NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
35290 |
1laq   |
cing | 2-parsed | STAR | distance | NOE | ambi | 188 |
data_1laq_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1laq
_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_1laq 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1laq
_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 1laq "Master copy" parsed_1laq
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1laq
_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 1laq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 3 distance NOE ambi 182 parsed_1laq 1
1 1laq.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 5 distance NOE ambi 140 parsed_1laq 1
1 1laq.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 7 distance NOE ambi 188 parsed_1laq 1
1 1laq.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 9 distance NOE ambi 0 parsed_1laq 1
1 1laq.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 11 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 13 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . n/a 14 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . XPLOR/CNS 15 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . n/a 16 comment "Not applicable" "Not applicable" 0 parsed_1laq 1
1 1laq.mr . . "MR format" 17 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1laq 1
stop_
save_
save_CNS/XPLOR_distance_constraints_7
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1laq
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 7
_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_1laq 1
2 1 . . . parsed_1laq 1
3 1 . . . parsed_1laq 1
4 1 . . . parsed_1laq 1
5 1 . . . parsed_1laq 1
6 1 . . . parsed_1laq 1
7 1 . . . parsed_1laq 1
8 1 . . . parsed_1laq 1
9 1 . . . parsed_1laq 1
10 1 . . . parsed_1laq 1
11 1 . . . parsed_1laq 1
12 1 . . . parsed_1laq 1
13 1 . . . parsed_1laq 1
14 1 . . . parsed_1laq 1
15 1 . . . parsed_1laq 1
16 1 . . . parsed_1laq 1
17 1 . . . parsed_1laq 1
18 1 . . . parsed_1laq 1
19 1 . . . parsed_1laq 1
20 1 . . . parsed_1laq 1
21 1 . . . parsed_1laq 1
22 1 . . . parsed_1laq 1
23 1 . . . parsed_1laq 1
24 1 . . . parsed_1laq 1
25 1 . . . parsed_1laq 1
26 1 . . . parsed_1laq 1
27 1 . . . parsed_1laq 1
28 1 . . . parsed_1laq 1
29 1 . . . parsed_1laq 1
30 1 . . . parsed_1laq 1
31 1 . . . parsed_1laq 1
32 1 . . . parsed_1laq 1
33 1 . . . parsed_1laq 1
34 1 . . . parsed_1laq 1
35 1 . . . parsed_1laq 1
36 1 . . . parsed_1laq 1
37 1 . . . parsed_1laq 1
38 1 . . . parsed_1laq 1
39 1 . . . parsed_1laq 1
40 1 . . . parsed_1laq 1
41 1 . . . parsed_1laq 1
42 1 . . . parsed_1laq 1
43 1 . . . parsed_1laq 1
44 1 . . . parsed_1laq 1
45 1 . . . parsed_1laq 1
46 1 . . . parsed_1laq 1
47 1 . . . parsed_1laq 1
48 1 . . . parsed_1laq 1
49 1 . . . parsed_1laq 1
50 1 . . . parsed_1laq 1
51 1 . . . parsed_1laq 1
52 1 . . . parsed_1laq 1
53 1 . . . parsed_1laq 1
54 1 . . . parsed_1laq 1
55 1 . . . parsed_1laq 1
56 1 . . . parsed_1laq 1
57 1 . . . parsed_1laq 1
58 1 . . . parsed_1laq 1
59 1 . . . parsed_1laq 1
60 1 . . . parsed_1laq 1
61 1 . . . parsed_1laq 1
62 1 . . . parsed_1laq 1
63 1 . . . parsed_1laq 1
64 1 . . . parsed_1laq 1
65 1 . . . parsed_1laq 1
66 1 . . . parsed_1laq 1
67 1 . . . parsed_1laq 1
68 1 . . . parsed_1laq 1
69 1 . . . parsed_1laq 1
70 1 . . . parsed_1laq 1
71 1 . . . parsed_1laq 1
72 1 . . . parsed_1laq 1
73 1 . . . parsed_1laq 1
74 1 . . . parsed_1laq 1
75 1 . . . parsed_1laq 1
76 1 . . . parsed_1laq 1
77 1 . . . parsed_1laq 1
78 1 . . . parsed_1laq 1
79 1 . . . parsed_1laq 1
80 1 . . . parsed_1laq 1
81 1 . . . parsed_1laq 1
82 1 . . . parsed_1laq 1
83 1 . . . parsed_1laq 1
84 1 . . . parsed_1laq 1
85 1 . . . parsed_1laq 1
86 1 . . . parsed_1laq 1
87 1 . . . parsed_1laq 1
88 1 . . . parsed_1laq 1
89 1 . . . parsed_1laq 1
90 1 . . . parsed_1laq 1
91 1 . . . parsed_1laq 1
92 1 . . . parsed_1laq 1
93 1 . . . parsed_1laq 1
94 1 . . . parsed_1laq 1
95 1 . . . parsed_1laq 1
96 1 . . . parsed_1laq 1
97 1 . . . parsed_1laq 1
98 1 . . . parsed_1laq 1
99 1 . . . parsed_1laq 1
100 1 . . . parsed_1laq 1
101 1 . . . parsed_1laq 1
102 1 . . . parsed_1laq 1
103 1 . . . parsed_1laq 1
104 1 . . . parsed_1laq 1
105 1 . . . parsed_1laq 1
106 1 . . . parsed_1laq 1
107 1 . . . parsed_1laq 1
108 1 . . . parsed_1laq 1
109 1 . . . parsed_1laq 1
110 1 . . . parsed_1laq 1
111 1 . . . parsed_1laq 1
112 1 . . . parsed_1laq 1
113 1 . . . parsed_1laq 1
114 1 . . . parsed_1laq 1
115 1 . . . parsed_1laq 1
116 1 . . . parsed_1laq 1
117 1 . . . parsed_1laq 1
118 1 . . . parsed_1laq 1
119 1 . . . parsed_1laq 1
120 1 . . . parsed_1laq 1
121 1 . . . parsed_1laq 1
122 1 . . . parsed_1laq 1
123 1 . . . parsed_1laq 1
124 1 . . . parsed_1laq 1
125 1 . . . parsed_1laq 1
126 1 . . . parsed_1laq 1
127 1 . . . parsed_1laq 1
128 1 . . . parsed_1laq 1
129 1 . . . parsed_1laq 1
130 1 . . . parsed_1laq 1
131 1 . . . parsed_1laq 1
132 1 . . . parsed_1laq 1
133 1 . . . parsed_1laq 1
134 1 . . . parsed_1laq 1
135 1 . . . parsed_1laq 1
136 1 . . . parsed_1laq 1
137 1 . . . parsed_1laq 1
138 1 . . . parsed_1laq 1
139 1 . . . parsed_1laq 1
140 1 . . . parsed_1laq 1
141 1 . . . parsed_1laq 1
142 1 . . . parsed_1laq 1
143 1 . . . parsed_1laq 1
144 1 . . . parsed_1laq 1
