NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
618613 |
5w54   |
30306 | cing | 2-parsed | STAR | entry | full | 224 |
data_5w54_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5w54
_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_5w54 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5w54
_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 5w54 "Master copy" parsed_5w54
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5w54
_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 5w54.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5w54 1
1 5w54.mr . . XPLOR/CNS 2 distance NOE simple 194 parsed_5w54 1
1 5w54.mr . . XPLOR/CNS 3 distance "general distance" simple 2 parsed_5w54 1
1 5w54.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 8 parsed_5w54 1
1 5w54.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 20 parsed_5w54 1
1 5w54.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5w54 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_5w54
_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 CYTOKINE 14-JUN-17 5W54
*TITLE CYTOKINE-LIKE STRESS RESPONSE PEPTIDE-2 IN MANDUCA SEXTA
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: STRESS RESPONSE PEPTIDE-2;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: MANDUCA SEXTA;
*SOURCE 4 ORGANISM_TAXID: 7130
*KEYWDS ANTI-PARALLEL BETA-STRANDS, DISULFIDE DISORDERED, CYTOKINE
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR L.G.SCHRAG,A.I.HERRERA,O.PRAKASH
*REVDAT 1 12-JUL-17 5W54 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5w54
_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_5w54 1
2 1 . . . parsed_5w54 1
3 1 . . . parsed_5w54 1
4 1 . . . parsed_5w54 1
5 1 . . . parsed_5w54 1
6 1 . . . parsed_5w54 1
7 1 . . . parsed_5w54 1
8 1 . . . parsed_5w54 1
9 1 . . . parsed_5w54 1
10 1 . . . parsed_5w54 1
11 1 . . . parsed_5w54 1
12 1 . . . parsed_5w54 1
13 1 . . . parsed_5w54 1
14 1 . . . parsed_5w54 1
15 1 . . . parsed_5w54 1
16 1 . . . parsed_5w54 1
17 1 . . . parsed_5w54 1
18 1 . . . parsed_5w54 1
19 1 . . . parsed_5w54 1
20 1 . . . parsed_5w54 1
21 1 . . . parsed_5w54 1
22 1 . . . parsed_5w54 1
23 1 . . . parsed_5w54 1
24 1 . . . parsed_5w54 1
25 1 . . . parsed_5w54 1
26 1 . . . parsed_5w54 1
27 1 . . . parsed_5w54 1
28 1 . . . parsed_5w54 1
29 1 . . . parsed_5w54 1
30 1 . . . parsed_5w54 1
31 1 . . . parsed_5w54 1
32 1 . . . parsed_5w54 1
33 1 . . . parsed_5w54 1
34 1 . . . parsed_5w54 1
35 1 . . . parsed_5w54 1
36 1 . . . parsed_5w54 1
37 1 . . . parsed_5w54 1
38 1 . . . parsed_5w54 1
39 1 . . . parsed_5w54 1
40 1 . . . parsed_5w54 1
41 1 . . . parsed_5w54 1
42 1 . . . parsed_5w54 1
43 1 . . . parsed_5w54 1
44 1 . . . parsed_5w54 1
45 1 . . . parsed_5w54 1
46 1 . . . parsed_5w54 1
47 1 . . . parsed_5w54 1
48 1 . . . parsed_5w54 1
49 1 . . . parsed_5w54 1
50 1 . . . parsed_5w54 1
51 1 . . . parsed_5w54 1
52 1 . . . parsed_5w54 1
53 1 . . . parsed_5w54 1
54 1 . . . parsed_5w54 1
55 1 . . . parsed_5w54 1
56 1 . . . parsed_5w54 1
57 1 . . . parsed_5w54 1
58 1 . . . parsed_5w54 1
59 1 . . . parsed_5w54 1
60 1 . . . parsed_5w54 1
61 1 . . . parsed_5w54 1
62 1 . . . parsed_5w54 1
63 1 . . . parsed_5w54 1
64 1 . . . parsed_5w54 1
65 1 . . . parsed_5w54 1
66 1 . . . parsed_5w54 1
67 1 . . . parsed_5w54 1
68 1 . . . parsed_5w54 1
69 1 . . . parsed_5w54 1
70 1 . . . parsed_5w54 1
71 1 . . . parsed_5w54 1
72 1 . . . parsed_5w54 1
73 1 . . . parsed_5w54 1
74 1 . . . parsed_5w54 1
75 1 . . . parsed_5w54 1
76 1 . . . parsed_5w54 1
77 1 . . . parsed_5w54 1
78 1 . . . parsed_5w54 1
79 1 . . . parsed_5w54 1
80 1 . . . parsed_5w54 1
81 1 . . . parsed_5w54 1
82 1 . . . parsed_5w54 1
83 1 . . . parsed_5w54 1
84 1 . . . parsed_5w54 1
85 1 . . . parsed_5w54 1
86 1 . . . parsed_5w54 1
87 1 . . . parsed_5w54 1
88 1 . . . parsed_5w54 1
89 1 . . . parsed_5w54 1
90 1 . . . parsed_5w54 1
91 1 . . . parsed_5w54 1
92 1 . . . parsed_5w54 1
93 1 . . . parsed_5w54 1
94 1 . . . parsed_5w54 1
95 1 . . . parsed_5w54 1
96 1 . . . parsed_5w54 1
97 1 . . . parsed_5w54 1
98 1 . . . parsed_5w54 1
99 1 . . . parsed_5w54 1
100 1 . . . parsed_5w54 1
101 1 . . . parsed_5w54 1
102 1 . . . parsed_5w54 1
103 1 . . . parsed_5w54 1
104 1 . . . parsed_5w54 1
105 1 . . . parsed_5w54 1
106 1 . . . parsed_5w54 1
107 1 . . . parsed_5w54 1
108 1 . . . parsed_5w54 1
109 1 . . . parsed_5w54 1
110 1 . . . parsed_5w54 1
111 1 . . . parsed_5w54 1
112 1 . . . parsed_5w54 1
113 1 . . . parsed_5w54 1
114 1 . . . parsed_5w54 1
115 1 . . . parsed_5w54 1
116 1 . . . parsed_5w54 1
117 1 . . . parsed_5w54 1
118 1 . . . parsed_5w54 1
119 1 . . . parsed_5w54 1
120 1 . . . parsed_5w54 1
121 1 . . . parsed_5w54 1
122 1 . . . parsed_5w54 1
123 1 . . . parsed_5w54 1
124 1 . . . parsed_5w54 1
125 1 . . . parsed_5w54 1
126 1 . . . parsed_5w54 1
127 1 . . . parsed_5w54 1
128 1 . . . parsed_5w54 1
129 1 . . . parsed_5w54 1
130 1 . . . parsed_5w54 1
131 1 . . . parsed_5w54 1
132 1 . . . parsed_5w54 1
133 1 . . . parsed_5w54 1
134 1 . . . parsed_5w54 1
135 1 . . . parsed_5w54 1
136 1 . . . parsed_5w54 1
137 1 . . . parsed_5w54 1
138 1 . . . parsed_5w54 1
139 1 . . . parsed_5w54 1
140 1 . . . parsed_5w54 1
141 1 . . . parsed_5w54 1
142 1 . . . parsed_5w54 1
143 1 . . . parsed_5w54 1
144 1 . . . parsed_5w54 1
145 1 . . . parsed_5w54 1
146 1 . . . parsed_5w54 1
