . 14 . H2'' parsed_2lbj 1
122 1 1 . . . . . . . . . 15 . H6 parsed_2lbj 1
122 1 2 . . . . . . . . . 14 . H4' parsed_2lbj 1
123 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
123 1 2 . . . . . . . . . 15 . H3' parsed_2lbj 1
124 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
124 1 2 . . . . . . . . . 15 . H2'' parsed_2lbj 1
125 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
125 1 2 . . . . . . . . . 16 . H5'' parsed_2lbj 1
126 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
126 1 2 . . . . . . . . . 16 . H2'' parsed_2lbj 1
127 1 1 . . . . . . . . . 16 . H6 parsed_2lbj 1
127 1 2 . . . . . . . . . 16 . H3' parsed_2lbj 1
128 1 1 . . . . . . . . . 17 . H6 parsed_2lbj 1
128 1 2 . . . . . . . . . 16 . H2'' parsed_2lbj 1
129 1 1 . . . . . . . . . 17 . H6 parsed_2lbj 1
129 1 2 . . . . . . . . . 17 . H2'' parsed_2lbj 1
130 1 1 . . . . . . . . . 17 . H6 parsed_2lbj 1
130 1 2 . . . . . . . . . 17 . H5'' parsed_2lbj 1
131 1 1 . . . . . . . . . 17 . H6 parsed_2lbj 1
131 1 2 . . . . . . . . . 17 . H3' parsed_2lbj 1
132 1 1 . . . . . . . . . 17 . H6 parsed_2lbj 1
132 1 2 . . . . . . . . . 17 . H5' parsed_2lbj 1
133 1 1 . . . . . . . . . 2 . H1' parsed_2lbj 1
133 1 2 . . . . . . . . . 2 . H2'' parsed_2lbj 1
134 1 1 . . . . . . . . . 2 . H1' parsed_2lbj 1
134 1 2 . . . . . . . . . 2 . H3' parsed_2lbj 1
135 1 1 . . . . . . . . . 3 . H1' parsed_2lbj 1
135 1 2 . . . . . . . . . 3 . H5'' parsed_2lbj 1
136 1 1 . . . . . . . . . 3 . H1' parsed_2lbj 1
136 1 2 . . . . . . . . . 3 . H2'' parsed_2lbj 1
137 1 1 . . . . . . . . . 3 . H1' parsed_2lbj 1
137 1 2 . . . . . . . . . 3 . H3' parsed_2lbj 1
138 1 1 . . . . . . . . . 4 . H1' parsed_2lbj 1
138 1 2 . . . . . . . . . 4 . H5'' parsed_2lbj 1
139 1 1 . . . . . . . . . 4 . H1' parsed_2lbj 1
139 1 2 . . . . . . . . . 4 . H2'' parsed_2lbj 1
140 1 1 . . . . . . . . . 5 . H1' parsed_2lbj 1
140 1 2 . . . . . . . . . 5 . H5'' parsed_2lbj 1
141 1 1 . . . . . . . . . 5 . H1' parsed_2lbj 1
141 1 2 . . . . . . . . . 5 . H2'' parsed_2lbj 1
142 1 1 . . . . . . . . . 5 . H1' parsed_2lbj 1
142 1 2 . . . . . . . . . 5 . H3' parsed_2lbj 1
143 1 1 . . . . . . . . . 6 . H1' parsed_2lbj 1
143 1 2 . . . . . . . . . 6 . H5'' parsed_2lbj 1
144 1 1 . . . . . . . . . 6 . H1' parsed_2lbj 1
144 1 2 . . . . . . . . . 6 . H3' parsed_2lbj 1
145 1 1 . . . . . . . . . 6 . H1' parsed_2lbj 1
145 1 2 . . . . . . . . . 6 . H2'' parsed_2lbj 1
146 1 1 . . . . . . . . . 6 . H1' parsed_2lbj 1
146 1 2 . . . . . . . . . 7 . H3' parsed_2lbj 1
147 1 1 . . . . . . . . . 7 . H1' parsed_2lbj 1
147 1 2 . . . . . . . . . 7 . H5' parsed_2lbj 1
148 1 1 . . . . . . . . . 7 . H1' parsed_2lbj 1
148 1 2 . . . . . . . . . 7 . H5'' parsed_2lbj 1
149 1 1 . . . . . . . . . 7 . H1' parsed_2lbj 1
149 1 2 . . . . . . . . . 7 . H3' parsed_2lbj 1
150 1 1 . . . . . . . . . 7 . H1' parsed_2lbj 1
150 1 2 . . . . . . . . . 7 . H2'' parsed_2lbj 1
151 1 1 . . . . . . . . . 8 . H1' parsed_2lbj 1
151 1 2 . . . . . . . . . 8 . H5'' parsed_2lbj 1
152 1 1 . . . . . . . . . 8 . H1' parsed_2lbj 1
152 1 2 . . . . . . . . . 8 . H5'' parsed_2lbj 1
153 1 1 . . . . . . . . . 8 . H1' parsed_2lbj 1
153 1 2 . . . . . . . . . 8 . H3' parsed_2lbj 1
154 1 1 . . . . . . . . . 8 . H1' parsed_2lbj 1
154 1 2 . . . . . . . . . 8 . H2'' parsed_2lbj 1
155 1 1 . . . . . . . . . 9 . H1' parsed_2lbj 1
155 1 2 . . . . . . . . . 9 . H5'' parsed_2lbj 1
156 1 1 . . . . . . . . . 9 . H1' parsed_2lbj 1
156 1 2 . . . . . . . . . 9 . H5' parsed_2lbj 1
157 1 1 . . . . . . . . . 9 . H1' parsed_2lbj 1
157 1 2 . . . . . . . . . 9 . H5'' parsed_2lbj 1
158 1 1 . . . . . . . . . 9 . H1' parsed_2lbj 1
158 1 2 . . . . . . . . . 9 . H3' parsed_2lbj 1
159 1 1 . . . . . . . . . 10 . H1' parsed_2lbj 1
159 1 2 . . . . . . . . . 10 . H5' parsed_2lbj 1
160 1 1 . . . . . . . . . 10 . H1' parsed_2lbj 1
160 1 2 . . . . . . . . . 10 . H5'' parsed_2lbj 1
161 1 1 . . . . . . . . . 10 . H1' parsed_2lbj 1
161 1 2 . . . . . . . . . 10 . H2'' parsed_2lbj 1
162 1 1 . . . . . . . . . 10 . H1' parsed_2lbj 1
162 1 2 . . . . . . . . . 10 . H3' parsed_2lbj 1
163 1 1 . . . . . . . . . 11 . H1' parsed_2lbj 1
163 1 2 . . . . . . . . . 11 . H5' parsed_2lbj 1
164 1 1 . . . . . . . . . 11 . H1' parsed_2lbj 1
164 1 2 . . . . . . . . . 11 . H5'' parsed_2lbj 1
165 1 1 . . . . . . . . . 11 . H1' parsed_2lbj 1
165 1 2 . . . . . . . . . 11 . H3' parsed_2lbj 1
166 1 1 . . . . . . . . . 11 . H1' parsed_2lbj 1
166 1 2 . . . . . . . . . 11 . H2'' parsed_2lbj 1
167 1 1 . . . . . . . . . 12 . H1' parsed_2lbj 1
167 1 2 . . . . . . . . . 12 . H5' parsed_2lbj 1
168 1 1 . . . . . . . . . 12 . H1' parsed_2lbj 1
168 1 2 . . . . . . . . . 12 . H5'' parsed_2lbj 1
169 1 1 . . . . . . . . . 12 . H1' parsed_2lbj 1
169 1 2 . . . . . . . . . 12 . H3' parsed_2lbj 1
170 1 1 . . . . . . . . . 12 . H1' parsed_2lbj 1
170 1 2 . . . . . . . . . 12 . H2'' parsed_2lbj 1
171 1 1 . . . . . . . . . 13 . H1' parsed_2lbj 1
171 1 2 . . . . . . . . . 13 . H5'' parsed_2lbj 1
172 1 1 . . . . . . . . . 13 . H1' parsed_2lbj 1
172 1 2 . . . . . . . . . 13 . H3' parsed_2lbj 1
173 1 1 . . . . . . . . . 13 . H1' parsed_2lbj 1
173 1 2 . . . . . . . . . 13 . H2'' parsed_2lbj 1
174 1 1 . . . . . . . . . 14 . H1' parsed_2lbj 1
174 1 2 . . . . . . . . . 14 . H3' parsed_2lbj 1
175 1 1 . . . . . . . . . 14 . H1' parsed_2lbj 1
175 1 2 . . . . . . . . . 14 . H2'' parsed_2lbj 1
176 1 1 . . . . . . . . . 15 . H1' parsed_2lbj 1
176 1 2 . . . . . . . . . 15 . H2'' parsed_2lbj 1
177 1 1 . . . . . . . . . 15 . H1' parsed_2lbj 1
177 1 2 . . . . . . . . . 15 . H3' parsed_2lbj 1
178 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
178 1 2 . . . . . . . . . 16 . H5'' parsed_2lbj 1
179 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
179 1 2 . . . . . . . . . 16 . H2'' parsed_2lbj 1
180 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
180 1 2 . . . . . . . . . 16 . H3' parsed_2lbj 1
181 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
181 1 2 . . . . . . . . . 16 . H5' parsed_2lbj 1
182 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