145 1 . . . parsed_1laq 1
146 1 . . . parsed_1laq 1
147 1 . . . parsed_1laq 1
148 1 . . . parsed_1laq 1
149 1 . . . parsed_1laq 1
150 1 . . . parsed_1laq 1
151 1 . . . parsed_1laq 1
152 1 . . . parsed_1laq 1
153 1 . . . parsed_1laq 1
154 1 . . . parsed_1laq 1
155 1 . . . parsed_1laq 1
156 1 . . . parsed_1laq 1
157 1 . . . parsed_1laq 1
158 1 . . . parsed_1laq 1
159 1 . . . parsed_1laq 1
160 1 . . . parsed_1laq 1
161 1 . . . parsed_1laq 1
162 1 . . . parsed_1laq 1
163 1 . . . parsed_1laq 1
164 1 . . . parsed_1laq 1
165 1 . . . parsed_1laq 1
166 1 . . . parsed_1laq 1
167 1 . . . parsed_1laq 1
168 1 . . . parsed_1laq 1
169 1 . . . parsed_1laq 1
170 1 . . . parsed_1laq 1
171 1 . . . parsed_1laq 1
172 1 . . . parsed_1laq 1
173 1 . . . parsed_1laq 1
174 1 . . . parsed_1laq 1
175 1 . . . parsed_1laq 1
176 1 . . . parsed_1laq 1
177 1 . . . parsed_1laq 1
178 1 . . . parsed_1laq 1
179 1 . . . parsed_1laq 1
180 1 . . . parsed_1laq 1
181 1 . . . parsed_1laq 1
182 1 . . . parsed_1laq 1
183 1 . . . parsed_1laq 1
184 1 . . . parsed_1laq 1
185 1 . . . parsed_1laq 1
186 1 . . . parsed_1laq 1
187 1 . . . parsed_1laq 1
188 1 . . . parsed_1laq 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 . H1' parsed_1laq 1
1 1 2 . . . . . . . . . 1 . H2' parsed_1laq 1
2 1 1 . . . . . . . . . 1 . H1' parsed_1laq 1
2 1 2 . . . . . . . . . 1 . H2'' parsed_1laq 1
3 1 1 . . . . . . . . . 1 . H3' parsed_1laq 1
3 1 2 . . . . . . . . . 1 . H4' parsed_1laq 1
4 1 1 . . . . . . . . . 2 . H8 parsed_1laq 1
4 1 2 . . . . . . . . . 2 . H2' parsed_1laq 1
5 1 1 . . . . . . . . . 2 . H8 parsed_1laq 1
5 1 2 . . . . . . . . . 2 . H2'' parsed_1laq 1
6 1 1 . . . . . . . . . 2 . H1' parsed_1laq 1
6 1 2 . . . . . . . . . 2 . H3' parsed_1laq 1
7 1 1 . . . . . . . . . 2 . H3' parsed_1laq 1
7 1 2 . . . . . . . . . 2 . H4' parsed_1laq 1
8 1 1 . . . . . . . . . 2 . H3' parsed_1laq 1
8 1 2 . . . . . . . . . 2 . H5' parsed_1laq 1
9 1 1 . . . . . . . . . 2 . H3' parsed_1laq 1
9 1 2 . . . . . . . . . 2 . H5'' parsed_1laq 1
10 1 1 . . . . . . . . . 3 . H6 parsed_1laq 1
10 1 2 . . . . . . . . . 2 . H2'' parsed_1laq 1
11 1 1 . . . . . . . . . 3 . H5 parsed_1laq 1
11 1 2 . . . . . . . . . 2 . H2' parsed_1laq 1
12 1 1 . . . . . . . . . 3 . H6 parsed_1laq 1
12 1 2 . . . . . . . . . 3 . H2' parsed_1laq 1
13 1 1 . . . . . . . . . 3 . H6 parsed_1laq 1
13 1 2 . . . . . . . . . 3 . H2'' parsed_1laq 1
14 1 1 . . . . . . . . . 3 . H6 parsed_1laq 1
14 1 2 . . . . . . . . . 3 . H4' parsed_1laq 1
15 1 1 . . . . . . . . . 3 . H5' parsed_1laq 1
15 1 1 . . . . . . . . . 3 . H5'' parsed_1laq 1
15 1 2 . . . . . . . . . 3 . H6 parsed_1laq 1
16 1 1 . . . . . . . . . 3 . H1' parsed_1laq 1
16 1 2 . . . . . . . . . 3 . H2' parsed_1laq 1
17 1 1 . . . . . . . . . 3 . H1' parsed_1laq 1
17 1 2 . . . . . . . . . 3 . H2'' parsed_1laq 1
18 1 1 . . . . . . . . . 3 . H1' parsed_1laq 1
18 1 2 . . . . . . . . . 3 . H3' parsed_1laq 1
19 1 1 . . . . . . . . . 3 . H2'' parsed_1laq 1
19 1 2 . . . . . . . . . 3 . H3' parsed_1laq 1
20 1 1 . . . . . . . . . 3 . H2' parsed_1laq 1
20 1 2 . . . . . . . . . 3 . H4' parsed_1laq 1
21 1 1 . . . . . . . . . 3 . H1' parsed_1laq 1
21 1 2 . . . . . . . . . 4 . H4' parsed_1laq 1
22 1 1 . . . . . . . . . 4 . H8 parsed_1laq 1
22 1 2 . . . . . . . . . 4 . H2'' parsed_1laq 1
23 1 1 . . . . . . . . . 4 . H1' parsed_1laq 1
23 1 2 . . . . . . . . . 4 . H2' parsed_1laq 1
24 1 1 . . . . . . . . . 4 . H1' parsed_1laq 1
24 1 2 . . . . . . . . . 4 . H2'' parsed_1laq 1
25 1 1 . . . . . . . . . 4 . H2' parsed_1laq 1
25 1 2 . . . . . . . . . 4 . H3' parsed_1laq 1
26 1 1 . . . . . . . . . 4 . H2'' parsed_1laq 1
26 1 2 . . . . . . . . . 4 . H3' parsed_1laq 1
27 1 1 . . . . . . . . . 4 . H3' parsed_1laq 1
27 1 2 . . . . . . . . . 4 . H4' parsed_1laq 1
28 1 1 . . . . . . . . . 4 . H3' parsed_1laq 1
28 1 2 . . . . . . . . . 4 . H5' parsed_1laq 1
29 1 1 . . . . . . . . . 4 . H3' parsed_1laq 1
29 1 2 . . . . . . . . . 4 . H5'' parsed_1laq 1
30 1 1 . . . . . . . . . 5 . H8 parsed_1laq 1
30 1 2 . . . . . . . . . 4 . H2'' parsed_1laq 1
31 1 1 . . . . . . . . . 5 . H8 parsed_1laq 1
31 1 2 . . . . . . . . . 5 . H4' parsed_1laq 1
32 1 1 . . . . . . . . . 5 . H1' parsed_1laq 1
32 1 2 . . . . . . . . . 5 . H2' parsed_1laq 1
33 1 1 . . . . . . . . . 5 . H2'' parsed_1laq 1
33 1 2 . . . . . . . . . 5 . H4' parsed_1laq 1
34 1 1 . . . . . . . . . 5 . H3' parsed_1laq 1
34 1 2 . . . . . . . . . 5 . H4' parsed_1laq 1
35 1 1 . . . . . . . . . 5 . H5' parsed_1laq 1
35 1 1 . . . . . . . . . 5 . H5'' parsed_1laq 1
35 1 2 . . . . . . . . . 5 . H3' parsed_1laq 1
36 1 1 . . . . . . . . . 5 . H1' parsed_1laq 1
36 1 2 . . . . . . . . . 6 . H3' parsed_1laq 1
37 1 1 . . . . . . . . . 6 . H6 parsed_1laq 1
37 1 2 . . . . . . . . . 5 . H2'' parsed_1laq 1
38 1 1 . . . . . . . . . 6 . H6 parsed_1laq 1
38 1 2 . . . . . . . . . 5 . H4' parsed_1laq 1
39 1 1 . . . . . . . . . 6 . H6 parsed_1laq 1
39 1 2 . . . . . . . . . 6 . H2'' parsed_1laq 1
40 1 1 . . . . . . . . . 6 . H5# parsed_1laq 1
40 1 2 . . . . . . . . . 6 . H2' parsed_1laq 1
41 1 1 . . . . . . . . . 6 . H1' parsed_1laq 1
41 1 2 . . . . . . . . . 6 . H3' parsed_1laq 1
42 1 1 . . . . . . . . . 7 . H8 parsed_1laq 1
42 1 2 . . . . . . . . . 7 . H1' parsed_1laq 1
