NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
640098 |
6rrl   |
34401 | cing | 2-parsed | STAR | entry | full | 252 |
data_6rrl_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6rrl
_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_6rrl 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6rrl
_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 6rrl "Master copy" parsed_6rrl
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6rrl
_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 6rrl.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6rrl 1
1 6rrl.mr . . DYANA/DIANA 2 distance NOE simple 236 parsed_6rrl 1
1 6rrl.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 16 parsed_6rrl 1
1 6rrl.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6rrl 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_6rrl
_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 ANTIMICROBIAL PROTEIN 20-MAY-19 6RRL
*TITLE SOLUTION NMR STRUCTURE OF THE PEPTIDE 3967 FROM MEDICINAL LEECH HIRUDO
*TITLE 2 MEDICINALIS IN DODECYLPHOSPHOCHOLINE MICELLES
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: PEPTIDE 3967;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: HIRUDO MEDICINALIS;
*SOURCE 4 ORGANISM_TAXID: 6421
*KEYWDS ANTIMICROBIAL PEPTIDES, MEDICINAL LEECH, HIRUDO MEDICINALIS, GENOME,
*KEYWDS 2 PREDICTION ALGORITHM, DOOECYLPHOSPHOCHOLINE MICELLES, ANTIMICROBIAL
*KEYWDS 3 PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR K.D.NADEZHDIN,E.N.GRAFSKAIA,A.S.ARSENIEV,V.N.LAZAREV
*REVDAT 1 24-JUL-19 6RRL 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6rrl
_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_6rrl 1
2 1 . . . parsed_6rrl 1
3 1 . . . parsed_6rrl 1
4 1 . . . parsed_6rrl 1
5 1 . . . parsed_6rrl 1
6 1 . . . parsed_6rrl 1
7 1 . . . parsed_6rrl 1
8 1 . . . parsed_6rrl 1
9 1 . . . parsed_6rrl 1
10 1 . . . parsed_6rrl 1
11 1 . . . parsed_6rrl 1
12 1 . . . parsed_6rrl 1
13 1 . . . parsed_6rrl 1
14 1 . . . parsed_6rrl 1
15 1 . . . parsed_6rrl 1
16 1 . . . parsed_6rrl 1
17 1 . . . parsed_6rrl 1
18 1 . . . parsed_6rrl 1
19 1 . . . parsed_6rrl 1
20 1 . . . parsed_6rrl 1
21 1 . . . parsed_6rrl 1
22 1 . . . parsed_6rrl 1
23 1 . . . parsed_6rrl 1
24 1 . . . parsed_6rrl 1
25 1 . . . parsed_6rrl 1
26 1 . . . parsed_6rrl 1
27 1 . . . parsed_6rrl 1
28 1 . . . parsed_6rrl 1
29 1 . . . parsed_6rrl 1
30 1 . . . parsed_6rrl 1
31 1 . . . parsed_6rrl 1
32 1 . . . parsed_6rrl 1
33 1 . . . parsed_6rrl 1
34 1 . . . parsed_6rrl 1
35 1 . . . parsed_6rrl 1
36 1 . . . parsed_6rrl 1
37 1 . . . parsed_6rrl 1
38 1 . . . parsed_6rrl 1
39 1 . . . parsed_6rrl 1
40 1 . . . parsed_6rrl 1
41 1 . . . parsed_6rrl 1
42 1 . . . parsed_6rrl 1