182 1 2 . . . . . . . . . 16 . H5' parsed_2lbj 1
183 1 1 . . . . . . . . . 17 . H1' parsed_2lbj 1
183 1 2 . . . . . . . . . 17 . H2'' parsed_2lbj 1
184 1 1 . . . . . . . . . 17 . H1' parsed_2lbj 1
184 1 2 . . . . . . . . . 17 . H5'' parsed_2lbj 1
185 1 1 . . . . . . . . . 17 . H1' parsed_2lbj 1
185 1 2 . . . . . . . . . 17 . H3' parsed_2lbj 1
186 1 1 . . . . . . . . . 17 . H1' parsed_2lbj 1
186 1 2 . . . . . . . . . 17 . H5' parsed_2lbj 1
187 1 1 . . . . . . . . . 1 . H1' parsed_2lbj 1
187 1 2 . . . . . . . . . 2 . H1' parsed_2lbj 1
188 1 1 . . . . . . . . . 2 . H1' parsed_2lbj 1
188 1 2 . . . . . . . . . 3 . H1' parsed_2lbj 1
189 1 1 . . . . . . . . . 3 . H1' parsed_2lbj 1
189 1 2 . . . . . . . . . 4 . H1' parsed_2lbj 1
190 1 1 . . . . . . . . . 4 . H1' parsed_2lbj 1
190 1 2 . . . . . . . . . 5 . H1' parsed_2lbj 1
191 1 1 . . . . . . . . . 11 . H1' parsed_2lbj 1
191 1 2 . . . . . . . . . 12 . H1' parsed_2lbj 1
192 1 1 . . . . . . . . . 13 . H1' parsed_2lbj 1
192 1 2 . . . . . . . . . 14 . H1' parsed_2lbj 1
193 1 1 . . . . . . . . . 14 . H1' parsed_2lbj 1
193 1 2 . . . . . . . . . 15 . H1' parsed_2lbj 1
194 1 1 . . . . . . . . . 15 . H1' parsed_2lbj 1
194 1 2 . . . . . . . . . 16 . H1' parsed_2lbj 1
195 1 1 . . . . . . . . . 16 . H1' parsed_2lbj 1
195 1 2 . . . . . . . . . 17 . H1' parsed_2lbj 1
196 1 1 . . . . . . . . . 11 . H2 parsed_2lbj 1
196 1 2 . . . . . . . . . 12 . H1' parsed_2lbj 1
197 1 1 . . . . . . . . . 11 . H2 parsed_2lbj 1
197 1 2 . . . . . . . . . 8 . H1' parsed_2lbj 1
198 1 1 . . . . . . . . . 12 . H2 parsed_2lbj 1
198 1 2 . . . . . . . . . 7 . H1' parsed_2lbj 1
199 1 1 . . . . . . . . . 12 . H2 parsed_2lbj 1
199 1 2 . . . . . . . . . 13 . H1' parsed_2lbj 1
200 1 1 . . . . . . . . . 8 . H8 parsed_2lbj 1
200 1 2 . . . . . . . . . 9 . H5 parsed_2lbj 1
201 1 1 . . . . . . . . . 3 . H8 parsed_2lbj 1
201 1 2 . . . . . . . . . 4 . H5 parsed_2lbj 1
202 1 1 . . . . . . . . . 14 . H8 parsed_2lbj 1
202 1 2 . . . . . . . . . 15 . H5 parsed_2lbj 1
203 1 1 . . . . . . . . . 6 . H5 parsed_2lbj 1
203 1 2 . . . . . . . . . 7 . H5 parsed_2lbj 1
204 1 1 . . . . . . . . . 7 . H5 parsed_2lbj 1
204 1 2 . . . . . . . . . 7 . H2'' parsed_2lbj 1
205 1 1 . . . . . . . . . 7 . H5 parsed_2lbj 1
205 1 2 . . . . . . . . . 8 . H1' parsed_2lbj 1
206 1 1 . . . . . . . . . 15 . H5 parsed_2lbj 1
206 1 2 . . . . . . . . . 14 . H2'' parsed_2lbj 1
207 1 1 . . . . . . . . . 10 . H5 parsed_2lbj 1
207 1 2 . . . . . . . . . 9 . H1' parsed_2lbj 1
208 1 1 . . . . . . . . . 15 . H5 parsed_2lbj 1
208 1 2 . . . . . . . . . 15 . H1' parsed_2lbj 1
209 1 1 . . . . . . . . . 16 . H5 parsed_2lbj 1
209 1 2 . . . . . . . . . 17 . H5 parsed_2lbj 1
210 1 1 . . . . . . . . . 8 . H1 parsed_2lbj 1
210 1 2 . . . . . . . . . 11 . H2'' parsed_2lbj 1
211 1 1 . . . . . . . . . 6 . H3 parsed_2lbj 1
211 1 2 . . . . . . . . . 11 . H2'' parsed_2lbj 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
2 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
3 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
4 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
5 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
6 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
7 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
8 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
9 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
10 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
11 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
12 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
13 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
14 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
15 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
16 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
17 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
18 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
19 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
20 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
21 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
22 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
23 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
24 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
25 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
26 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
27 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
28 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
29 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
30 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
31 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
32 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
33 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
34 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
35 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
36 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
37 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
38 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
39 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
40 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
41 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
42 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
43 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
44 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
45 1 . . . . . 3.9 0.0 3.9 parsed_2lbj 1
46 1 . . . . . 2.9 0.0 2.9 parsed_2lbj 1
47 1 . . . . . 4.2 0.0 4.2 parsed_2lbj 1
48 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
49 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
50 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
51 1 . . . . . 3.3 0.0 3.3 parsed_2lbj 1
52 1 . . . . . 5.5 0.0 5.5 parsed_2lbj 1
53 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
54 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
55 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
56 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
57 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