43 1 1 . . . . . . . . . 7 . H1' parsed_1laq 1
43 1 2 . . . . . . . . . 7 . H3' parsed_1laq 1
44 1 1 . . . . . . . . . 8 . H6 parsed_1laq 1
44 1 2 . . . . . . . . . 7 . H3' parsed_1laq 1
45 1 1 . . . . . . . . . 8 . H2' parsed_1laq 1
45 1 1 . . . . . . . . . 8 . H2'' parsed_1laq 1
45 1 2 . . . . . . . . . 8 . H6 parsed_1laq 1
46 1 1 . . . . . . . . . 8 . H6 parsed_1laq 1
46 1 2 . . . . . . . . . 8 . H3' parsed_1laq 1
47 1 1 . . . . . . . . . 8 . H2' parsed_1laq 1
47 1 1 . . . . . . . . . 8 . H2'' parsed_1laq 1
47 1 2 . . . . . . . . . 8 . H1' parsed_1laq 1
48 1 1 . . . . . . . . . 8 . H1' parsed_1laq 1
48 1 2 . . . . . . . . . 8 . H4' parsed_1laq 1
49 1 1 . . . . . . . . . 8 . H2' parsed_1laq 1
49 1 1 . . . . . . . . . 8 . H2'' parsed_1laq 1
49 1 2 . . . . . . . . . 8 . H3' parsed_1laq 1
50 1 1 . . . . . . . . . 8 . H5' parsed_1laq 1
50 1 1 . . . . . . . . . 8 . H5'' parsed_1laq 1
50 1 2 . . . . . . . . . 8 . H3' parsed_1laq 1
51 1 1 . . . . . . . . . 8 . H1' parsed_1laq 1
51 1 2 . . . . . . . . . 9 . H3' parsed_1laq 1
52 1 1 . . . . . . . . . 8 . H2' parsed_1laq 1
52 1 1 . . . . . . . . . 8 . H2'' parsed_1laq 1
52 1 2 . . . . . . . . . 9 . H6 parsed_1laq 1
53 1 1 . . . . . . . . . 9 . H6 parsed_1laq 1
53 1 2 . . . . . . . . . 8 . H3' parsed_1laq 1
54 1 1 . . . . . . . . . 8 . H2' parsed_1laq 1
54 1 1 . . . . . . . . . 8 . H2'' parsed_1laq 1
54 1 2 . . . . . . . . . 9 . H5 parsed_1laq 1
55 1 1 . . . . . . . . . 9 . H6 parsed_1laq 1
55 1 2 . . . . . . . . . 9 . H4' parsed_1laq 1
56 1 1 . . . . . . . . . 9 . H5' parsed_1laq 1
56 1 1 . . . . . . . . . 9 . H5'' parsed_1laq 1
56 1 2 . . . . . . . . . 9 . H6 parsed_1laq 1
57 1 1 . . . . . . . . . 9 . H1' parsed_1laq 1
57 1 2 . . . . . . . . . 9 . H2'' parsed_1laq 1
58 1 1 . . . . . . . . . 9 . H1' parsed_1laq 1
58 1 2 . . . . . . . . . 9 . H3' parsed_1laq 1
59 1 1 . . . . . . . . . 9 . H2' parsed_1laq 1
59 1 2 . . . . . . . . . 9 . H3' parsed_1laq 1
60 1 1 . . . . . . . . . 9 . H2'' parsed_1laq 1
60 1 2 . . . . . . . . . 9 . H3' parsed_1laq 1
61 1 1 . . . . . . . . . 10 . H6 parsed_1laq 1
61 1 2 . . . . . . . . . 9 . H2' parsed_1laq 1
62 1 1 . . . . . . . . . 10 . H6 parsed_1laq 1
62 1 2 . . . . . . . . . 9 . H4' parsed_1laq 1
63 1 1 . . . . . . . . . 10 . H6 parsed_1laq 1
63 1 2 . . . . . . . . . 9 . H6 parsed_1laq 1
64 1 1 . . . . . . . . . 10 . H5 parsed_1laq 1
64 1 2 . . . . . . . . . 9 . H2'' parsed_1laq 1
65 1 1 . . . . . . . . . 10 . H6 parsed_1laq 1
65 1 2 . . . . . . . . . 10 . H1' parsed_1laq 1
66 1 1 . . . . . . . . . 10 . H6 parsed_1laq 1
66 1 2 . . . . . . . . . 10 . H2'' parsed_1laq 1
67 1 1 . . . . . . . . . 10 . H6 parsed_1laq 1
67 1 2 . . . . . . . . . 10 . H4' parsed_1laq 1
68 1 1 . . . . . . . . . 10 . H5' parsed_1laq 1
68 1 1 . . . . . . . . . 10 . H5'' parsed_1laq 1
68 1 2 . . . . . . . . . 10 . H6 parsed_1laq 1
69 1 1 . . . . . . . . . 10 . H2' parsed_1laq 1
69 1 2 . . . . . . . . . 10 . H3' parsed_1laq 1
70 1 1 . . . . . . . . . 10 . H2'' parsed_1laq 1
70 1 2 . . . . . . . . . 10 . H3' parsed_1laq 1
71 1 1 . . . . . . . . . 11 . H8 parsed_1laq 1
71 1 2 . . . . . . . . . 10 . H1' parsed_1laq 1
72 1 1 . . . . . . . . . 11 . H8 parsed_1laq 1
72 1 2 . . . . . . . . . 10 . H2' parsed_1laq 1
73 1 1 . . . . . . . . . 11 . H8 parsed_1laq 1
73 1 2 . . . . . . . . . 11 . H1' parsed_1laq 1
74 1 1 . . . . . . . . . 11 . H1' parsed_1laq 1
74 1 2 . . . . . . . . . 11 . H3' parsed_1laq 1
75 1 1 . . . . . . . . . 11 . H3' parsed_1laq 1
75 1 2 . . . . . . . . . 11 . H4' parsed_1laq 1
76 1 1 . . . . . . . . . 11 . H3' parsed_1laq 1
76 1 2 . . . . . . . . . 11 . H5' parsed_1laq 1
77 1 1 . . . . . . . . . 11 . H3' parsed_1laq 1
77 1 2 . . . . . . . . . 11 . H5'' parsed_1laq 1
78 1 1 . . . . . . . . . 11 . H8 parsed_1laq 1
78 1 2 . . . . . . . . . 12 . H5 parsed_1laq 1
79 1 1 . . . . . . . . . 12 . H6 parsed_1laq 1
79 1 2 . . . . . . . . . 11 . H1' parsed_1laq 1
80 1 1 . . . . . . . . . 12 . H6 parsed_1laq 1
80 1 2 . . . . . . . . . 11 . H2' parsed_1laq 1
81 1 1 . . . . . . . . . 12 . H6 parsed_1laq 1
81 1 2 . . . . . . . . . 11 . H3' parsed_1laq 1
82 1 1 . . . . . . . . . 12 . H6 parsed_1laq 1
82 1 2 . . . . . . . . . 12 . H2'' parsed_1laq 1
83 1 1 . . . . . . . . . 12 . H5 parsed_1laq 1
83 1 2 . . . . . . . . . 12 . H1' parsed_1laq 1
84 1 1 . . . . . . . . . 12 . H1' parsed_1laq 1
84 1 2 . . . . . . . . . 12 . H2'' parsed_1laq 1
85 1 1 . . . . . . . . . 12 . H1' parsed_1laq 1
85 1 2 . . . . . . . . . 12 . H4' parsed_1laq 1
86 1 1 . . . . . . . . . 12 . H2' parsed_1laq 1
86 1 2 . . . . . . . . . 12 . H3' parsed_1laq 1
87 1 1 . . . . . . . . . 12 . H2'' parsed_1laq 1
87 1 2 . . . . . . . . . 12 . H3' parsed_1laq 1
88 1 1 . . . . . . . . . 12 . H2' parsed_1laq 1
88 1 2 . . . . . . . . . 12 . H4' parsed_1laq 1
89 1 1 . . . . . . . . . 12 . H1' parsed_1laq 1
89 1 2 . . . . . . . . . 13 . H3' parsed_1laq 1
90 1 1 . . . . . . . . . 13 . H8 parsed_1laq 1
90 1 2 . . . . . . . . . 12 . H2'' parsed_1laq 1
91 1 1 . . . . . . . . . 13 . H8 parsed_1laq 1
91 1 2 . . . . . . . . . 13 . H2'' parsed_1laq 1
92 1 1 . . . . . . . . . 13 . H1' parsed_1laq 1
92 1 2 . . . . . . . . . 13 . H4' parsed_1laq 1
93 1 1 . . . . . . . . . 13 . H5' parsed_1laq 1
93 1 1 . . . . . . . . . 13 . H5'' parsed_1laq 1