43 1 . . . parsed_6rrl 1
44 1 . . . parsed_6rrl 1
45 1 . . . parsed_6rrl 1
46 1 . . . parsed_6rrl 1
47 1 . . . parsed_6rrl 1
48 1 . . . parsed_6rrl 1
49 1 . . . parsed_6rrl 1
50 1 . . . parsed_6rrl 1
51 1 . . . parsed_6rrl 1
52 1 . . . parsed_6rrl 1
53 1 . . . parsed_6rrl 1
54 1 . . . parsed_6rrl 1
55 1 . . . parsed_6rrl 1
56 1 . . . parsed_6rrl 1
57 1 . . . parsed_6rrl 1
58 1 . . . parsed_6rrl 1
59 1 . . . parsed_6rrl 1
60 1 . . . parsed_6rrl 1
61 1 . . . parsed_6rrl 1
62 1 . . . parsed_6rrl 1
63 1 . . . parsed_6rrl 1
64 1 . . . parsed_6rrl 1
65 1 . . . parsed_6rrl 1
66 1 . . . parsed_6rrl 1
67 1 . . . parsed_6rrl 1
68 1 . . . parsed_6rrl 1
69 1 . . . parsed_6rrl 1
70 1 . . . parsed_6rrl 1
71 1 . . . parsed_6rrl 1
72 1 . . . parsed_6rrl 1
73 1 . . . parsed_6rrl 1
74 1 . . . parsed_6rrl 1
75 1 . . . parsed_6rrl 1
76 1 . . . parsed_6rrl 1
77 1 . . . parsed_6rrl 1
78 1 . . . parsed_6rrl 1
79 1 . . . parsed_6rrl 1
80 1 . . . parsed_6rrl 1
81 1 . . . parsed_6rrl 1
82 1 . . . parsed_6rrl 1
83 1 . . . parsed_6rrl 1
84 1 . . . parsed_6rrl 1
85 1 . . . parsed_6rrl 1
86 1 . . . parsed_6rrl 1
87 1 . . . parsed_6rrl 1
88 1 . . . parsed_6rrl 1
89 1 . . . parsed_6rrl 1
90 1 . . . parsed_6rrl 1
91 1 . . . parsed_6rrl 1
92 1 . . . parsed_6rrl 1
93 1 . . . parsed_6rrl 1
94 1 . . . parsed_6rrl 1
95 1 . . . parsed_6rrl 1
96 1 . . . parsed_6rrl 1
97 1 . . . parsed_6rrl 1
98 1 . . . parsed_6rrl 1
99 1 . . . parsed_6rrl 1
100 1 . . . parsed_6rrl 1
101 1 . . . parsed_6rrl 1
102 1 . . . parsed_6rrl 1
103 1 . . . parsed_6rrl 1
104 1 . . . parsed_6rrl 1
105 1 . . . parsed_6rrl 1
106 1 . . . parsed_6rrl 1
107 1 . . . parsed_6rrl 1
108 1 . . . parsed_6rrl 1
109 1 . . . parsed_6rrl 1
110 1 . . . parsed_6rrl 1
111 1 . . . parsed_6rrl 1
112 1 . . . parsed_6rrl 1
113 1 . . . parsed_6rrl 1
114 1 . . . parsed_6rrl 1
115 1 . . . parsed_6rrl 1
116 1 . . . parsed_6rrl 1
117 1 . . . parsed_6rrl 1
118 1 . . . parsed_6rrl 1
119 1 . . . parsed_6rrl 1
120 1 . . . parsed_6rrl 1
121 1 . . . parsed_6rrl 1
122 1 . . . parsed_6rrl 1
123 1 . . . parsed_6rrl 1
124 1 . . . parsed_6rrl 1
125 1 . . . parsed_6rrl 1
126 1 . . . parsed_6rrl 1
127 1 . . . parsed_6rrl 1
128 1 . . . parsed_6rrl 1
129 1 . . . parsed_6rrl 1
130 1 . . . parsed_6rrl 1
131 1 . . . parsed_6rrl 1
132 1 . . . parsed_6rrl 1
133 1 . . . parsed_6rrl 1
134 1 . . . parsed_6rrl 1
135 1 . . . parsed_6rrl 1
136 1 . . . parsed_6rrl 1
137 1 . . . parsed_6rrl 1
138 1 . . . parsed_6rrl 1
139 1 . . . parsed_6rrl 1
140 1 . . . parsed_6rrl 1
141 1 . . . parsed_6rrl 1
142 1 . . . parsed_6rrl 1
143 1 . . . parsed_6rrl 1
144 1 . . . parsed_6rrl 1
145 1 . . . parsed_6rrl 1
146 1 . . . parsed_6rrl 1
147 1 . . . parsed_6rrl 1
148 1 . . . parsed_6rrl 1