147 1 . . . parsed_5w54 1
148 1 . . . parsed_5w54 1
149 1 . . . parsed_5w54 1
150 1 . . . parsed_5w54 1
151 1 . . . parsed_5w54 1
152 1 . . . parsed_5w54 1
153 1 . . . parsed_5w54 1
154 1 . . . parsed_5w54 1
155 1 . . . parsed_5w54 1
156 1 . . . parsed_5w54 1
157 1 . . . parsed_5w54 1
158 1 . . . parsed_5w54 1
159 1 . . . parsed_5w54 1
160 1 . . . parsed_5w54 1
161 1 . . . parsed_5w54 1
162 1 . . . parsed_5w54 1
163 1 . . . parsed_5w54 1
164 1 . . . parsed_5w54 1
165 1 . . . parsed_5w54 1
166 1 . . . parsed_5w54 1
167 1 . . . parsed_5w54 1
168 1 . . . parsed_5w54 1
169 1 . . . parsed_5w54 1
170 1 . . . parsed_5w54 1
171 1 . . . parsed_5w54 1
172 1 . . . parsed_5w54 1
173 1 . . . parsed_5w54 1
174 1 . . . parsed_5w54 1
175 1 . . . parsed_5w54 1
176 1 . . . parsed_5w54 1
177 1 . . . parsed_5w54 1
178 1 . . . parsed_5w54 1
179 1 . . . parsed_5w54 1
180 1 . . . parsed_5w54 1
181 1 . . . parsed_5w54 1
182 1 . . . parsed_5w54 1
183 1 . . . parsed_5w54 1
184 1 . . . parsed_5w54 1
185 1 . . . parsed_5w54 1
186 1 . . . parsed_5w54 1
187 1 . . . parsed_5w54 1
188 1 . . . parsed_5w54 1
189 1 . . . parsed_5w54 1
190 1 . . . parsed_5w54 1
191 1 . . . parsed_5w54 1
192 1 . . . parsed_5w54 1
193 1 . . . parsed_5w54 1
194 1 . . . parsed_5w54 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 . . . . . . . . . 2 . HN parsed_5w54 1
1 1 2 . . . . . . . . . 2 . HA# parsed_5w54 1
2 1 1 . . . . . . . . . 3 . HN parsed_5w54 1
2 1 2 . . . . . . . . . 3 . HA parsed_5w54 1
3 1 1 . . . . . . . . . 3 . HN parsed_5w54 1
3 1 2 . . . . . . . . . 3 . HG## parsed_5w54 1
4 1 1 . . . . . . . . . 4 . HN parsed_5w54 1
4 1 2 . . . . . . . . . 4 . HA parsed_5w54 1
5 1 1 . . . . . . . . . 4 . HN parsed_5w54 1
5 1 2 . . . . . . . . . 4 . HB1 parsed_5w54 1
6 1 1 . . . . . . . . . 4 . HN parsed_5w54 1
6 1 2 . . . . . . . . . 4 . HB2 parsed_5w54 1
7 1 1 . . . . . . . . . 5 . HN parsed_5w54 1
7 1 2 . . . . . . . . . 5 . HA parsed_5w54 1
8 1 1 . . . . . . . . . 5 . HN parsed_5w54 1
8 1 2 . . . . . . . . . 5 . HB1 parsed_5w54 1
9 1 1 . . . . . . . . . 5 . HN parsed_5w54 1
9 1 2 . . . . . . . . . 5 . HB1 parsed_5w54 1
10 1 1 . . . . . . . . . 6 . HN parsed_5w54 1
10 1 2 . . . . . . . . . 6 . HA1 parsed_5w54 1
11 1 1 . . . . . . . . . 6 . HN parsed_5w54 1
11 1 2 . . . . . . . . . 6 . HA2 parsed_5w54 1
12 1 1 . . . . . . . . . 7 . HN parsed_5w54 1
12 1 2 . . . . . . . . . 7 . HA parsed_5w54 1
13 1 1 . . . . . . . . . 7 . HN parsed_5w54 1
13 1 2 . . . . . . . . . 7 . HB1 parsed_5w54 1
14 1 1 . . . . . . . . . 7 . HN parsed_5w54 1
14 1 2 . . . . . . . . . 7 . HB2 parsed_5w54 1
15 1 1 . . . . . . . . . 7 . HN parsed_5w54 1
15 1 2 . . . . . . . . . 7 . HD# parsed_5w54 1
16 1 1 . . . . . . . . . 7 . HN parsed_5w54 1
16 1 2 . . . . . . . . . 7 . HG# parsed_5w54 1
17 1 1 . . . . . . . . . 8 . HN parsed_5w54 1
17 1 2 . . . . . . . . . 8 . HA parsed_5w54 1
18 1 1 . . . . . . . . . 8 . HN parsed_5w54 1
18 1 2 . . . . . . . . . 8 . HB1 parsed_5w54 1
19 1 1 . . . . . . . . . 8 . HN parsed_5w54 1
19 1 2 . . . . . . . . . 8 . HB2 parsed_5w54 1
20 1 1 . . . . . . . . . 9 . HA parsed_5w54 1
20 1 2 . . . . . . . . . 9 . HB1 parsed_5w54 1
21 1 1 . . . . . . . . . 9 . HA parsed_5w54 1
21 1 2 . . . . . . . . . 9 . HB2 parsed_5w54 1
22 1 1 . . . . . . . . . 9 . HA parsed_5w54 1
22 1 2 . . . . . . . . . 9 . HG1 parsed_5w54 1
23 1 1 . . . . . . . . . 9 . HB1 parsed_5w54 1
23 1 2 . . . . . . . . . 9 . HG1 parsed_5w54 1
24 1 1 . . . . . . . . . 9 . HB1 parsed_5w54 1
24 1 2 . . . . . . . . . 9 . HG2 parsed_5w54 1
25 1 1 . . . . . . . . . 9 . HB2 parsed_5w54 1
25 1 2 . . . . . . . . . 9 . HG1 parsed_5w54 1
26 1 1 . . . . . . . . . 9 . HB2 parsed_5w54 1
26 1 2 . . . . . . . . . 9 . HG2 parsed_5w54 1
27 1 1 . . . . . . . . . 9 . HG1 parsed_5w54 1
27 1 2 . . . . . . . . . 9 . HD1 parsed_5w54 1
28 1 1 . . . . . . . . . 9 . HG1 parsed_5w54 1
28 1 2 . . . . . . . . . 9 . HD2 parsed_5w54 1
29 1 1 . . . . . . . . . 9 . HG2 parsed_5w54 1
29 1 2 . . . . . . . . . 9 . HD1 parsed_5w54 1
30 1 1 . . . . . . . . . 9 . HG2 parsed_5w54 1
30 1 2 . . . . . . . . . 9 . HD2 parsed_5w54 1
31 1 1 . . . . . . . . . 9 . HB1 parsed_5w54 1
31 1 2 . . . . . . . . . 9 . HD1 parsed_5w54 1
32 1 1 . . . . . . . . . 9 . HB1 parsed_5w54 1
32 1 2 . . . . . . . . . 9 . HD2 parsed_5w54 1
33 1 1 . . . . . . . . . 9 . HB2 parsed_5w54 1
33 1 2 . . . . . . . . . 9 . HD1 parsed_5w54 1
34 1 1 . . . . . . . . . 9 . HB2 parsed_5w54 1
34 1 2 . . . . . . . . . 9 . HD2 parsed_5w54 1
35 1 1 . . . . . . . . . 11 . HN parsed_5w54 1
35 1 2 . . . . . . . . . 11 . HA1 parsed_5w54 1
36 1 1 . . . . . . . . . 11 . HN parsed_5w54 1
36 1 2 . . . . . . . . . 11 . HA2 parsed_5w54 1
37 1 1 . . . . . . . . . 12 . HN parsed_5w54 1
37 1 2 . . . . . . . . . 12 . HA parsed_5w54 1
38 1 1 . . . . . . . . . 12 . HN parsed_5w54 1
38 1 2 . . . . . . . . . 12 . HB# parsed_5w54 1
39 1 1 . . . . . . . . . 12 . HN parsed_5w54 1
39 1 2 . . . . . . . . . 12 . HD1 parsed_5w54 1
40 1 1 . . . . . . . . . 12 . HN parsed_5w54 1
40 1 2 . . . . . . . . . 12 . HG1 parsed_5w54 1
41 1 1 . . . . . . . . . 12 . HN parsed_5w54 1
41 1 2 . . . . . . . . . 12 . HG2 parsed_5w54 1
42 1 1 . . . . . . . . . 12 . HE parsed_5w54 1
42 1 2 . . . . . . . . . 12 . HB# parsed_5w54 1
43 1 1 . . . . . . . . . 12 . HE parsed_5w54 1
43 1 2 . . . . . . . . . 12 . HD1 parsed_5w54 1