93 1 2 . . . . . . . . . 13 . H1' parsed_1laq 1
94 1 1 . . . . . . . . . 13 . H3' parsed_1laq 1
94 1 2 . . . . . . . . . 13 . H4' parsed_1laq 1
95 1 1 . . . . . . . . . 14 . H1' parsed_1laq 1
95 1 2 . . . . . . . . . 14 . H2' parsed_1laq 1
96 1 1 . . . . . . . . . 14 . H1' parsed_1laq 1
96 1 2 . . . . . . . . . 14 . H2'' parsed_1laq 1
97 1 1 . . . . . . . . . 14 . H3' parsed_1laq 1
97 1 2 . . . . . . . . . 14 . H4' parsed_1laq 1
98 1 1 . . . . . . . . . 15 . H8 parsed_1laq 1
98 1 2 . . . . . . . . . 15 . H2' parsed_1laq 1
99 1 1 . . . . . . . . . 15 . H8 parsed_1laq 1
99 1 2 . . . . . . . . . 15 . H2'' parsed_1laq 1
100 1 1 . . . . . . . . . 15 . H1' parsed_1laq 1
100 1 2 . . . . . . . . . 15 . H3' parsed_1laq 1
101 1 1 . . . . . . . . . 15 . H3' parsed_1laq 1
101 1 2 . . . . . . . . . 15 . H4' parsed_1laq 1
102 1 1 . . . . . . . . . 15 . H3' parsed_1laq 1
102 1 2 . . . . . . . . . 15 . H5' parsed_1laq 1
103 1 1 . . . . . . . . . 15 . H3' parsed_1laq 1
103 1 2 . . . . . . . . . 15 . H5'' parsed_1laq 1
104 1 1 . . . . . . . . . 16 . H6 parsed_1laq 1
104 1 2 . . . . . . . . . 15 . H2'' parsed_1laq 1
105 1 1 . . . . . . . . . 16 . H5 parsed_1laq 1
105 1 2 . . . . . . . . . 15 . H2' parsed_1laq 1
106 1 1 . . . . . . . . . 16 . H6 parsed_1laq 1
106 1 2 . . . . . . . . . 16 . H2' parsed_1laq 1
107 1 1 . . . . . . . . . 16 . H6 parsed_1laq 1
107 1 2 . . . . . . . . . 16 . H2'' parsed_1laq 1
108 1 1 . . . . . . . . . 16 . H6 parsed_1laq 1
108 1 2 . . . . . . . . . 16 . H4' parsed_1laq 1
109 1 1 . . . . . . . . . 16 . H5' parsed_1laq 1
109 1 1 . . . . . . . . . 16 . H5'' parsed_1laq 1
109 1 2 . . . . . . . . . 16 . H6 parsed_1laq 1
110 1 1 . . . . . . . . . 16 . H1' parsed_1laq 1
110 1 2 . . . . . . . . . 16 . H3' parsed_1laq 1
111 1 1 . . . . . . . . . 17 . H8 parsed_1laq 1
111 1 2 . . . . . . . . . 17 . H2'' parsed_1laq 1
112 1 1 . . . . . . . . . 17 . H8 parsed_1laq 1
112 1 2 . . . . . . . . . 17 . H5' parsed_1laq 1
113 1 1 . . . . . . . . . 17 . H1' parsed_1laq 1
113 1 2 . . . . . . . . . 17 . H2' parsed_1laq 1
114 1 1 . . . . . . . . . 17 . H1' parsed_1laq 1
114 1 2 . . . . . . . . . 17 . H2'' parsed_1laq 1
115 1 1 . . . . . . . . . 17 . H2' parsed_1laq 1
115 1 2 . . . . . . . . . 17 . H4' parsed_1laq 1
116 1 1 . . . . . . . . . 17 . H2'' parsed_1laq 1
116 1 2 . . . . . . . . . 17 . H4' parsed_1laq 1
117 1 1 . . . . . . . . . 17 . H3' parsed_1laq 1
117 1 2 . . . . . . . . . 17 . H4' parsed_1laq 1
118 1 1 . . . . . . . . . 17 . H3' parsed_1laq 1
118 1 2 . . . . . . . . . 17 . H5' parsed_1laq 1
119 1 1 . . . . . . . . . 17 . H3' parsed_1laq 1
119 1 2 . . . . . . . . . 17 . H5'' parsed_1laq 1
120 1 1 . . . . . . . . . 17 . H1' parsed_1laq 1
120 1 2 . . . . . . . . . 18 . H4' parsed_1laq 1
121 1 1 . . . . . . . . . 18 . H8 parsed_1laq 1
121 1 2 . . . . . . . . . 17 . H2' parsed_1laq 1
122 1 1 . . . . . . . . . 18 . H8 parsed_1laq 1
122 1 2 . . . . . . . . . 17 . H2'' parsed_1laq 1
123 1 1 . . . . . . . . . 18 . H8 parsed_1laq 1
123 1 2 . . . . . . . . . 17 . H8 parsed_1laq 1
124 1 1 . . . . . . . . . 18 . H8 parsed_1laq 1
124 1 2 . . . . . . . . . 18 . H2' parsed_1laq 1
125 1 1 . . . . . . . . . 18 . H8 parsed_1laq 1
125 1 2 . . . . . . . . . 18 . H2'' parsed_1laq 1
126 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
126 1 2 . . . . . . . . . 18 . H2' parsed_1laq 1
127 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
127 1 2 . . . . . . . . . 18 . H2'' parsed_1laq 1
128 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
128 1 2 . . . . . . . . . 18 . H8 parsed_1laq 1
129 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
129 1 2 . . . . . . . . . 19 . H2' parsed_1laq 1
130 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
130 1 2 . . . . . . . . . 19 . H2'' parsed_1laq 1
131 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
131 1 2 . . . . . . . . . 19 . H4' parsed_1laq 1
132 1 1 . . . . . . . . . 19 . H5' parsed_1laq 1
132 1 1 . . . . . . . . . 19 . H5'' parsed_1laq 1
132 1 2 . . . . . . . . . 19 . H8 parsed_1laq 1
133 1 1 . . . . . . . . . 19 . H1' parsed_1laq 1
133 1 2 . . . . . . . . . 19 . H4' parsed_1laq 1
134 1 1 . . . . . . . . . 19 . H3' parsed_1laq 1
134 1 2 . . . . . . . . . 19 . H4' parsed_1laq 1
135 1 1 . . . . . . . . . 19 . H8 parsed_1laq 1
135 1 2 . . . . . . . . . 20 . H5 parsed_1laq 1
136 1 1 . . . . . . . . . 19 . H1' parsed_1laq 1
136 1 2 . . . . . . . . . 20 . H5' parsed_1laq 1
137 1 1 . . . . . . . . . 20 . H6 parsed_1laq 1
137 1 2 . . . . . . . . . 19 . H3' parsed_1laq 1
138 1 1 . . . . . . . . . 20 . H6 parsed_1laq 1
138 1 2 . . . . . . . . . 19 . H8 parsed_1laq 1
139 1 1 . . . . . . . . . 20 . H1' parsed_1laq 1
139 1 2 . . . . . . . . . 19 . H1' parsed_1laq 1
140 1 1 . . . . . . . . . 20 . H6 parsed_1laq 1
140 1 2 . . . . . . . . . 20 . H4' parsed_1laq 1
141 1 1 . . . . . . . . . 20 . H6 parsed_1laq 1
141 1 2 . . . . . . . . . 20 . H5'' parsed_1laq 1
142 1 1 . . . . . . . . . 20 . H5 parsed_1laq 1
142 1 2 . . . . . . . . . 20 . H2' parsed_1laq 1
143 1 1 . . . . . . . . . 20 . H1' parsed_1laq 1
143 1 2 . . . . . . . . . 20 . H4' parsed_1laq 1
144 1 1 . . . . . . . . . 20 . H2'' parsed_1laq 1
144 1 2 . . . . . . . . . 20 . H4' parsed_1laq 1
145 1 1 . . . . . . . . . 20 . H3' parsed_1laq 1