149 1 . . . parsed_6rrl 1
150 1 . . . parsed_6rrl 1
151 1 . . . parsed_6rrl 1
152 1 . . . parsed_6rrl 1
153 1 . . . parsed_6rrl 1
154 1 . . . parsed_6rrl 1
155 1 . . . parsed_6rrl 1
156 1 . . . parsed_6rrl 1
157 1 . . . parsed_6rrl 1
158 1 . . . parsed_6rrl 1
159 1 . . . parsed_6rrl 1
160 1 . . . parsed_6rrl 1
161 1 . . . parsed_6rrl 1
162 1 . . . parsed_6rrl 1
163 1 . . . parsed_6rrl 1
164 1 . . . parsed_6rrl 1
165 1 . . . parsed_6rrl 1
166 1 . . . parsed_6rrl 1
167 1 . . . parsed_6rrl 1
168 1 . . . parsed_6rrl 1
169 1 . . . parsed_6rrl 1
170 1 . . . parsed_6rrl 1
171 1 . . . parsed_6rrl 1
172 1 . . . parsed_6rrl 1
173 1 . . . parsed_6rrl 1
174 1 . . . parsed_6rrl 1
175 1 . . . parsed_6rrl 1
176 1 . . . parsed_6rrl 1
177 1 . . . parsed_6rrl 1
178 1 . . . parsed_6rrl 1
179 1 . . . parsed_6rrl 1
180 1 . . . parsed_6rrl 1
181 1 . . . parsed_6rrl 1
182 1 . . . parsed_6rrl 1
183 1 . . . parsed_6rrl 1
184 1 . . . parsed_6rrl 1
185 1 . . . parsed_6rrl 1
186 1 . . . parsed_6rrl 1
187 1 . . . parsed_6rrl 1
188 1 . . . parsed_6rrl 1
189 1 . . . parsed_6rrl 1
190 1 . . . parsed_6rrl 1
191 1 . . . parsed_6rrl 1
192 1 . . . parsed_6rrl 1
193 1 . . . parsed_6rrl 1
194 1 . . . parsed_6rrl 1
195 1 . . . parsed_6rrl 1
196 1 . . . parsed_6rrl 1
197 1 . . . parsed_6rrl 1
198 1 . . . parsed_6rrl 1
199 1 . . . parsed_6rrl 1
200 1 . . . parsed_6rrl 1
201 1 . . . parsed_6rrl 1
202 1 . . . parsed_6rrl 1
203 1 . . . parsed_6rrl 1
204 1 . . . parsed_6rrl 1
205 1 . . . parsed_6rrl 1
206 1 . . . parsed_6rrl 1
207 1 . . . parsed_6rrl 1
208 1 . . . parsed_6rrl 1
209 1 . . . parsed_6rrl 1
210 1 . . . parsed_6rrl 1
211 1 . . . parsed_6rrl 1
212 1 . . . parsed_6rrl 1
213 1 . . . parsed_6rrl 1
214 1 . . . parsed_6rrl 1
215 1 . . . parsed_6rrl 1
216 1 . . . parsed_6rrl 1
217 1 . . . parsed_6rrl 1
218 1 . . . parsed_6rrl 1
219 1 . . . parsed_6rrl 1
220 1 . . . parsed_6rrl 1
221 1 . . . parsed_6rrl 1
222 1 . . . parsed_6rrl 1
223 1 . . . parsed_6rrl 1
224 1 . . . parsed_6rrl 1
225 1 . . . parsed_6rrl 1
226 1 . . . parsed_6rrl 1
227 1 . . . parsed_6rrl 1
228 1 . . . parsed_6rrl 1
229 1 . . . parsed_6rrl 1
230 1 . . . parsed_6rrl 1
231 1 . . . parsed_6rrl 1
232 1 . . . parsed_6rrl 1
233 1 . . . parsed_6rrl 1
234 1 . . . parsed_6rrl 1
235 1 . . . parsed_6rrl 1
236 1 . . . parsed_6rrl 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 . . . . . . . . . 3 ILE HG13 parsed_6rrl 1
1 1 2 . . . . . . . . . 4 MET H parsed_6rrl 1
2 1 1 . . . . . . . . . 3 ILE HG12 parsed_6rrl 1
2 1 2 . . . . . . . . . 4 MET H parsed_6rrl 1
3 1 1 . . . . . . . . . 3 ILE HA parsed_6rrl 1
3 1 2 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
4 1 1 . . . . . . . . . 8 ARG QB parsed_6rrl 1