58 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
59 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
60 1 . . . . . 2.4 0.0 2.4 parsed_2lbj 1
61 1 . . . . . 3.3 0.0 3.3 parsed_2lbj 1
62 1 . . . . . 5.5 0.0 5.5 parsed_2lbj 1
63 1 . . . . . 2.4 0.0 2.4 parsed_2lbj 1
64 1 . . . . . 4.6 0.0 4.6 parsed_2lbj 1
65 1 . . . . . 3.3 0.0 3.3 parsed_2lbj 1
66 1 . . . . . 5.5 0.0 5.5 parsed_2lbj 1
67 1 . . . . . 6.6 0.0 6.6 parsed_2lbj 1
68 1 . . . . . 6.1 0.0 6.1 parsed_2lbj 1
69 1 . . . . . 4.4 0.0 4.4 parsed_2lbj 1
70 1 . . . . . 3.3 0.0 3.3 parsed_2lbj 1
71 1 . . . . . 5.5 0.0 5.5 parsed_2lbj 1
72 1 . . . . . 6.6 0.0 6.6 parsed_2lbj 1
73 1 . . . . . 6.1 0.0 6.1 parsed_2lbj 1
74 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
75 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
76 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
77 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
78 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
79 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
80 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
81 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
82 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
83 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
84 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
85 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
86 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
87 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
88 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
89 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
90 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
91 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
92 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
93 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
94 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
95 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
96 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
97 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
98 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
99 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
100 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
101 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
102 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
103 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
104 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
105 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
106 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
107 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
108 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
109 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
110 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
111 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
112 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
113 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
114 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
115 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
116 1 . . . . . 4.2 0.0 4.2 parsed_2lbj 1
117 1 . . . . . 5.6 0.0 5.6 parsed_2lbj 1
118 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
119 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
120 1 . . . . . 2.4 0.0 2.4 parsed_2lbj 1
121 1 . . . . . 4.2 0.0 4.2 parsed_2lbj 1
122 1 . . . . . 5.6 0.0 5.6 parsed_2lbj 1
123 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
124 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
125 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
126 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
127 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
128 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
129 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
130 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
131 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
132 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
133 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
134 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
135 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
136 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
137 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
138 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
139 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
140 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
141 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
142 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
143 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
144 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
145 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
146 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
147 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
148 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
149 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
150 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
151 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
152 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
153 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
154 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
155 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
156 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
157 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
158 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
159 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
160 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
161 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
162 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
163 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
164 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
165 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
166 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