44 1 1 . . . . . . . . . 12 . HE parsed_5w54 1
44 1 2 . . . . . . . . . 12 . HD2 parsed_5w54 1
45 1 1 . . . . . . . . . 12 . HE parsed_5w54 1
45 1 2 . . . . . . . . . 12 . HG1 parsed_5w54 1
46 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
46 1 2 . . . . . . . . . 13 . HA parsed_5w54 1
47 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
47 1 2 . . . . . . . . . 13 . HB parsed_5w54 1
48 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
48 1 2 . . . . . . . . . 14 . HB# parsed_5w54 1
49 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
49 1 2 . . . . . . . . . 14 . HD# parsed_5w54 1
50 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
50 1 2 . . . . . . . . . 14 . HE parsed_5w54 1
51 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
51 1 2 . . . . . . . . . 14 . HG1 parsed_5w54 1
52 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
52 1 2 . . . . . . . . . 14 . HG2 parsed_5w54 1
53 1 1 . . . . . . . . . 14 . HE parsed_5w54 1
53 1 2 . . . . . . . . . 14 . HB# parsed_5w54 1
54 1 1 . . . . . . . . . 14 . HE parsed_5w54 1
54 1 2 . . . . . . . . . 14 . HD# parsed_5w54 1
55 1 1 . . . . . . . . . 14 . HE parsed_5w54 1
55 1 2 . . . . . . . . . 14 . HG1 parsed_5w54 1
56 1 1 . . . . . . . . . 14 . HE parsed_5w54 1
56 1 2 . . . . . . . . . 14 . HG2 parsed_5w54 1
57 1 1 . . . . . . . . . 15 . HE parsed_5w54 1
57 1 2 . . . . . . . . . 15 . HB1 parsed_5w54 1
58 1 1 . . . . . . . . . 15 . HE parsed_5w54 1
58 1 2 . . . . . . . . . 15 . HD1 parsed_5w54 1
59 1 1 . . . . . . . . . 15 . HE parsed_5w54 1
59 1 2 . . . . . . . . . 15 . HD2 parsed_5w54 1
60 1 1 . . . . . . . . . 15 . HE parsed_5w54 1
60 1 2 . . . . . . . . . 15 . HG2 parsed_5w54 1
61 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
61 1 2 . . . . . . . . . 16 . HA parsed_5w54 1
62 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
62 1 2 . . . . . . . . . 16 . HB1 parsed_5w54 1
63 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
63 1 2 . . . . . . . . . 16 . HB2 parsed_5w54 1
64 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
64 1 2 . . . . . . . . . 16 . HD1# parsed_5w54 1
65 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
65 1 2 . . . . . . . . . 16 . HG parsed_5w54 1
66 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
66 1 2 . . . . . . . . . 17 . HA1 parsed_5w54 1
67 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
67 1 2 . . . . . . . . . 17 . HA2 parsed_5w54 1
68 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
68 1 2 . . . . . . . . . 18 . HB parsed_5w54 1
69 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
69 1 2 . . . . . . . . . 18 . HD1# parsed_5w54 1
70 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
70 1 2 . . . . . . . . . 18 . HG1# parsed_5w54 1
71 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
71 1 2 . . . . . . . . . 18 . HG2# parsed_5w54 1
72 1 1 . . . . . . . . . 18 . HB parsed_5w54 1
72 1 2 . . . . . . . . . 18 . HG2# parsed_5w54 1
73 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
73 1 2 . . . . . . . . . 19 . HA parsed_5w54 1
74 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
74 1 2 . . . . . . . . . 19 . HB1 parsed_5w54 1
75 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
75 1 2 . . . . . . . . . 19 . HB2 parsed_5w54 1
76 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
76 1 2 . . . . . . . . . 20 . HA parsed_5w54 1
77 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
77 1 2 . . . . . . . . . 20 . HB parsed_5w54 1
78 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
78 1 2 . . . . . . . . . 20 . HG1# parsed_5w54 1
79 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
79 1 2 . . . . . . . . . 20 . HG2# parsed_5w54 1
80 1 1 . . . . . . . . . 20 . HB parsed_5w54 1
80 1 2 . . . . . . . . . 20 . HA parsed_5w54 1
81 1 1 . . . . . . . . . 20 . HB parsed_5w54 1
81 1 2 . . . . . . . . . 20 . HG1# parsed_5w54 1
82 1 1 . . . . . . . . . 20 . HB parsed_5w54 1
82 1 2 . . . . . . . . . 20 . HG2# parsed_5w54 1
83 1 1 . . . . . . . . . 21 . HA parsed_5w54 1
83 1 2 . . . . . . . . . 21 . HB1 parsed_5w54 1
84 1 1 . . . . . . . . . 21 . HA parsed_5w54 1
84 1 2 . . . . . . . . . 21 . HB2 parsed_5w54 1
85 1 1 . . . . . . . . . 21 . HA parsed_5w54 1
85 1 2 . . . . . . . . . 21 . HG1 parsed_5w54 1
86 1 1 . . . . . . . . . 21 . HB1 parsed_5w54 1
86 1 2 . . . . . . . . . 21 . HG1 parsed_5w54 1
87 1 1 . . . . . . . . . 21 . HB1 parsed_5w54 1
87 1 2 . . . . . . . . . 21 . HG2 parsed_5w54 1
88 1 1 . . . . . . . . . 21 . HB2 parsed_5w54 1
88 1 2 . . . . . . . . . 21 . HG1 parsed_5w54 1
89 1 1 . . . . . . . . . 21 . HB2 parsed_5w54 1
89 1 2 . . . . . . . . . 21 . HG2 parsed_5w54 1
90 1 1 . . . . . . . . . 21 . HG1 parsed_5w54 1
90 1 2 . . . . . . . . . 21 . HD1 parsed_5w54 1
91 1 1 . . . . . . . . . 21 . HG1 parsed_5w54 1
91 1 2 . . . . . . . . . 21 . HD2 parsed_5w54 1
92 1 1 . . . . . . . . . 21 . HG2 parsed_5w54 1
92 1 2 . . . . . . . . . 21 . HD1 parsed_5w54 1
93 1 1 . . . . . . . . . 21 . HG2 parsed_5w54 1
93 1 2 . . . . . . . . . 21 . HD2 parsed_5w54 1
94 1 1 . . . . . . . . . 21 . HB1 parsed_5w54 1
94 1 2 . . . . . . . . . 21 . HD1 parsed_5w54 1
95 1 1 . . . . . . . . . 21 . HB1 parsed_5w54 1
95 1 2 . . . . . . . . . 21 . HD2 parsed_5w54 1
96 1 1 . . . . . . . . . 21 . HB2 parsed_5w54 1
96 1 2 . . . . . . . . . 21 . HD1 parsed_5w54 1