4 1 2 . . . . . . . . . 8 ARG QD parsed_6rrl 1
5 1 1 . . . . . . . . . 2 ARG HA parsed_6rrl 1
5 1 2 . . . . . . . . . 2 ARG QD parsed_6rrl 1
6 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
6 1 2 . . . . . . . . . 11 LYS QG parsed_6rrl 1
7 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
7 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
8 1 1 . . . . . . . . . 9 VAL HA parsed_6rrl 1
8 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
9 1 1 . . . . . . . . . 10 LEU HB3 parsed_6rrl 1
9 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
10 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
10 1 2 . . . . . . . . . 11 LYS QB parsed_6rrl 1
11 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
11 1 2 . . . . . . . . . 11 LYS HD3 parsed_6rrl 1
12 1 1 . . . . . . . . . 10 LEU HA parsed_6rrl 1
12 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
13 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
13 1 2 . . . . . . . . . 11 LYS HD2 parsed_6rrl 1
14 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
14 1 2 . . . . . . . . . 11 LYS QZ parsed_6rrl 1
15 1 1 . . . . . . . . . 10 LEU HG parsed_6rrl 1
15 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
16 1 1 . . . . . . . . . 6 ILE HA parsed_6rrl 1
16 1 2 . . . . . . . . . 9 VAL QG2 parsed_6rrl 1
17 1 1 . . . . . . . . . 9 VAL HA parsed_6rrl 1
17 1 2 . . . . . . . . . 9 VAL QG2 parsed_6rrl 1
18 1 1 . . . . . . . . . 4 MET HG3 parsed_6rrl 1
18 1 2 . . . . . . . . . 4 MET QE parsed_6rrl 1
19 1 1 . . . . . . . . . 4 MET HG2 parsed_6rrl 1
19 1 2 . . . . . . . . . 4 MET QE parsed_6rrl 1
20 1 1 . . . . . . . . . 4 MET HA parsed_6rrl 1
20 1 2 . . . . . . . . . 4 MET QE parsed_6rrl 1
21 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
21 1 2 . . . . . . . . . 4 MET QE parsed_6rrl 1
22 1 1 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
22 1 2 . . . . . . . . . 4 MET HG3 parsed_6rrl 1
23 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
23 1 2 . . . . . . . . . 4 MET HG3 parsed_6rrl 1
24 1 1 . . . . . . . . . 6 ILE HA parsed_6rrl 1
24 1 2 . . . . . . . . . 6 ILE QG2 parsed_6rrl 1
25 1 1 . . . . . . . . . 6 ILE QG2 parsed_6rrl 1
25 1 2 . . . . . . . . . 6 ILE HG13 parsed_6rrl 1
26 1 1 . . . . . . . . . 4 MET HB3 parsed_6rrl 1
26 1 2 . . . . . . . . . 4 MET QE parsed_6rrl 1
27 1 1 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
27 1 2 . . . . . . . . . 3 ILE HG12 parsed_6rrl 1
28 1 1 . . . . . . . . . 2 ARG HG3 parsed_6rrl 1
28 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
29 1 1 . . . . . . . . . 2 ARG HA parsed_6rrl 1
29 1 2 . . . . . . . . . 2 ARG HG3 parsed_6rrl 1
30 1 1 . . . . . . . . . 9 VAL QG2 parsed_6rrl 1