167 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
168 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
169 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
170 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
171 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
172 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
173 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
174 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
175 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
176 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
177 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
178 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
179 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
180 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
181 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
182 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
183 1 . . . . . 4.0 1.8 4.0 parsed_2lbj 1
184 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
185 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
186 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 1
187 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
188 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
189 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
190 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
191 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
192 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
193 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
194 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
195 1 . . . . . 5.9 0.0 5.9 parsed_2lbj 1
196 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
197 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
198 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
199 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
200 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
201 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
202 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
203 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
204 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
205 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
206 1 . . . . . 5.0 1.8 5.0 parsed_2lbj 1
207 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
208 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
209 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
210 1 . . . . . 6.0 1.8 6.0 parsed_2lbj 1
211 1 . . . . . 7.0 1.8 7.0 parsed_2lbj 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 - 1'" 1 1 2 2 parsed_2lbj 1
2 M 3 63 3 65 parsed_2lbj 1
3 M 4 63 4 65 parsed_2lbj 1
4 M 5 63 5 65 parsed_2lbj 1
5 M 6 63 6 65 parsed_2lbj 1
6 M 7 63 7 65 parsed_2lbj 1
7 W 8 63 8 65 parsed_2lbj 1
8 M 9 63 9 65 parsed_2lbj 1
9 M 10 63 10 65 parsed_2lbj 1
10 M 11 63 11 65 parsed_2lbj 1
11 W 12 63 12 65 parsed_2lbj 1
12 M 13 63 13 65 parsed_2lbj 1
13 M 14 63 14 65 parsed_2lbj 1
14 M 15 63 15 65 parsed_2lbj 1
15 W 16 63 16 65 parsed_2lbj 1
16 S 17 63 17 65 parsed_2lbj 1
17 W 18 63 18 65 parsed_2lbj 1
18 S 19 63 19 65 parsed_2lbj 1
19 W 20 64 20 66 parsed_2lbj 1
20 S 21 65 21 67 parsed_2lbj 1
21 W 22 65 22 67 parsed_2lbj 1
22 S 23 65 23 67 parsed_2lbj 1
23 M 24 65 24 67 parsed_2lbj 1
24 M 25 65 25 67 parsed_2lbj 1
25 M 26 65 26 67 parsed_2lbj 1
26 S 27 65 27 67 parsed_2lbj 1
27 M 28 65 28 67 parsed_2lbj 1
28 M 29 65 29 67 parsed_2lbj 1
29 M 30 65 30 67 parsed_2lbj 1
30 S 31 65 31 67 parsed_2lbj 1
31 M 32 65 32 67 parsed_2lbj 1
32 M 33 65 33 67 parsed_2lbj 1
33 M 34 65 34 67 parsed_2lbj 1
34
;
M
base - base
;
35 65 38 2 parsed_2lbj 1
35 W 39 62 39 64 parsed_2lbj 1
36 VW 40 62 40 65 parsed_2lbj 1
37 VW 41 62 41 65 parsed_2lbj 1
38 VW 42 62 42 65 parsed_2lbj 1
39 VW 43 62 43 65 parsed_2lbj 1
40 W 44 63 44 65 parsed_2lbj 1
41 W 45 64 45 66 parsed_2lbj 1
42 W 46 64 46 66 parsed_2lbj 1
43 W 47 64 47 66 parsed_2lbj 1
44 VW 48 64 48 67 parsed_2lbj 1
45
;
W
base - ribose
some of the inter-residue restrains of stem region are from Jiachen Wang's table
;
49 64 52 82 parsed_2lbj 1
46 S 56 63 56 65 parsed_2lbj 1
47 S 57 64 57 66 parsed_2lbj 1
48 "assign ( resid 2 and name H8 ) ( resid 1 and name H2'' ) 2.4 2.4 0 !" 58 63 59 70 parsed_2lbj 1
49 M 62 64 62 66 parsed_2lbj 1
50 M 63 63 63 65 parsed_2lbj 1
51 W 64 64 64 66 parsed_2lbj 1
52 M 65 64 65 66 parsed_2lbj 1
53 M 66 63 66 65 parsed_2lbj 1
54
;
M
assign (resid 3 and name H8) (resid 2 and name H5') 5.0 3.2 0 !M
;
67 63 68 66 parsed_2lbj 1
55 S 69 64 69 66 parsed_2lbj 1
56 "assign ( resid 5 and name H6 ) ( resid 4 and name H2'' ) 2.4 2.4 0 !" 78 68 79 70 parsed_2lbj 1
57 W 85 64 85 66 parsed_2lbj 1
58 M 86 64 86 66 parsed_2lbj 1
59 M 87 63 87 65 parsed_2lbj 1
60 S 88 64 88 66 parsed_2lbj 1
61 S 89 64 89 66 parsed_2lbj 1
62 M 90 63 90 65 parsed_2lbj 1
63 S 91 64 91 66 parsed_2lbj 1
64 M 92 63 92 65 parsed_2lbj 1
65 M 93 64 93 66 parsed_2lbj 1
66 W 94 64 94 66 parsed_2lbj 1
67 M 95 63 95 65 parsed_2lbj 1
68 S 96 64 96 66 parsed_2lbj 1
69 M 97 63 97 65 parsed_2lbj 1
70 M 98 63 98 65 parsed_2lbj 1
71 M 99 64 99 66 parsed_2lbj 1
72 M 100 64 100 66 parsed_2lbj 1
73 M 101 63 101 65 parsed_2lbj 1
74 S 102 63 102 65 parsed_2lbj 1
75 S 103 64 103 66 parsed_2lbj 1
76 M 104 63 104 65 parsed_2lbj 1
77 M 105 64 105 66 parsed_2lbj 1
78 M 106 65 106 67 parsed_2lbj 1
79 M 107 66 107 68 parsed_2lbj 1
80 W 108 64 108 66 parsed_2lbj 1
81 M 109 66 109 68 parsed_2lbj 1
82 M 110 65 110 67 parsed_2lbj 1
83 M 111 65 111 67 parsed_2lbj 1
84 M 112 65 112 67 parsed_2lbj 1
85 M 113 66 113 68 parsed_2lbj 1
86 M 114 65 114 67 parsed_2lbj 1
87 M 115 66 115 68 parsed_2lbj 1
88 M 116 65 116 67 parsed_2lbj 1
89 M 117 65 117 67 parsed_2lbj 1
90 VW 118 66 118 69 parsed_2lbj 1
91 VW 119 65 119 68 parsed_2lbj 1
92 M 120 66 120 68 parsed_2lbj 1
93 M 121 65 121 67 parsed_2lbj 1
94 M 122 65 122 67 parsed_2lbj 1
95 W 123 66 123 68 parsed_2lbj 1
96 M 124 66 124 68 parsed_2lbj 1
97 M 125 65 125 67 parsed_2lbj 1
98
;
M
assign ( resid 14 and name H8 ) ( resid 13 and name H2'') 2.4 2.4 0 !