145 1 2 . . . . . . . . . 20 . H5' parsed_1laq 1
146 1 1 . . . . . . . . . 21 . H8 parsed_1laq 1
146 1 2 . . . . . . . . . 20 . H6 parsed_1laq 1
147 1 1 . . . . . . . . . 21 . H8 parsed_1laq 1
147 1 2 . . . . . . . . . 21 . H4' parsed_1laq 1
148 1 1 . . . . . . . . . 21 . H8 parsed_1laq 1
148 1 2 . . . . . . . . . 21 . H5' parsed_1laq 1
149 1 1 . . . . . . . . . 21 . H8 parsed_1laq 1
149 1 2 . . . . . . . . . 21 . H5'' parsed_1laq 1
150 1 1 . . . . . . . . . 21 . H1' parsed_1laq 1
150 1 2 . . . . . . . . . 21 . H4' parsed_1laq 1
151 1 1 . . . . . . . . . 21 . H2' parsed_1laq 1
151 1 1 . . . . . . . . . 21 . H2'' parsed_1laq 1
151 1 2 . . . . . . . . . 21 . H3' parsed_1laq 1
152 1 1 . . . . . . . . . 21 . H2' parsed_1laq 1
152 1 1 . . . . . . . . . 21 . H2'' parsed_1laq 1
152 1 2 . . . . . . . . . 21 . H5'' parsed_1laq 1
153 1 1 . . . . . . . . . 21 . H3' parsed_1laq 1
153 1 2 . . . . . . . . . 21 . H5'' parsed_1laq 1
154 1 1 . . . . . . . . . 22 . H1' parsed_1laq 1
154 1 2 . . . . . . . . . 21 . H1' parsed_1laq 1
155 1 1 . . . . . . . . . 22 . H6 parsed_1laq 1
155 1 2 . . . . . . . . . 22 . H2'' parsed_1laq 1
156 1 1 . . . . . . . . . 22 . H6 parsed_1laq 1
156 1 2 . . . . . . . . . 22 . H4' parsed_1laq 1
157 1 1 . . . . . . . . . 22 . H1' parsed_1laq 1
157 1 2 . . . . . . . . . 22 . H4' parsed_1laq 1
158 1 1 . . . . . . . . . 22 . H3' parsed_1laq 1
158 1 2 . . . . . . . . . 22 . H4' parsed_1laq 1
159 1 1 . . . . . . . . . 23 . H6 parsed_1laq 1
159 1 2 . . . . . . . . . 22 . H6 parsed_1laq 1
160 1 1 . . . . . . . . . 23 . H6 parsed_1laq 1
160 1 2 . . . . . . . . . 23 . H4' parsed_1laq 1
161 1 1 . . . . . . . . . 23 . H5' parsed_1laq 1
161 1 1 . . . . . . . . . 23 . H5'' parsed_1laq 1
161 1 2 . . . . . . . . . 23 . H6 parsed_1laq 1
162 1 1 . . . . . . . . . 23 . H1' parsed_1laq 1
162 1 2 . . . . . . . . . 23 . H2' parsed_1laq 1
163 1 1 . . . . . . . . . 23 . H1' parsed_1laq 1
163 1 2 . . . . . . . . . 23 . H2'' parsed_1laq 1
164 1 1 . . . . . . . . . 23 . H2' parsed_1laq 1
164 1 2 . . . . . . . . . 23 . H3' parsed_1laq 1
165 1 1 . . . . . . . . . 23 . H2'' parsed_1laq 1
165 1 2 . . . . . . . . . 23 . H3' parsed_1laq 1
166 1 1 . . . . . . . . . 24 . H8 parsed_1laq 1
166 1 2 . . . . . . . . . 23 . H2' parsed_1laq 1
167 1 1 . . . . . . . . . 24 . H8 parsed_1laq 1
167 1 2 . . . . . . . . . 23 . H6 parsed_1laq 1
168 1 1 . . . . . . . . . 24 . H1' parsed_1laq 1
168 1 2 . . . . . . . . . 24 . H3' parsed_1laq 1
169 1 1 . . . . . . . . . 24 . H3' parsed_1laq 1
169 1 2 . . . . . . . . . 24 . H4' parsed_1laq 1
170 1 1 . . . . . . . . . 24 . H3' parsed_1laq 1
170 1 2 . . . . . . . . . 24 . H5' parsed_1laq 1
171 1 1 . . . . . . . . . 24 . H3' parsed_1laq 1
171 1 2 . . . . . . . . . 24 . H5'' parsed_1laq 1
172 1 1 . . . . . . . . . 24 . H1' parsed_1laq 1
172 1 2 . . . . . . . . . 25 . H2' parsed_1laq 1
173 1 1 . . . . . . . . . 25 . H6 parsed_1laq 1
173 1 2 . . . . . . . . . 24 . H1' parsed_1laq 1
174 1 1 . . . . . . . . . 25 . H6 parsed_1laq 1
174 1 2 . . . . . . . . . 24 . H2' parsed_1laq 1
175 1 1 . . . . . . . . . 25 . H6 parsed_1laq 1
175 1 2 . . . . . . . . . 24 . H3' parsed_1laq 1
176 1 1 . . . . . . . . . 25 . H6 parsed_1laq 1
176 1 2 . . . . . . . . . 25 . H2'' parsed_1laq 1
177 1 1 . . . . . . . . . 25 . H5 parsed_1laq 1
177 1 2 . . . . . . . . . 25 . H1' parsed_1laq 1
178 1 1 . . . . . . . . . 25 . H1' parsed_1laq 1
178 1 2 . . . . . . . . . 25 . H2'' parsed_1laq 1
179 1 1 . . . . . . . . . 25 . H1' parsed_1laq 1
179 1 2 . . . . . . . . . 25 . H4' parsed_1laq 1
180 1 1 . . . . . . . . . 25 . H2' parsed_1laq 1
180 1 2 . . . . . . . . . 25 . H3' parsed_1laq 1
181 1 1 . . . . . . . . . 25 . H2'' parsed_1laq 1
181 1 2 . . . . . . . . . 25 . H3' parsed_1laq 1
182 1 1 . . . . . . . . . 25 . H2' parsed_1laq 1
182 1 2 . . . . . . . . . 25 . H4' parsed_1laq 1
183 1 1 . . . . . . . . . 25 . H1' parsed_1laq 1
183 1 2 . . . . . . . . . 26 . H3' parsed_1laq 1
184 1 1 . . . . . . . . . 26 . H8 parsed_1laq 1
184 1 2 . . . . . . . . . 25 . H2'' parsed_1laq 1
185 1 1 . . . . . . . . . 26 . H8 parsed_1laq 1
185 1 2 . . . . . . . . . 26 . H2'' parsed_1laq 1
186 1 1 . . . . . . . . . 26 . H1' parsed_1laq 1
186 1 2 . . . . . . . . . 26 . H4' parsed_1laq 1
187 1 1 . . . . . . . . . 26 . H5' parsed_1laq 1
187 1 1 . . . . . . . . . 26 . H5'' parsed_1laq 1
187 1 2 . . . . . . . . . 26 . H1' parsed_1laq 1
188 1 1 . . . . . . . . . 26 . H3' parsed_1laq 1
188 1 2 . . . . . . . . . 26 . H4' parsed_1laq 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.51 2.00 3.02 parsed_1laq 1
2 1 . . . . . 2.46 2.10 2.82 parsed_1laq 1
3 1 . . . . . 2.66 2.12 3.19 parsed_1laq 1
4 1 . . . . . 2.26 1.98 2.55 parsed_1laq 1
5 1 . . . . . 2.88 2.07 3.69 parsed_1laq 1
6 1 . . . . . 3.04 2.03 4.05 parsed_1laq 1
7 1 . . . . . 2.58 2.23 2.93 parsed_1laq 1
8 1 . . . . . 2.87 1.98 3.75 parsed_1laq 1
9 1 . . . . . 2.90 2.08 3.72 parsed_1laq 1
10 1 . . . . . 2.54 2.30 2.77 parsed_1laq 1
11 1 . . . . . 2.93 2.38 3.48 parsed_1laq 1
12 1 . . . . . 2.37 2.14 2.59 parsed_1laq 1
13 1 . . . . . 2.94 2.23 3.65 parsed_1laq 1
14 1 . . . . . 3.85 2.86 4.85 parsed_1laq 1
15 1 . . . . . 3.54 2.90 4.17 parsed_1laq 1
16 1 . . . . . 2.39 1.88 2.90 parsed_1laq 1