97 1 1 . . . . . . . . . 21 . HB2 parsed_5w54 1
97 1 2 . . . . . . . . . 21 . HD2 parsed_5w54 1
98 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
98 1 2 . . . . . . . . . 22 . HA parsed_5w54 1
99 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
99 1 2 . . . . . . . . . 22 . HB# parsed_5w54 1
100 1 1 . . . . . . . . . 23 . HN parsed_5w54 1
100 1 2 . . . . . . . . . 23 . HA parsed_5w54 1
101 1 1 . . . . . . . . . 23 . HN parsed_5w54 1
101 1 2 . . . . . . . . . 23 . HB# parsed_5w54 1
102 1 1 . . . . . . . . . 24 . HN parsed_5w54 1
102 1 2 . . . . . . . . . 24 . HA parsed_5w54 1
103 1 1 . . . . . . . . . 24 . HN parsed_5w54 1
103 1 2 . . . . . . . . . 24 . HB1 parsed_5w54 1
104 1 1 . . . . . . . . . 24 . HN parsed_5w54 1
104 1 2 . . . . . . . . . 24 . HB2 parsed_5w54 1
105 1 1 . . . . . . . . . 25 . HN parsed_5w54 1
105 1 2 . . . . . . . . . 25 . HB1 parsed_5w54 1
106 1 1 . . . . . . . . . 25 . HN parsed_5w54 1
106 1 2 . . . . . . . . . 25 . HB2 parsed_5w54 1
107 1 1 . . . . . . . . . 4 . HN parsed_5w54 1
107 1 2 . . . . . . . . . 3 . HN parsed_5w54 1
108 1 1 . . . . . . . . . 4 . HN parsed_5w54 1
108 1 2 . . . . . . . . . 3 . HG## parsed_5w54 1
109 1 1 . . . . . . . . . 4 . HN parsed_5w54 1
109 1 2 . . . . . . . . . 5 . HN parsed_5w54 1
110 1 1 . . . . . . . . . 6 . HN parsed_5w54 1
110 1 2 . . . . . . . . . 7 . HN parsed_5w54 1
111 1 1 . . . . . . . . . 7 . HN parsed_5w54 1
111 1 2 . . . . . . . . . 6 . HA1 parsed_5w54 1
112 1 1 . . . . . . . . . 8 . HN parsed_5w54 1
112 1 2 . . . . . . . . . 7 . HN parsed_5w54 1
113 1 1 . . . . . . . . . 8 . HN parsed_5w54 1
113 1 2 . . . . . . . . . 7 . HB1 parsed_5w54 1
114 1 1 . . . . . . . . . 8 . HN parsed_5w54 1
114 1 2 . . . . . . . . . 7 . HG# parsed_5w54 1
115 1 1 . . . . . . . . . 8 . HB1 parsed_5w54 1
115 1 2 . . . . . . . . . 7 . HG# parsed_5w54 1
116 1 1 . . . . . . . . . 8 . HB1 parsed_5w54 1
116 1 2 . . . . . . . . . 9 . HD1 parsed_5w54 1
117 1 1 . . . . . . . . . 8 . HB1 parsed_5w54 1
117 1 2 . . . . . . . . . 9 . HD2 parsed_5w54 1
118 1 1 . . . . . . . . . 8 . HB2 parsed_5w54 1
118 1 2 . . . . . . . . . 9 . HD1 parsed_5w54 1
119 1 1 . . . . . . . . . 8 . HB2 parsed_5w54 1
119 1 2 . . . . . . . . . 9 . HD2 parsed_5w54 1
120 1 1 . . . . . . . . . 10 . HN parsed_5w54 1
120 1 2 . . . . . . . . . 9 . HA parsed_5w54 1
121 1 1 . . . . . . . . . 10 . HN parsed_5w54 1
121 1 2 . . . . . . . . . 9 . HB# parsed_5w54 1
122 1 1 . . . . . . . . . 10 . HN parsed_5w54 1
122 1 2 . . . . . . . . . 9 . HG# parsed_5w54 1
123 1 1 . . . . . . . . . 11 . HN parsed_5w54 1
123 1 2 . . . . . . . . . 10 . HN parsed_5w54 1
124 1 1 . . . . . . . . . 11 . HN parsed_5w54 1
124 1 2 . . . . . . . . . 12 . HN parsed_5w54 1
125 1 1 . . . . . . . . . 11 . HN parsed_5w54 1
125 1 2 . . . . . . . . . 12 . HA parsed_5w54 1
126 1 1 . . . . . . . . . 12 . HN parsed_5w54 1
126 1 2 . . . . . . . . . 11 . HA2 parsed_5w54 1
127 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
127 1 2 . . . . . . . . . 12 . HA parsed_5w54 1
128 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
128 1 2 . . . . . . . . . 12 . HB# parsed_5w54 1
129 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
129 1 2 . . . . . . . . . 12 . HD2 parsed_5w54 1
130 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
130 1 2 . . . . . . . . . 12 . HG1 parsed_5w54 1
131 1 1 . . . . . . . . . 13 . HN parsed_5w54 1
131 1 2 . . . . . . . . . 12 . HG2 parsed_5w54 1
132 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
132 1 2 . . . . . . . . . 13 . HA parsed_5w54 1
133 1 1 . . . . . . . . . 14 . HN parsed_5w54 1
133 1 2 . . . . . . . . . 13 . HB parsed_5w54 1
134 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
134 1 2 . . . . . . . . . 14 . HN parsed_5w54 1
135 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
135 1 2 . . . . . . . . . 14 . HB# parsed_5w54 1
136 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
136 1 2 . . . . . . . . . 14 . HD# parsed_5w54 1
137 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
137 1 2 . . . . . . . . . 14 . HE parsed_5w54 1
138 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
138 1 2 . . . . . . . . . 14 . HG# parsed_5w54 1
139 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
139 1 2 . . . . . . . . . 15 . HA parsed_5w54 1
140 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
140 1 2 . . . . . . . . . 15 . HB1 parsed_5w54 1
141 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
141 1 2 . . . . . . . . . 15 . HB2 parsed_5w54 1
142 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
142 1 2 . . . . . . . . . 16 . HA parsed_5w54 1
143 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
143 1 2 . . . . . . . . . 16 . HB1 parsed_5w54 1
144 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
144 1 2 . . . . . . . . . 16 . HB2 parsed_5w54 1
145 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
145 1 2 . . . . . . . . . 16 . HD1# parsed_5w54 1
146 1 1 . . . . . . . . . 17 . HN parsed_5w54 1
146 1 2 . . . . . . . . . 18 . HN parsed_5w54 1
147 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
147 1 2 . . . . . . . . . 17 . HA# parsed_5w54 1
148 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
148 1 2 . . . . . . . . . 18 . HD1# parsed_5w54 1
149 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
149 1 2 . . . . . . . . . 18 . HN parsed_5w54 1