;
126 66 127 71 parsed_2lbj 1
99 "assign ( resid 14 and name H8 ) ( resid 13 and name H3' ) 3.3 3.3 0 !" 128 69 129 71 parsed_2lbj 1
100 M 131 65 131 67 parsed_2lbj 1
101 M 132 66 132 68 parsed_2lbj 1
102 "assign ( resid 15 and name H6 ) ( resid 14 and name H3' ) 3.3 3.3 0 !" 134 70 135 71 parsed_2lbj 1
103 M 137 65 137 67 parsed_2lbj 1
104 S 138 66 138 68 parsed_2lbj 1
105 W 139 66 139 68 parsed_2lbj 1
106 M 140 66 140 68 parsed_2lbj 1
107
;
M
assign (resid 17 and name H6) (resid 16 and name H5') 5.0 3.2 0 !M
;
141 65 142 68 parsed_2lbj 1
108 M 143 66 143 68 parsed_2lbj 1
109 M 144 66 144 68 parsed_2lbj 1
110 W 145 66 145 68 parsed_2lbj 1
111 S 146 65 146 67 parsed_2lbj 1
112
;
M
1' - ribose
;
147 65 151 2 parsed_2lbj 1
113 S 152 65 152 67 parsed_2lbj 1
114 VW 153 64 153 67 parsed_2lbj 1
115 W 154 65 154 67 parsed_2lbj 1
116 S 155 65 155 67 parsed_2lbj 1
117 M 156 64 156 66 parsed_2lbj 1
118 M 157 65 157 67 parsed_2lbj 1
119 S 158 65 158 67 parsed_2lbj 1
120 W 159 65 159 67 parsed_2lbj 1
121 S 160 65 160 67 parsed_2lbj 1
122 W 161 64 161 66 parsed_2lbj 1
123 VW 162 65 162 68 parsed_2lbj 1
124 M 163 64 163 66 parsed_2lbj 1
125 S 164 65 164 67 parsed_2lbj 1
126 W 165 64 165 66 parsed_2lbj 1
127 VW 166 64 166 67 parsed_2lbj 1
128 VW 167 65 167 68 parsed_2lbj 1
129 S 168 64 168 66 parsed_2lbj 1
130 S 169 65 169 67 parsed_2lbj 1
131 M 170 65 170 67 parsed_2lbj 1
132 M 171 65 171 67 parsed_2lbj 1
133 S 172 64 172 66 parsed_2lbj 1
134 M 173 65 173 67 parsed_2lbj 1
135 M 174 65 174 67 parsed_2lbj 1
136 M 175 64 175 66 parsed_2lbj 1
137 M 176 65 176 67 parsed_2lbj 1
138 S 177 64 177 66 parsed_2lbj 1
139 W 178 66 178 68 parsed_2lbj 1
140 W 179 67 179 69 parsed_2lbj 1
141 S 180 67 180 69 parsed_2lbj 1
142 M 181 66 181 68 parsed_2lbj 1
143 M 182 66 182 68 parsed_2lbj 1
144 M 183 67 183 69 parsed_2lbj 1
145 S 184 66 184 68 parsed_2lbj 1
146 M 185 67 185 69 parsed_2lbj 1
147 W 186 66 186 68 parsed_2lbj 1
148 W 187 67 187 69 parsed_2lbj 1
149 M 188 66 188 68 parsed_2lbj 1
150 M 189 67 189 69 parsed_2lbj 1
151 W 190 67 190 69 parsed_2lbj 1
152 M 191 66 191 68 parsed_2lbj 1
153 S 192 67 192 69 parsed_2lbj 1
154 W 193 66 193 68 parsed_2lbj 1
155 S 194 67 194 69 parsed_2lbj 1
156 S 195 67 195 69 parsed_2lbj 1
157 M 196 66 196 68 parsed_2lbj 1
158 W 197 67 197 69 parsed_2lbj 1
159 S 198 67 198 69 parsed_2lbj 1
160 M 199 66 199 68 parsed_2lbj 1
161 W 200 66 200 68 parsed_2lbj 1
162 W 201 66 201 68 parsed_2lbj 1
163 S 202 67 202 69 parsed_2lbj 1
164 VW 203 67 203 70 parsed_2lbj 1
165 M 204 66 204 68 parsed_2lbj 1
166
;
VW
H1'-H1'
;
205 66 210 2 parsed_2lbj 1
167 W 215 66 215 68 parsed_2lbj 1
168 H2 219 70 222 2 parsed_2lbj 1
169 M 223 65 223 67 parsed_2lbj 1
170
;
M
assign (resid 12 and name H2) (resid 12 and name H1') 6.0 4.2 0 !W
;
224 64 225 68 parsed_2lbj 1
171 M 226 64 226 66 parsed_2lbj 1
172
;
M
H8-H5
;
227 65 230 2 parsed_2lbj 1
173 M 231 62 231 64 parsed_2lbj 1
174 M 232 62 232 64 parsed_2lbj 1
175
;
M
H5
;
233 64 236 2 parsed_2lbj 1
176 W 237 62 237 64 parsed_2lbj 1
177 M 238 64 238 66 parsed_2lbj 1
178 W 239 63 239 65 parsed_2lbj 1
179 M 240 66 240 68 parsed_2lbj 1
180 W 241 64 241 66 parsed_2lbj 1
181 W 242 65 242 67 parsed_2lbj 1
182
;
W
Imino
;
243 64 246 2 parsed_2lbj 1
183 W 247 65 247 67 parsed_2lbj 1
184 "VW!Hydrogen bond table for GlyGCC" 248 65 248 99 parsed_2lbj 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2lbj
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_2lbj 2
2 1 . . . parsed_2lbj 2
3 1 . . . parsed_2lbj 2
4 1 . . . parsed_2lbj 2
5 1 . . . parsed_2lbj 2
6 1 . . . parsed_2lbj 2
7 1 . . . parsed_2lbj 2
8 1 . . . parsed_2lbj 2
9 1 . . . parsed_2lbj 2
10 1 . . . parsed_2lbj 2
11 1 . . . parsed_2lbj 2
12 1 . . . parsed_2lbj 2
13 1 . . . parsed_2lbj 2
14 1 . . . parsed_2lbj 2
15 1 . . . parsed_2lbj 2
16 1 . . . parsed_2lbj 2
17 1 . . . parsed_2lbj 2
18 1 . . . parsed_2lbj 2
19 1 . . . parsed_2lbj 2
20 1 . . . parsed_2lbj 2
21 1 . . . parsed_2lbj 2
22 1 . . . parsed_2lbj 2
23 1 . . . parsed_2lbj 2
24 1 . . . parsed_2lbj 2
25 1 . . . parsed_2lbj 2
26 1 . . . parsed_2lbj 2
27 1 . . . parsed_2lbj 2
28 1 . . . parsed_2lbj 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 . O6 parsed_2lbj 2
1 1 2 . . . . . . . . . 17 . H41 parsed_2lbj 2
2 1 1 . . . . . . . . . 1 . O6 parsed_2lbj 2
2 1 2 . . . . . . . . . 17 . N4 parsed_2lbj 2
3 1 1 . . . . . . . . . 1 . H1 parsed_2lbj 2
3 1 2 . . . . . . . . . 17 . N3 parsed_2lbj 2
4 1 1 . . . . . . . . . 1 . N1 parsed_2lbj 2
4 1 2 . . . . . . . . . 17 . N3 parsed_2lbj 2
5 1 1 . . . . . . . . . 1 . H21 parsed_2lbj 2
5 1 2 . . . . . . . . . 17 . O2 parsed_2lbj 2
6 1 1 . . . . . . . . . 1 . N2 parsed_2lbj 2
6 1 2 . . . . . . . . . 17 . O2 parsed_2lbj 2
7 1 1 . . . . . . . . . 2 . O6 parsed_2lbj 2
7 1 2 . . . . . . . . . 16 . H41 parsed_2lbj 2
8 1 1 . . . . . . . . . 2 . O6 parsed_2lbj 2
8 1 2 . . . . . . . . . 16 . N4 parsed_2lbj 2
9 1 1 . . . . . . . . . 2 . H1 parsed_2lbj 2
9 1 2 . . . . . . . . . 16 . N3 parsed_2lbj 2
10 1 1 . . . . . . . . . 2 . N1 parsed_2lbj 2
10 1 2 . . . . . . . . . 16 . N3 parsed_2lbj 2
11 1 1 . . . . . . . . . 2 . H21 parsed_2lbj 2
11 1 2 . . . . . . . . . 16 . O2 parsed_2lbj 2
12 1 1 . . . . . . . . . 2 . N2 parsed_2lbj 2
12 1 2 . . . . . . . . . 16 . O2 parsed_2lbj 2
13 1 1 . . . . . . . . . 4 . H41 parsed_2lbj 2
13 1 2 . . . . . . . . . 14 . O6 parsed_2lbj 2
14 1 1 . . . . . . . . . 4 . N4 parsed_2lbj 2
14 1 2 . . . . . . . . . 14 . O6 parsed_2lbj 2
15 1 1 . . . . . . . . . 4 . N3 parsed_2lbj 2
15 1 2 . . . . . . . . . 14 . H1 parsed_2lbj 2
16 1 1 . . . . . . . . . 4 . N3 parsed_2lbj 2
16 1 2 . . . . . . . . . 14 . N1 parsed_2lbj 2
17 1 1 . . . . . . . . . 4 . O2 parsed_2lbj 2
17 1 2 . . . . . . . . . 14 . H21 parsed_2lbj 2
18 1 1 . . . . . . . . . 4 . O2 parsed_2lbj 2
18 1 2 . . . . . . . . . 14 . N2 parsed_2lbj 2
19 1 1 . . . . . . . . . 5 . H41 parsed_2lbj 2