17 1 . . . . . 2.20 2.03 2.37 parsed_1laq 1
18 1 . . . . . 2.92 1.96 3.88 parsed_1laq 1
19 1 . . . . . 2.82 2.37 3.27 parsed_1laq 1
20 1 . . . . . 2.73 1.66 3.80 parsed_1laq 1
21 1 . . . . . 3.93 2.76 5.10 parsed_1laq 1
22 1 . . . . . 3.14 2.19 4.09 parsed_1laq 1
23 1 . . . . . 2.97 2.22 3.72 parsed_1laq 1
24 1 . . . . . 2.22 1.95 2.49 parsed_1laq 1
25 1 . . . . . 2.59 2.33 2.85 parsed_1laq 1
26 1 . . . . . 2.71 2.28 3.13 parsed_1laq 1
27 1 . . . . . 2.54 2.32 2.76 parsed_1laq 1
28 1 . . . . . 2.94 2.04 3.84 parsed_1laq 1
29 1 . . . . . 2.94 2.11 3.77 parsed_1laq 1
30 1 . . . . . 2.81 2.30 3.32 parsed_1laq 1
31 1 . . . . . 3.64 1.86 5.41 parsed_1laq 1
32 1 . . . . . 2.55 2.06 3.05 parsed_1laq 1
33 1 . . . . . 3.53 2.46 4.60 parsed_1laq 1
34 1 . . . . . 2.56 2.19 2.93 parsed_1laq 1
35 1 . . . . . 2.78 2.06 3.50 parsed_1laq 1
36 1 . . . . . 4.43 2.86 6.00 parsed_1laq 1
37 1 . . . . . 2.88 2.30 3.46 parsed_1laq 1
38 1 . . . . . 4.11 2.41 5.80 parsed_1laq 1
39 1 . . . . . 2.85 1.83 3.87 parsed_1laq 1
40 1 . . . . . 4.22 3.14 5.30 parsed_1laq 1
41 1 . . . . . 3.45 2.26 4.64 parsed_1laq 1
42 1 . . . . . 2.38 2.11 2.65 parsed_1laq 1
43 1 . . . . . 3.41 2.44 4.38 parsed_1laq 1
44 1 . . . . . 4.00 3.10 4.89 parsed_1laq 1
45 1 . . . . . 2.96 2.52 3.40 parsed_1laq 1
46 1 . . . . . 3.43 2.59 4.27 parsed_1laq 1
47 1 . . . . . 2.44 2.02 2.86 parsed_1laq 1
48 1 . . . . . 3.19 2.23 4.15 parsed_1laq 1
49 1 . . . . . 2.65 2.31 2.99 parsed_1laq 1
50 1 . . . . . 2.75 2.03 3.47 parsed_1laq 1
51 1 . . . . . 4.20 2.40 6.00 parsed_1laq 1
52 1 . . . . . 3.37 3.00 3.74 parsed_1laq 1
53 1 . . . . . 3.89 2.99 4.79 parsed_1laq 1
54 1 . . . . . 2.92 2.56 3.29 parsed_1laq 1
55 1 . . . . . 3.54 2.49 4.59 parsed_1laq 1
56 1 . . . . . 3.54 2.75 4.33 parsed_1laq 1
57 1 . . . . . 2.25 2.08 2.42 parsed_1laq 1
58 1 . . . . . 3.15 1.87 4.43 parsed_1laq 1
59 1 . . . . . 2.92 2.32 3.51 parsed_1laq 1
60 1 . . . . . 2.52 2.31 2.73 parsed_1laq 1
61 1 . . . . . 3.47 3.00 3.94 parsed_1laq 1
62 1 . . . . . 4.42 3.04 5.80 parsed_1laq 1
63 1 . . . . . 5.00 4.60 5.40 parsed_1laq 1
64 1 . . . . . 2.48 2.06 2.90 parsed_1laq 1
65 1 . . . . . 3.08 2.12 4.04 parsed_1laq 1
66 1 . . . . . 2.87 2.08 3.66 parsed_1laq 1
67 1 . . . . . 3.62 2.62 4.62 parsed_1laq 1
68 1 . . . . . 3.73 3.05 4.41 parsed_1laq 1
69 1 . . . . . 2.52 2.15 2.89 parsed_1laq 1
70 1 . . . . . 2.44 2.17 2.71 parsed_1laq 1
71 1 . . . . . 3.12 2.39 3.85 parsed_1laq 1
72 1 . . . . . 3.48 3.00 3.96 parsed_1laq 1
73 1 . . . . . 3.10 2.22 3.98 parsed_1laq 1
74 1 . . . . . 3.33 2.46 4.20 parsed_1laq 1
75 1 . . . . . 2.42 2.14 2.71 parsed_1laq 1
76 1 . . . . . 2.88 1.94 3.82 parsed_1laq 1
77 1 . . . . . 3.03 1.95 4.11 parsed_1laq 1
78 1 . . . . . 3.83 2.91 4.75 parsed_1laq 1
79 1 . . . . . 3.04 2.34 3.74 parsed_1laq 1
80 1 . . . . . 3.54 3.00 4.08 parsed_1laq 1
81 1 . . . . . 4.38 3.50 5.26 parsed_1laq 1
82 1 . . . . . 2.92 2.09 3.75 parsed_1laq 1
83 1 . . . . . 4.12 2.83 5.41 parsed_1laq 1
84 1 . . . . . 2.15 1.99 2.30 parsed_1laq 1
85 1 . . . . . 3.15 2.25 4.05 parsed_1laq 1
86 1 . . . . . 2.71 2.25 3.17 parsed_1laq 1
87 1 . . . . . 2.65 2.33 2.97 parsed_1laq 1
88 1 . . . . . 3.13 1.87 4.39 parsed_1laq 1
89 1 . . . . . 4.56 3.13 6.00 parsed_1laq 1
90 1 . . . . . 2.82 2.30 3.34 parsed_1laq 1
91 1 . . . . . 2.92 1.93 3.91 parsed_1laq 1
92 1 . . . . . 3.20 2.25 4.15 parsed_1laq 1
93 1 . . . . . 3.88 2.89 4.87 parsed_1laq 1
94 1 . . . . . 2.44 2.11 2.77 parsed_1laq 1
95 1 . . . . . 2.37 1.88 2.85 parsed_1laq 1
96 1 . . . . . 2.52 2.17 2.87 parsed_1laq 1
97 1 . . . . . 2.53 2.04 3.02 parsed_1laq 1
98 1 . . . . . 2.27 1.99 2.55 parsed_1laq 1
99 1 . . . . . 2.90 2.08 3.72 parsed_1laq 1
100 1 . . . . . 3.01 2.03 3.99 parsed_1laq 1
101 1 . . . . . 2.58 2.20 2.96 parsed_1laq 1
102 1 . . . . . 2.83 1.94 3.72 parsed_1laq 1
103 1 . . . . . 2.90 1.93 3.88 parsed_1laq 1
104 1 . . . . . 2.62 2.30 2.94 parsed_1laq 1
105 1 . . . . . 3.00 2.44 3.56 parsed_1laq 1
106 1 . . . . . 2.29 2.12 2.46 parsed_1laq 1
107 1 . . . . . 2.94 2.19 3.69 parsed_1laq 1
108 1 . . . . . 3.88 2.80 4.96 parsed_1laq 1
109 1 . . . . . 3.32 2.56 4.08 parsed_1laq 1
110 1 . . . . . 3.06 1.67 4.45 parsed_1laq 1
111 1 . . . . . 3.18 2.05 4.31 parsed_1laq 1
112 1 . . . . . 3.09 2.29 3.89 parsed_1laq 1
113 1 . . . . . 3.10 2.22 3.98 parsed_1laq 1
114 1 . . . . . 2.29 1.89 2.69 parsed_1laq 1
115 1 . . . . . 3.99 2.85 5.13 parsed_1laq 1
116 1 . . . . . 3.35 2.40 4.30 parsed_1laq 1
117 1 . . . . . 2.58 2.19 2.97 parsed_1laq 1
118 1 . . . . . 2.90 1.95 3.84 parsed_1laq 1
119 1 . . . . . 2.88 1.97 3.78 parsed_1laq 1
120 1 . . . . . 3.83 2.56 5.10 parsed_1laq 1
121 1 . . . . . 3.42 3.00 3.85 parsed_1laq 1
122 1 . . . . . 2.88 2.30 3.47 parsed_1laq 1
123 1 . . . . . 5.00 4.60 5.40 parsed_1laq 1
124 1 . . . . . 2.38 2.07 2.70 parsed_1laq 1
125 1 . . . . . 3.46 2.36 4.57 parsed_1laq 1
126 1 . . . . . 3.46 3.00 3.92 parsed_1laq 1
127 1 . . . . . 2.85 2.30 3.40 parsed_1laq 1
128 1 . . . . . 5.50 5.00 6.00 parsed_1laq 1
129 1 . . . . . 2.31 1.91 2.71 parsed_1laq 1
130 1 . . . . . 2.92 2.02 3.82 parsed_1laq 1
131 1 . . . . . 4.50 2.98 6.01 parsed_1laq 1
132 1 . . . . . 3.67 2.82 4.52 parsed_1laq 1
133 1 . . . . . 3.56 2.62 4.50 parsed_1laq 1
134 1 . . . . . 2.48 2.03 2.93 parsed_1laq 1