150 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
150 1 2 . . . . . . . . . 18 . HA parsed_5w54 1
151 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
151 1 2 . . . . . . . . . 18 . HB parsed_5w54 1
152 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
152 1 2 . . . . . . . . . 18 . HG1# parsed_5w54 1
153 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
153 1 2 . . . . . . . . . 18 . HG2# parsed_5w54 1
154 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
154 1 2 . . . . . . . . . 19 . HA parsed_5w54 1
155 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
155 1 2 . . . . . . . . . 19 . HB1 parsed_5w54 1
156 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
156 1 2 . . . . . . . . . 19 . HB2 parsed_5w54 1
157 1 1 . . . . . . . . . 21 . HA parsed_5w54 1
157 1 2 . . . . . . . . . 22 . HB# parsed_5w54 1
158 1 1 . . . . . . . . . 21 . HD1 parsed_5w54 1
158 1 2 . . . . . . . . . 20 . HB parsed_5w54 1
159 1 1 . . . . . . . . . 21 . HD2 parsed_5w54 1
159 1 2 . . . . . . . . . 20 . HB parsed_5w54 1
160 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
160 1 2 . . . . . . . . . 21 . HA parsed_5w54 1
161 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
161 1 2 . . . . . . . . . 21 . HB# parsed_5w54 1
162 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
162 1 2 . . . . . . . . . 23 . HN parsed_5w54 1
163 1 1 . . . . . . . . . 23 . HN parsed_5w54 1
163 1 2 . . . . . . . . . 22 . HA parsed_5w54 1
164 1 1 . . . . . . . . . 23 . HN parsed_5w54 1
164 1 2 . . . . . . . . . 22 . HB# parsed_5w54 1
165 1 1 . . . . . . . . . 23 . HN parsed_5w54 1
165 1 2 . . . . . . . . . 24 . HN parsed_5w54 1
166 1 1 . . . . . . . . . 24 . HN parsed_5w54 1
166 1 2 . . . . . . . . . 23 . HA parsed_5w54 1
167 1 1 . . . . . . . . . 24 . HN parsed_5w54 1
167 1 2 . . . . . . . . . 25 . HN parsed_5w54 1
168 1 1 . . . . . . . . . 25 . HN parsed_5w54 1
168 1 2 . . . . . . . . . 24 . HB1 parsed_5w54 1
169 1 1 . . . . . . . . . 25 . HN parsed_5w54 1
169 1 2 . . . . . . . . . 24 . HB2 parsed_5w54 1
170 1 1 . . . . . . . . . 5 . HN parsed_5w54 1
170 1 2 . . . . . . . . . 3 . HG## parsed_5w54 1
171 1 1 . . . . . . . . . 6 . HN parsed_5w54 1
171 1 2 . . . . . . . . . 3 . HG## parsed_5w54 1
172 1 1 . . . . . . . . . 8 . HB1 parsed_5w54 1
172 1 2 . . . . . . . . . 12 . HB1 parsed_5w54 1
173 1 1 . . . . . . . . . 8 . HB1 parsed_5w54 1
173 1 2 . . . . . . . . . 12 . HG1 parsed_5w54 1
174 1 1 . . . . . . . . . 8 . HB1 parsed_5w54 1
174 1 2 . . . . . . . . . 12 . HG2 parsed_5w54 1
175 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
175 1 2 . . . . . . . . . 13 . HG## parsed_5w54 1
176 1 1 . . . . . . . . . 15 . HN parsed_5w54 1
176 1 2 . . . . . . . . . 17 . HN parsed_5w54 1
177 1 1 . . . . . . . . . 16 . HN parsed_5w54 1
177 1 2 . . . . . . . . . 18 . HN parsed_5w54 1
178 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
178 1 2 . . . . . . . . . 16 . HN parsed_5w54 1
179 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
179 1 2 . . . . . . . . . 16 . HA parsed_5w54 1
180 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
180 1 2 . . . . . . . . . 16 . HB1 parsed_5w54 1
181 1 1 . . . . . . . . . 18 . HN parsed_5w54 1
181 1 2 . . . . . . . . . 20 . HG2# parsed_5w54 1
182 1 1 . . . . . . . . . 18 . HB parsed_5w54 1
182 1 2 . . . . . . . . . 20 . HG2# parsed_5w54 1
183 1 1 . . . . . . . . . 18 . HG1# parsed_5w54 1
183 1 2 . . . . . . . . . 20 . HG2# parsed_5w54 1
184 1 1 . . . . . . . . . 23 . HN parsed_5w54 1
184 1 2 . . . . . . . . . 21 . HB# parsed_5w54 1
185 1 1 . . . . . . . . . 24 . HN parsed_5w54 1
185 1 2 . . . . . . . . . 22 . HA parsed_5w54 1
186 1 1 . . . . . . . . . 19 . HN parsed_5w54 1
186 1 2 . . . . . . . . . 13 . HG## parsed_5w54 1
187 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
187 1 2 . . . . . . . . . 12 . HD1 parsed_5w54 1
188 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
188 1 2 . . . . . . . . . 12 . HG1 parsed_5w54 1
189 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
189 1 2 . . . . . . . . . 13 . HN parsed_5w54 1
190 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
190 1 2 . . . . . . . . . 14 . HA parsed_5w54 1
191 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
191 1 2 . . . . . . . . . 14 . HB# parsed_5w54 1
192 1 1 . . . . . . . . . 20 . HN parsed_5w54 1
192 1 2 . . . . . . . . . 14 . HG# parsed_5w54 1
193 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
193 1 2 . . . . . . . . . 12 . HG1 parsed_5w54 1
194 1 1 . . . . . . . . . 22 . HN parsed_5w54 1
194 1 2 . . . . . . . . . 12 . HG2 parsed_5w54 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 2.2 6.0 parsed_5w54 1
2 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
3 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
4 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
5 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
6 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
7 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
8 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
9 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
10 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
11 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
12 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