19 1 2 . . . . . . . . . 13 . O6 parsed_2lbj 2
20 1 1 . . . . . . . . . 5 . N4 parsed_2lbj 2
20 1 2 . . . . . . . . . 13 . O6 parsed_2lbj 2
21 1 1 . . . . . . . . . 5 . N3 parsed_2lbj 2
21 1 2 . . . . . . . . . 13 . H1 parsed_2lbj 2
22 1 1 . . . . . . . . . 5 . N3 parsed_2lbj 2
22 1 2 . . . . . . . . . 13 . N1 parsed_2lbj 2
23 1 1 . . . . . . . . . 5 . O2 parsed_2lbj 2
23 1 2 . . . . . . . . . 13 . H21 parsed_2lbj 2
24 1 1 . . . . . . . . . 5 . O2 parsed_2lbj 2
24 1 2 . . . . . . . . . 13 . N2 parsed_2lbj 2
25 1 1 . . . . . . . . . 12 . H61 parsed_2lbj 2
25 1 2 . . . . . . . . . 6 . O4 parsed_2lbj 2
26 1 1 . . . . . . . . . 12 . N6 parsed_2lbj 2
26 1 2 . . . . . . . . . 6 . O4 parsed_2lbj 2
27 1 1 . . . . . . . . . 12 . N1 parsed_2lbj 2
27 1 2 . . . . . . . . . 6 . H3 parsed_2lbj 2
28 1 1 . . . . . . . . . 12 . N1 parsed_2lbj 2
28 1 2 . . . . . . . . . 6 . N3 parsed_2lbj 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
2 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
3 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
4 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
5 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
6 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
7 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
8 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
9 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
10 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
11 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
12 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
13 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
14 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
15 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
16 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
17 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
18 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
19 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
20 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
21 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
22 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
23 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
24 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
25 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
26 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 2
27 1 . . . . . 2.00 1.80 2.40 parsed_2lbj 2
28 1 . . . . . 2.90 2.60 3.50 parsed_2lbj 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 G1-C17 1 1 3 2 parsed_2lbj 2
2 G2-C16 10 1 12 2 parsed_2lbj 2
3
;
G3-U15
assign ( resid 3 and name O6 ) ( resid 15 and name H3 ) 2.00 0.2 0.4
assign ( resid 3 and name O6 ) ( resid 15 and name N3 ) 2.90 0.3 0.6
assign ( resid 3 and name H1 ) ( resid 15 and name O2 ) 2.00 0.2 0.4
assign ( resid 3 and name N1 ) ( resid 15 and name O2 ) 2.90 0.3 0.6
C4-G14
;
19 1 28 2 parsed_2lbj 2
4 C5-G13 35 1 37 2 parsed_2lbj 2
5 A12-U6 44 1 46 2 parsed_2lbj 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lbj
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' parsed_2lbj 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' parsed_2lbj 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' parsed_2lbj 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 5 . P . 5 . O5' . 5 . C5' . 5 . C4' parsed_2lbj 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 6 . P . 6 . O5' . 6 . C5' . 6 . C4' parsed_2lbj 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -300.0 -60.0 . . 7 . P . 7 . O5' . 7 . C5' . 7 . C4' parsed_2lbj 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -300.0 -60.0 . . 8 . P . 8 . O5' . 8 . C5' . 8 . C4' parsed_2lbj 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -300.0 -60.0 . . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' parsed_2lbj 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' parsed_2lbj 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 13 . P . 13 . O5' . 13 . C5' . 13 . C4' parsed_2lbj 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' parsed_2lbj 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' parsed_2lbj 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_2lbj 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -160.0 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2lbj 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 1 . O5' . 1 . C5' . 1 . C4' . 1 . C3' parsed_2lbj 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' parsed_2lbj 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' parsed_2lbj 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' parsed_2lbj 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 5 . O5' . 5 . C5' . 5 . C4' . 5 . C3' parsed_2lbj 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 6 . O5' . 6 . C5' . 6 . C4' . 6 . C3' parsed_2lbj 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 10 . O5' . 10 . C5' . 10 . C4' . 10 . C3' parsed_2lbj 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 12 . O5' . 12 . C5' . 12 . C4' . 12 . C3' parsed_2lbj 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' parsed_2lbj 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' parsed_2lbj 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 15 . O5' . 15 . C5' . 15 . C4' . 15 . C3' parsed_2lbj 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_2lbj 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2lbj 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 1 . C4' . 1 . C3' . 1 . O3' . 2 . P parsed_2lbj 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P parsed_2lbj 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P parsed_2lbj 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 4 . C4' . 4 . C3' . 4 . O3' . 5 . P parsed_2lbj 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 5 . C4' . 5 . C3' . 5 . O3' . 6 . P parsed_2lbj 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -230.0 -70.0 . . 