135 1 . . . . . 4.07 3.39 4.75 parsed_1laq 1
136 1 . . . . . 4.20 3.40 5.00 parsed_1laq 1
137 1 . . . . . 4.31 3.63 4.99 parsed_1laq 1
138 1 . . . . . 5.00 4.60 5.40 parsed_1laq 1
139 1 . . . . . 3.77 2.58 4.96 parsed_1laq 1
140 1 . . . . . 4.53 3.44 5.61 parsed_1laq 1
141 1 . . . . . 3.62 2.70 4.54 parsed_1laq 1
142 1 . . . . . 4.21 2.40 6.03 parsed_1laq 1
143 1 . . . . . 2.91 2.05 3.77 parsed_1laq 1
144 1 . . . . . 2.92 1.94 3.90 parsed_1laq 1
145 1 . . . . . 3.09 2.09 4.09 parsed_1laq 1
146 1 . . . . . 5.50 5.00 6.00 parsed_1laq 1
147 1 . . . . . 4.55 2.59 6.51 parsed_1laq 1
148 1 . . . . . 3.17 2.32 4.02 parsed_1laq 1
149 1 . . . . . 3.88 2.90 4.87 parsed_1laq 1
150 1 . . . . . 3.62 2.34 4.90 parsed_1laq 1
151 1 . . . . . 2.54 2.33 2.75 parsed_1laq 1
152 1 . . . . . 3.61 2.34 4.88 parsed_1laq 1
153 1 . . . . . 3.01 2.21 3.81 parsed_1laq 1
154 1 . . . . . 4.26 3.13 5.39 parsed_1laq 1
155 1 . . . . . 3.18 2.13 4.23 parsed_1laq 1
156 1 . . . . . 3.46 2.40 4.53 parsed_1laq 1
157 1 . . . . . 3.41 2.38 4.44 parsed_1laq 1
158 1 . . . . . 2.30 1.89 2.71 parsed_1laq 1
159 1 . . . . . 5.00 4.60 5.40 parsed_1laq 1
160 1 . . . . . 3.74 2.68 4.80 parsed_1laq 1
161 1 . . . . . 4.38 3.59 5.17 parsed_1laq 1
162 1 . . . . . 2.35 1.67 3.03 parsed_1laq 1
163 1 . . . . . 2.20 2.05 2.35 parsed_1laq 1
164 1 . . . . . 2.43 2.11 2.75 parsed_1laq 1
165 1 . . . . . 2.46 2.23 2.69 parsed_1laq 1
166 1 . . . . . 3.39 3.00 3.78 parsed_1laq 1
167 1 . . . . . 5.00 4.60 5.40 parsed_1laq 1
168 1 . . . . . 3.27 2.37 4.17 parsed_1laq 1
169 1 . . . . . 2.54 2.12 2.96 parsed_1laq 1
170 1 . . . . . 2.87 1.93 3.81 parsed_1laq 1
171 1 . . . . . 2.97 1.96 3.98 parsed_1laq 1
172 1 . . . . . 3.82 2.64 5.00 parsed_1laq 1
173 1 . . . . . 3.12 2.41 3.83 parsed_1laq 1
174 1 . . . . . 3.48 3.00 3.96 parsed_1laq 1
175 1 . . . . . 4.26 3.33 5.19 parsed_1laq 1
176 1 . . . . . 2.88 2.13 3.63 parsed_1laq 1
177 1 . . . . . 4.45 3.14 5.75 parsed_1laq 1
178 1 . . . . . 2.20 2.02 2.38 parsed_1laq 1
179 1 . . . . . 3.19 2.25 4.13 parsed_1laq 1
180 1 . . . . . 2.70 2.19 3.21 parsed_1laq 1
181 1 . . . . . 2.60 2.25 2.95 parsed_1laq 1
182 1 . . . . . 3.06 1.73 4.39 parsed_1laq 1
183 1 . . . . . 4.54 3.08 6.00 parsed_1laq 1
184 1 . . . . . 2.77 2.29 3.25 parsed_1laq 1
185 1 . . . . . 2.89 1.86 3.92 parsed_1laq 1
186 1 . . . . . 3.21 2.16 4.26 parsed_1laq 1
187 1 . . . . . 3.93 2.95 4.91 parsed_1laq 1
188 1 . . . . . 2.40 2.02 2.78 parsed_1laq 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 "assign ( resid 1 and name H5 )( resid 1 and name H2'' ) 2.74 0.60 0.59 ! OFF" 1 1 1 93 parsed_1laq 1
2 ub+0.5 2 81 2 91 parsed_1laq 1
3 nc 3 81 3 91 parsed_1laq 1
4
;
nc
assign ( resid 1 and name H1' )( resid 2 and name H5'' ) 3.22 0.98 0.98 ! OFF
;
4 81 5 93 parsed_1laq 1
5 nc 6 81 6 91 parsed_1laq 1
6 ub+1.2 7 81 7 91 parsed_1laq 1
7 ub+1 8 81 8 91 parsed_1laq 1
8 ub+0.3 9 81 9 91 parsed_1laq 1
9 ub+1.5 10 81 10 91 parsed_1laq 1
10 ub+1 11 81 11 91 parsed_1laq 1
11 lb=2.3 12 81 12 91 parsed_1laq 1
12 nc 13 81 13 91 parsed_1laq 1
13 nc 14 81 14 91 parsed_1laq 1
14 ub+1 15 81 15 91 parsed_1laq 1
15 ub+1 16 81 16 91 parsed_1laq 1
16
;
nc
assign ( resid 3 and name H5 )( resid 3 and name H2'' ) 3.20 0.60 0.59 ! OFF
;
18 81 19 93 parsed_1laq 1
17 ub+0.5 20 81 20 91 parsed_1laq 1
18 nc 21 81 21 91 parsed_1laq 1
19 ub+1 22 81 22 91 parsed_1laq 1
20 nc 23 81 23 91 parsed_1laq 1
21 ub+1 24 81 24 91 parsed_1laq 1
22 ub=5.1 25 81 25 91 parsed_1laq 1
23 ub+1 26 81 26 91 parsed_1laq 1
24 ub+0.5 27 81 27 91 parsed_1laq 1
25
;
nc
assign ( resid 4 and name H1' )( resid 4 and name H5'' ) 3.68 0.58 0.58 ! OFF
;
28 81 29 93 parsed_1laq 1
26 nc 30 81 30 91 parsed_1laq 1
27 nc 31 81 31 91 parsed_1laq 1
28 nc 32 81 32 91 parsed_1laq 1
29 ub+1.5 33 81 33 91 parsed_1laq 1
30 ub+1 34 81 34 91 parsed_1laq 1
31 lb=2.3 35 81 35 91 parsed_1laq 1
32 ub+1 36 81 36 91 parsed_1laq 1
33 ub+0.5 37 81 37 91 parsed_1laq 1
34 ub+1 38 81 38 91 parsed_1laq 1
35 ub+0.3 39 81 39 91 parsed_1laq 1
36 ub+1 41 81 41 91 parsed_1laq 1
37 ub=6 42 81 42 91 parsed_1laq 1
38 lb=2.3 43 81 43 91 parsed_1laq 1
39 ub=5.8 44 81 44 91 parsed_1laq 1
40 ub+1 45 81 45 91 parsed_1laq 1
41
;
nc
assign ( resid 6 and name H5# )( resid 6 and name H2'' ) 3.82 0.60 0.60 ! OFF
;
46 81 47 93 parsed_1laq 1
42
;
ub+1
assign ( resid 6 and name H5# )( resid 6 and name H4' ) 4.96 1.16 1.16 ! OFF
;
48 81 49 93 parsed_1laq 1
43 nc 50 81 50 91 parsed_1laq 1
44 ub+1 51 81 51 91 parsed_1laq 1
45
;
nc
assign ( resid 8 and name Q2' )( resid 7 and name H3' ) 3.62 0.72 0.71 ! OFF
;
52 81 53 93 parsed_1laq 1
46 ub+0.5 55 81 55 91 parsed_1laq 1
47 ub+0.5 56 81 56 91 parsed_1laq 1
48 ub+0.5 58 81 58 91 parsed_1laq 1
49 ub+1 59 81 59 91 parsed_1laq 1
50 nc 61 81 61 91 parsed_1laq 1
51 ub+1 63 81 63 91 parsed_1laq 1
52 ub=6 64 81 64 91 parsed_1laq 1
53 ub+0.5 66 81 66 91 parsed_1laq 1
54 ub+0.5 67 81 67 91 parsed_1laq 1
55 nc 69 81 69 91 parsed_1laq 1
56 ub+1 70 81 70 91 parsed_1laq 1
57
;
nc
assign ( resid 9 and name H5 )( resid 9 and name H2'' ) 2.91 0.56 0.55 ! OFF
assign ( resid 9 and name H5 )( resid 9 and name Q5' ) 4.01 0.73 0.73 ! OFF
;
72 81 74 93 parsed_1laq 1
58 nc 75 81 75 91 parsed_1laq 1
59 ub+1 76 81 76 91 parsed_1laq 1
60 nc 77 81 77 91 parsed_1laq 1