13 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
14 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
15 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
16 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
17 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
18 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
19 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
20 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
21 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
22 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
23 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
24 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
25 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
26 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
27 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
28 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
29 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
30 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
31 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
32 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
33 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
34 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
35 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
36 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
37 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
38 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
39 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
40 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
41 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
42 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
43 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
44 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
45 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
46 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
47 1 . . . . . 4.0 1.8 5.0 parsed_5w54 1
48 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
49 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
50 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
51 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
52 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
53 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
54 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
55 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
56 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
57 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
58 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
59 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
60 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
61 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
62 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
63 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
64 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
65 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
66 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
67 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
68 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
69 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
70 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
71 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
72 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
73 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
74 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
75 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
76 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
77 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
78 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
79 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
80 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
81 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
82 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
83 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
84 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
85 1 . . . . . 4.2 1.2 4.5 parsed_5w54 1
86 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
87 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
88 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
89 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
90 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
91 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
92 1 . . . . . 3.2 2.2 3.7 parsed_5w54 1
93 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
94 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
95 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
96 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
97 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
98 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
99 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
100 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
101 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
102 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
103 1 . . . . . 3.2 2.2 3.5 parsed_5w54 1
104 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
105 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
106 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
107 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
108 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
109 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
110 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
111 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
112 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
113 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
114 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
115 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
116 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
117 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
118 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
119 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
120 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
121 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
122 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
123 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
124 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
125 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
126 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
127 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
128 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
129 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
130 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
131 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
132 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
133 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
134 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
135 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
136 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
137 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
138 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
139 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
140 1 . . . . . 4.2 2.2 4.7 parsed_5w54 1
141 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
142 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
143 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
144 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
145 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
146 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
147 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
148 1 . . . . . 4.2 2.2 4.7 parsed_5w54 1
149 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
150 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
151 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
152 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
153 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
154 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
155 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
156 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
157 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
158 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
159 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
160 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
161 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
162 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
163 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
164 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
165 1 . . . . . 2.2 1.8 2.5 parsed_5w54 1
166 1 . . . . . 4.0 2.0 4.3 parsed_5w54 1
167 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
168 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
169 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
170 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
171 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
172 1 . . . . . 3.2 1.8 3.5 parsed_5w54 1
173 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
174 1 . . . . . 3.2 1.8 4.0 parsed_5w54 1
175 1 . . . . . 4.2 2.2 5.0 parsed_5w54 1
176 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
177 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
178 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
179 1 . . . . . 4.2 2.2 4.7 parsed_5w54 1
180 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
181 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
182 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
183 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
184 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
185 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
186 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
187 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
188 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
189 1 . . . . . 4.2 2.2 4.5 parsed_5w54 1
190 1 . . . . . 4.2 1.4 4.5 parsed_5w54 1
191 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
192 1 . . . . . 5.0 2.2 6.0 parsed_5w54 1
193 1 . . . . . 6.0 2.2 7.0 parsed_5w54 1
194 1 . . . . . 6.0 2.2 7.0 parsed_5w54 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 "Intra-Residue NOE Constraints 106" 2 1 2 36 parsed_5w54 1
2 "Sequential Residue NOE Constraints Total-72 Utilized-62" 137 1 137 59 parsed_5w54 1
3 "Medium Range NOE Constraints Total-41 Utilized-16" 233 1 233 52 parsed_5w54 1
4 "Long Range NOE Constraints Total-41 Utilized-9" 260 1 260 49 parsed_5w54 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 1: srp2_NOE_Constraint_WG1B9Op.tbl" 1 1 1 52 parsed_5w54 1