6 . C4' . 6 . C3' . 6 . O3' . 7 . P parsed_2lbj 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 11 . C4' . 11 . C3' . 11 . O3' . 12 . P parsed_2lbj 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 12 . C4' . 12 . C3' . 12 . O3' . 13 . P parsed_2lbj 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 13 . C4' . 13 . C3' . 13 . O3' . 14 . P parsed_2lbj 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P parsed_2lbj 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 15 . C4' . 15 . C3' . 15 . O3' . 16 . P parsed_2lbj 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -130.0 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_2lbj 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 1 . O3' . 2 . P . 2 . O5' . 2 . C5' parsed_2lbj 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' parsed_2lbj 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_2lbj 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 4 . O3' . 5 . P . 5 . O5' . 5 . C5' parsed_2lbj 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 5 . O3' . 6 . P . 6 . O5' . 6 . C5' parsed_2lbj 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -5.0 . . 6 . O3' . 7 . P . 7 . O5' . 7 . C5' parsed_2lbj 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -185.0 55.0 . . 7 . O3' . 8 . P . 8 . O5' . 8 . C5' parsed_2lbj 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -185.0 55.0 . . 8 . O3' . 9 . P . 9 . O5' . 9 . C5' parsed_2lbj 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -25.0 . . 9 . O3' . 10 . P . 10 . O5' . 10 . C5' parsed_2lbj 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -5.0 . . 10 . O3' . 11 . P . 11 . O5' . 11 . C5' parsed_2lbj 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -5.0 . . 11 . O3' . 12 . P . 12 . O5' . 12 . C5' parsed_2lbj 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 12 . O3' . 13 . P . 13 . O5' . 13 . C5' parsed_2lbj 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 13 . O3' . 14 . P . 14 . O5' . 14 . C5' parsed_2lbj 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 14 . O3' . 15 . P . 15 . O5' . 15 . C5' parsed_2lbj 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 15 . O3' . 16 . P . 16 . O5' . 16 . C5' parsed_2lbj 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2lbj 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 1 . C3' . 1 . O3' . 2 . P . 2 . O5' parsed_2lbj 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 2 . C3' . 2 . O3' . 3 . P . 3 . O5' parsed_2lbj 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' parsed_2lbj 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 4 . C3' . 4 . O3' . 5 . P . 5 . O5' parsed_2lbj 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 5 . C3' . 5 . O3' . 6 . P . 6 . O5' parsed_2lbj 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 -10.0 . . 6 . C3' . 6 . O3' . 7 . P . 7 . O5' parsed_2lbj 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -190.0 50.0 . . 7 . C3' . 7 . O3' . 8 . P . 8 . O5' parsed_2lbj 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -190.0 50.0 . . 8 . C3' . 8 . O3' . 9 . P . 9 . O5' parsed_2lbj 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -190.0 50.0 . . 9 . C3' . 9 . O3' . 10 . P . 10 . O5' parsed_2lbj 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 -10.0 . . 10 . C3' . 10 . O3' . 11 . P . 11 . O5' parsed_2lbj 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 -10.0 . . 11 . C3' . 11 . O3' . 12 . P . 12 . O5' parsed_2lbj 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 12 . C3' . 12 . O3' . 13 . P . 13 . O5' parsed_2lbj 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 13 . C3' . 13 . O3' . 14 . P . 14 . O5' parsed_2lbj 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 14 . C3' . 14 . O3' . 15 . P . 15 . O5' parsed_2lbj 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 15 . C3' . 15 . O3' . 16 . P . 16 . O5' parsed_2lbj 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_2lbj 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 1 . O4' . 1 . C4' . 1 . C3' . 1 . C2' parsed_2lbj 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 1 . C4' . 1 . C3' . 1 . C2' . 1 . C1' parsed_2lbj 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 1 . C3' . 1 . C2' . 1 . C1' . 1 . O4' parsed_2lbj 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 2 . O4' . 2 . C4' . 2 . C3' . 2 . C2' parsed_2lbj 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 2 . C4' . 2 . C3' . 2 . C2' . 2 . C1' parsed_2lbj 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 2 . C3' . 2 . C2' . 2 . C1' . 2 . O4' parsed_2lbj 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 3 . O4' . 3 . C4' . 3 . C3' . 3 . C2' parsed_2lbj 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 3 . C4' . 3 . C3' . 3 . C2' . 3 . C1' parsed_2lbj 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 3 . C3' . 3 . C2' . 3 . C1' . 3 . O4' parsed_2lbj 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 4 . O4' . 4 . C4' . 4 . C3' . 4 . C2' parsed_2lbj 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 4 . C4' . 4 . C3' . 4 . C2' . 4 . C1' parsed_2lbj 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 4 . C3' . 4 . C2' . 4 . C1' . 4 . O4' parsed_2lbj 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 5 . O4' . 5 . C4' . 5 . C3' . 5 . C2' parsed_2lbj 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 5 . C4' . 5 . C3' . 5 . C2' . 5 . C1' parsed_2lbj 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 5 . C3' . 5 . C2' . 5 . C1' . 5 . O4' parsed_2lbj 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 6 . O4' . 6 . C4' . 6 . C3' . 6 . C2' parsed_2lbj 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 6 . C4' . 6 . C3' . 6 . C2' . 6 . C1' parsed_2lbj 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 6 . C3' . 6 . C2' . 6 . C1' . 6 . O4' parsed_2lbj 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 7 . O4' . 