61 nc 78 81 78 91 parsed_1laq 1
62 ub+1 79 81 79 91 parsed_1laq 1
63 ub=5.8 80 81 80 91 parsed_1laq 1
64 gen 81 81 81 91 parsed_1laq 1
65 nc 82 81 82 91 parsed_1laq 1
66 ub+0.5 83 81 83 91 parsed_1laq 1
67 ub+1.2 84 81 84 91 parsed_1laq 1
68 ub+1.5 85 81 85 91 parsed_1laq 1
69 nc 87 81 87 91 parsed_1laq 1
70 nc 88 81 88 91 parsed_1laq 1
71 nc 89 81 89 91 parsed_1laq 1
72 ub+0.5 90 81 90 91 parsed_1laq 1
73 ub+0.5 91 81 91 91 parsed_1laq 1
74 ub+1.3 92 81 92 91 parsed_1laq 1
75 ub+1 93 81 93 91 parsed_1laq 1
76 nc 94 81 94 91 parsed_1laq 1
77 ub+1.5 95 81 95 91 parsed_1laq 1
78 ub+1 96 81 96 91 parsed_1laq 1
79 ub+4.75 97 81 97 91 parsed_1laq 1
80 ub+0.5 98 81 98 91 parsed_1laq 1
81 ub+0.3 99 81 99 91 parsed_1laq 1
82 ub+0.5 100 81 100 91 parsed_1laq 1
83 ub+1 101 81 101 91 parsed_1laq 1
84 ub+0.5 102 81 102 91 parsed_1laq 1
85 nc 103 81 103 91 parsed_1laq 1
86 ub+1 104 81 104 91 parsed_1laq 1
87 nc 105 81 105 91 parsed_1laq 1
88 nc 106 81 106 91 parsed_1laq 1
89 ub+1 107 81 107 91 parsed_1laq 1
90 ub=6 108 81 108 91 parsed_1laq 1
91 lb=2.3 109 81 109 91 parsed_1laq 1
92 ub+1 110 81 110 91 parsed_1laq 1
93 ub+1 111 81 111 91 parsed_1laq 1
94 ub+1 113 81 113 91 parsed_1laq 1
95
;
nc
assign ( resid 14 and name H5 )( resid 14 and name H2'' ) 3.69 0.76 0.76 ! OFF
;
114 81 115 93 parsed_1laq 1
96 ub+0.5 116 81 116 91 parsed_1laq 1
97 nc 117 81 117 91 parsed_1laq 1
98
;
nc
assign ( resid 14 and name H1' )( resid 15 and name H5'' ) 3.19 1.02 1.02 ! OFF
;
118 81 119 93 parsed_1laq 1
99 nc 120 81 120 91 parsed_1laq 1
100 ub+1.2 121 81 121 91 parsed_1laq 1
101 ub+1 122 81 122 91 parsed_1laq 1
102 ub+0.3 123 81 123 91 parsed_1laq 1
103 ub+1.5 124 81 124 91 parsed_1laq 1
104 ub+1 125 81 125 91 parsed_1laq 1
105 lb=2.3 126 81 126 91 parsed_1laq 1
106 nc 127 81 127 91 parsed_1laq 1
107 nc 128 81 128 91 parsed_1laq 1
108 ub+1.2 129 81 129 91 parsed_1laq 1
109 ub+1 130 81 130 91 parsed_1laq 1
110
;
ub+0.5
assign ( resid 16 and name H5 )( resid 16 and name H2'' ) 3.04 0.77 0.76 ! OFF
;
132 81 133 93 parsed_1laq 1
111 ub+1 134 81 134 91 parsed_1laq 1
112 ub+1 135 81 135 91 parsed_1laq 1
113 nc 136 81 136 91 parsed_1laq 1
114 ub+0.5 137 81 137 91 parsed_1laq 1
115 nc 138 81 138 91 parsed_1laq 1
116 ub+1 139 81 139 91 parsed_1laq 1
117 ub+1 140 81 140 91 parsed_1laq 1
118 ub+0.3 141 81 141 91 parsed_1laq 1
119 ub+1.5 142 81 142 91 parsed_1laq 1
120 ub+1 143 81 143 91 parsed_1laq 1
121 ub=5.1 144 81 144 91 parsed_1laq 1
122 ub+1 145 81 145 91 parsed_1laq 1
123 lb=2.3 146 81 146 91 parsed_1laq 1
124 gen 147 81 147 91 parsed_1laq 1
125 nc 148 81 148 91 parsed_1laq 1
126 ub+1 149 81 149 91 parsed_1laq 1
127 ub+0.5 150 81 150 91 parsed_1laq 1
128 lb=2.3 151 81 151 91 parsed_1laq 1
129 gen 152 81 152 91 parsed_1laq 1
130 nc 153 81 153 91 parsed_1laq 1
131 ub+1 154 81 154 91 parsed_1laq 1
132 ub+1 155 81 155 91 parsed_1laq 1
133 nc 157 81 157 91 parsed_1laq 1
134 ub+1 158 81 158 91 parsed_1laq 1
135 ub+0.3 159 81 159 91 parsed_1laq 1
136 ub+4.75 160 81 160 91 parsed_1laq 1
137
;
gen
assign ( resid 19 and name H2'' )( resid 20 and name H5' ) 3.17 0.67 0.67 ! OFF
;
161 81 162 93 parsed_1laq 1
138 nc 163 81 163 91 parsed_1laq 1
139 gen 164 81 164 91 parsed_1laq 1
140 ub+0.5 165 81 165 91 parsed_1laq 1
141 ub+1 166 81 166 91 parsed_1laq 1
142 ub+0.5 167 81 167 91 parsed_1laq 1
143 ub+1.5 168 81 168 91 parsed_1laq 1
144 ub+1 169 81 169 91 parsed_1laq 1
145 ub+1 170 81 170 91 parsed_1laq 1
146
;
ub+1.5
assign ( resid 20 and name H2'' )( resid 21 and name H5'' ) 3.02 0.67 0.67 ! OFF
;
171 81 172 93 parsed_1laq 1
147 gen 173 81 173 91 parsed_1laq 1
148 ub+1 174 81 174 91 parsed_1laq 1
149 nc 175 81 175 91 parsed_1laq 1
150 ub+0.5 176 81 176 91 parsed_1laq 1
151 ub+1 177 81 177 91 parsed_1laq 1
152 nc 179 81 179 91 parsed_1laq 1
153 ub+1.5 181 81 181 91 parsed_1laq 1
154 ub+1 182 81 182 91 parsed_1laq 1
155 ub+0.5 183 81 183 91 parsed_1laq 1
156 ub+1 184 81 184 91 parsed_1laq 1
157 ub+1.5 185 81 185 91 parsed_1laq 1
158 ub+1 186 81 186 91 parsed_1laq 1
159 ub+0.5 187 81 187 91 parsed_1laq 1
160 gen 188 81 188 91 parsed_1laq 1
161 ub+1.5 189 81 189 91 parsed_1laq 1
162 nc 191 81 191 91 parsed_1laq 1
163 ub+0.5 192 81 192 91 parsed_1laq 1
164 nc 193 81 193 91 parsed_1laq 1
165 nc 194 81 194 91 parsed_1laq 1
166 nc 195 81 195 91 parsed_1laq 1
167 ub+0.5 196 81 196 91 parsed_1laq 1
168 gen 197 81 197 91 parsed_1laq 1
169 ub+1 198 81 198 91 parsed_1laq 1
170 ub+0.3 199 81 199 91 parsed_1laq 1
171 ub+1.5 200 81 200 91 parsed_1laq 1
172 ub+1 201 81 201 91 parsed_1laq 1
173 ub=5 202 81 202 91 parsed_1laq 1
174 ub+0.5 203 81 203 91 parsed_1laq 1
175 ub+0.3 204 81 204 91 parsed_1laq 1
176 ub+0.5 205 81 205 91 parsed_1laq 1
177 ub+1 206 81 206 91 parsed_1laq 1
178 ub+0.5 207 81 207 91 parsed_1laq 1
179 nc 208 81 208 91 parsed_1laq 1
180 ub+1 209 81 209 91 parsed_1laq 1
181 nc 210 81 210 91 parsed_1laq 1
182 nc 211 81 211 91 parsed_1laq 1
183 ub+1 212 81 212 91 parsed_1laq 1
184 ub=6 213 81 213 91 parsed_1laq 1
185 lb=2.3 214 81 214 91 parsed_1laq 1
186 ub+1 215 81 215 91 parsed_1laq 1
187 ub+1 216 81 216 91 parsed_1laq 1
188 ub+1 218 81 218 91 parsed_1laq 1
189 nc 219 81 219 91 parsed_1laq 1
stop_
save_
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