2 "assign (residue 16 and name HN) (residue 16 and name HD2 5.0 2.8 1.0" 82 1 82 68 parsed_5w54 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5w54
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "general distance"
_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_5w54 2
2 1 . . . parsed_5w54 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 . . . . . . . . . 8 . CB parsed_5w54 2
1 1 2 . . . . . . . . . 19 . SG parsed_5w54 2
2 1 1 . . . . . . . . . 8 . SG parsed_5w54 2
2 1 2 . . . . . . . . . 19 . SG parsed_5w54 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 3.2 2.2 3.5 parsed_5w54 2
2 1 . . . . . 2.05 2.00 2.50 parsed_5w54 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 "Disulfide Constraints" 1 1 1 24 parsed_5w54 2
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5w54
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_5w54 3
2 1 . . . parsed_5w54 3
3 1 . . . parsed_5w54 3
4 1 . . . parsed_5w54 3
5 1 . . . parsed_5w54 3
6 1 . . . parsed_5w54 3
7 1 . . . parsed_5w54 3
8 1 . . . parsed_5w54 3
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 10 . HN parsed_5w54 3
1 1 2 . . . . . . . . . 8 . O parsed_5w54 3
2 1 1 . . . . . . . . . 10 . N parsed_5w54 3
2 1 2 . . . . . . . . . 8 . O parsed_5w54 3
3 1 1 . . . . . . . . . 18 . HN parsed_5w54 3
3 1 2 . . . . . . . . . 15 . O parsed_5w54 3
4 1 1 . . . . . . . . . 18 . N parsed_5w54 3
4 1 2 . . . . . . . . . 15 . O parsed_5w54 3
5 1 1 . . . . . . . . . 15 . HN parsed_5w54 3
5 1 2 . . . . . . . . . 18 . O parsed_5w54 3
6 1 1 . . . . . . . . . 15 . N parsed_5w54 3
6 1 2 . . . . . . . . . 18 . O parsed_5w54 3
7 1 1 . . . . . . . . . 13 . HN parsed_5w54 3
7 1 2 . . . . . . . . . 20 . O parsed_5w54 3
8 1 1 . . . . . . . . . 13 . N parsed_5w54 3
8 1 2 . . . . . . . . . 20 . O parsed_5w54 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.2 1.8 2.5 parsed_5w54 3
2 1 . . . . . 3.2 2.4 3.5 parsed_5w54 3
3 1 . . . . . 2.2 1.8 2.5 parsed_5w54 3
4 1 . . . . . 3.2 2.4 3.5 parsed_5w54 3
5 1 . . . . . 3.2 2.4 4.0 parsed_5w54 3
6 1 . . . . . 4.2 2.2 4.5 parsed_5w54 3
7 1 . . . . . 4.2 2.2 4.5 parsed_5w54 3
8 1 . . . . . 5.2 2.2 5.5 parsed_5w54 3
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "Hydrogen Bond Constraints" 1 1 1 28 parsed_5w54 3
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_5w54
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_5w54 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -90.0 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_5w54 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -90.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_5w54 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -90.0 . . 13 . c . 14 . n . 14 . ca . 14 . c parsed_5w54 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -190.0 -80.0 . . 14 . c . 15 . n . 15 . ca . 15 . c parsed_5w54 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_5w54 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 120.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_5w54 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -90.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_5w54 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -90.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_5w54 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -90.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_5w54 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 9 . n . 9 . ca . 9 . c . 10 . n parsed_5w54 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 12 . n . 12 . ca . 12 . c . 13 . n parsed_5w54 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 13 . n . 13 . ca . 13 . c . 14 . n parsed_5w54 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 14 . n . 14 . ca . 14 . c . 15 . n parsed_5w54 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 15 . n . 15 . ca . 15 . c . 16 . n parsed_5w54 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 60.0 . . 16 . n . 16 . ca . 16 . c . 17 . n parsed_5w54 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 30.0 . . 17 . n . 17 . ca . 17 . c . 18 . n parsed_5w54 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 18 . n . 18 . ca . 18 . c . 19 . n parsed_5w54 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 19 . n . 19 . ca . 19 . c . 20 . n parsed_5w54 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 20 . n . 20 . ca . 20 . c . 21 . n parsed_5w54 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
;
Phi
P9
;
2 1 3 4 parsed_5w54 1
2 R12 7 1 7 5 parsed_5w54 1
3 V13 11 1 11 5 parsed_5w54 1
4 R14 15 1 15 5 parsed_5w54 1
5 R15 19 1 19 5 parsed_5w54 1
6 L16 23 1 23 5 parsed_5w54 1
7 G17 28 1 28 5 parsed_5w54 1
8 I18 34 1 34 5 parsed_5w54 1
9 C19 38 1 38 5 parsed_5w54 1
10 V20 42 1 42 5 parsed_5w54 1
11
;
Psi
P9
;
46 1 48 4 parsed_5w54 1
12 R12 52 1 52 5 parsed_5w54 1
13 V13 56 1 56 5 parsed_5w54 1
14 R14 59 1 59 5 parsed_5w54 1
15 R15 63 1 63 5 parsed_5w54 1
16 L16 67 1 67 5 parsed_5w54 1
17 G17 72 1 72 5 parsed_5w54 1
18 I18 76 1 76 5 parsed_5w54 1
19 C19 80 1 80 5 parsed_5w54 1
20 V20 84 1 84 5 parsed_5w54 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "# Restraints file 2: SRP2Dihedral_SbqKBfF.tbl" 1 1 1 45 parsed_5w54 1
stop_
save_
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