7 . C4' . 7 . C3' . 7 . C2' parsed_2lbj 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 7 . C4' . 7 . C3' . 7 . C2' . 7 . C1' parsed_2lbj 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 7 . C3' . 7 . C2' . 7 . C1' . 7 . O4' parsed_2lbj 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 8 . O4' . 8 . C4' . 8 . C3' . 8 . C2' parsed_2lbj 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 8 . C4' . 8 . C3' . 8 . C2' . 8 . C1' parsed_2lbj 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 8 . C3' . 8 . C2' . 8 . C1' . 8 . O4' parsed_2lbj 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 9 . O4' . 9 . C4' . 9 . C3' . 9 . C2' parsed_2lbj 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 9 . C4' . 9 . C3' . 9 . C2' . 9 . C1' parsed_2lbj 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 9 . C3' . 9 . C2' . 9 . C1' . 9 . O4' parsed_2lbj 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 11 . O4' . 11 . C4' . 11 . C3' . 11 . C2' parsed_2lbj 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 11 . C4' . 11 . C3' . 11 . C2' . 11 . C1' parsed_2lbj 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 11 . C3' . 11 . C2' . 11 . C1' . 11 . O4' parsed_2lbj 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 12 . O4' . 12 . C4' . 12 . C3' . 12 . C2' parsed_2lbj 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 12 . C4' . 12 . C3' . 12 . C2' . 12 . C1' parsed_2lbj 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 12 . C3' . 12 . C2' . 12 . C1' . 12 . O4' parsed_2lbj 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 13 . O4' . 13 . C4' . 13 . C3' . 13 . C2' parsed_2lbj 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 13 . C4' . 13 . C3' . 13 . C2' . 13 . C1' parsed_2lbj 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 13 . C3' . 13 . C2' . 13 . C1' . 13 . O4' parsed_2lbj 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 14 . O4' . 14 . C4' . 14 . C3' . 14 . C2' parsed_2lbj 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 14 . C4' . 14 . C3' . 14 . C2' . 14 . C1' parsed_2lbj 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 14 . C3' . 14 . C2' . 14 . C1' . 14 . O4' parsed_2lbj 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 15 . O4' . 15 . C4' . 15 . C3' . 15 . C2' parsed_2lbj 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 15 . C4' . 15 . C3' . 15 . C2' . 15 . C1' parsed_2lbj 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 15 . C3' . 15 . C2' . 15 . C1' . 15 . O4' parsed_2lbj 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 16 . O4' . 16 . C4' . 16 . C3' . 16 . C2' parsed_2lbj 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 16 . C4' . 16 . C3' . 16 . C2' . 16 . C1' parsed_2lbj 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 16 . C3' . 16 . C2' . 16 . C1' . 16 . O4' parsed_2lbj 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.1 -33.1 . . 17 . O4' . 17 . C4' . 17 . C3' . 17 . C2' parsed_2lbj 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34.3 40.3 . . 17 . C4' . 17 . C3' . 17 . C2' . 17 . C1' parsed_2lbj 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.8 -22.8 . . 17 . C3' . 17 . C2' . 17 . C1' . 17 . O4' parsed_2lbj 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 1 . C5 . 1 . C6 . 1 . N1 . 17 . N3 parsed_2lbj 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 1 . C5 . 1 . C6 . 1 . O6 . 17 . N4 parsed_2lbj 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 2 . C5 . 2 . C6 . 2 . N1 . 16 . N3 parsed_2lbj 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 2 . C5 . 2 . C6 . 2 . O6 . 16 . N4 parsed_2lbj 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 3 . C5 . 3 . C6 . 3 . N1 . 15 . O2 parsed_2lbj 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 3 . C5 . 3 . C6 . 3 . O6 . 15 . N3 parsed_2lbj 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 14 . C5 . 14 . C6 . 14 . N1 . 4 . N3 parsed_2lbj 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 14 . C5 . 14 . C6 . 14 . O6 . 4 . N4 parsed_2lbj 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 13 . C5 . 13 . C6 . 13 . N1 . 5 . N3 parsed_2lbj 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 13 . C5 . 13 . C6 . 13 . O6 . 5 . N4 parsed_2lbj 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 12 . C5 . 12 . C6 . 12 . N1 . 6 . N3 parsed_2lbj 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 175.0 185.0 . . 12 . C5 . 12 . C6 . 12 . N6 . 6 . O4 parsed_2lbj 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 Beta 1 1 1 6 parsed_2lbj 1
2
;
assign (resid 9 and name P )
(resid 9 and name O5')
(resid 9 and name C5')
(resid 9 and name C4') 30.0 -180.0 120.0 2
assign (resid 10 and name P )
(resid 10 and name O5')
(resid 10 and name C5')
(resid 10 and name C4') 30.0 -180.0 120.0 2
;
38 1 46 55 parsed_2lbj 1
3 Gamma 83 1 83 7 parsed_2lbj 1
4 Epsilon 149 1 149 9 parsed_2lbj 1
5 Alpha 211 1 211 7 parsed_2lbj 1
6 Zeta 292 1 292 6 parsed_2lbj 1
7
;
Delta
assign ( resid 10 and name C5' )
( resid 10 and name C4' )
( resid 10 and name C3' )
( resid 10 and name O3' ) 10.0 162.0 30.0 2 !delta
Sugar pucker
G1-C5 and G13-C17 are C3' endo
;
375 1 383 32 parsed_2lbj 1
8
;
assign (resid 10 and name O4')
(resid 10 and name C4')
(resid 10 and name C3')
(resid 10 and name C2') 30.0 33.0 3.0 2
assign (resid 10 and name C4')
(resid 10 and name C3')
(resid 10 and name C2')
(resid 10 and name C1') 30.0 -34.9 3.0 2
assign (resid 10 and name C3')
(resid 10 and name C2')
(resid 10 and name C1')
(resid 10 and name O4') 30.0 24.9 3.0 2
;
502 1 513 50 parsed_2lbj 1
9
;
Base pair
G1-C17
;
606 1 608 8 parsed_2lbj 1
10 G2-C16 618 1 618 8 parsed_2lbj 1
11 G3-U15 627 1 627 8 parsed_2lbj 1
12 G14-C4 636 1 636 8 parsed_2lbj 1
13 G13-C5 646 1 646 8 parsed_2lbj 1
14 A12-U6 656 1 656 8 parsed_2lbj 1
stop_
save_
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