30 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
31 1 1 . . . . . . . . . 6 ILE QG2 parsed_6rrl 1
31 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
32 1 1 . . . . . . . . . 8 ARG HA parsed_6rrl 1
32 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
33 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
33 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
34 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
34 1 2 . . . . . . . . . 10 LEU HB3 parsed_6rrl 1
35 1 1 . . . . . . . . . 9 VAL QG1 parsed_6rrl 1
35 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
36 1 1 . . . . . . . . . 9 VAL HB parsed_6rrl 1
36 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
37 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
37 1 2 . . . . . . . . . 10 LEU HB2 parsed_6rrl 1
38 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
38 1 2 . . . . . . . . . 10 LEU HG parsed_6rrl 1
39 1 1 . . . . . . . . . 2 ARG HB3 parsed_6rrl 1
39 1 2 . . . . . . . . . 2 ARG HE parsed_6rrl 1
40 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
40 1 2 . . . . . . . . . 10 LEU QD2 parsed_6rrl 1
41 1 1 . . . . . . . . . 10 LEU HB3 parsed_6rrl 1
41 1 2 . . . . . . . . . 10 LEU QD2 parsed_6rrl 1
42 1 1 . . . . . . . . . 10 LEU HA parsed_6rrl 1
42 1 2 . . . . . . . . . 10 LEU QD2 parsed_6rrl 1
43 1 1 . . . . . . . . . 10 LEU HB2 parsed_6rrl 1
43 1 2 . . . . . . . . . 10 LEU QD2 parsed_6rrl 1
44 1 1 . . . . . . . . . 4 MET HA parsed_6rrl 1
44 1 2 . . . . . . . . . 7 LEU HB2 parsed_6rrl 1
45 1 1 . . . . . . . . . 1 PHE QD parsed_6rrl 1
45 1 2 . . . . . . . . . 3 ILE HA parsed_6rrl 1
46 1 1 . . . . . . . . . 1 PHE QD parsed_6rrl 1
46 1 2 . . . . . . . . . 3 ILE HG12 parsed_6rrl 1
47 1 1 . . . . . . . . . 1 PHE QD parsed_6rrl 1
47 1 2 . . . . . . . . . 6 ILE HG13 parsed_6rrl 1
48 1 1 . . . . . . . . . 1 PHE QD parsed_6rrl 1
48 1 2 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
49 1 1 . . . . . . . . . 1 PHE HA parsed_6rrl 1
49 1 2 . . . . . . . . . 1 PHE QD parsed_6rrl 1
50 1 1 . . . . . . . . . 1 PHE QD parsed_6rrl 1
50 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
51 1 1 . . . . . . . . . 1 PHE QD parsed_6rrl 1
51 1 2 . . . . . . . . . 3 ILE HB parsed_6rrl 1
52 1 1 . . . . . . . . . 5 ARG HA parsed_6rrl 1
52 1 2 . . . . . . . . . 5 ARG HG3 parsed_6rrl 1
53 1 1 . . . . . . . . . 7 LEU HB2 parsed_6rrl 1
53 1 2 . . . . . . . . . 7 LEU HG parsed_6rrl 1
54 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
54 1 2 . . . . . . . . . 7 LEU HG parsed_6rrl 1
55 1 1 . . . . . . . . . 8 ARG HA parsed_6rrl 1
55 1 2 . . . . . . . . . 8 ARG HG2 parsed_6rrl 1
56 1 1 . . . . . . . . . 2 ARG HB2 parsed_6rrl 1
56 1 2 . . . . . . . . . 5 ARG HA parsed_6rrl 1
57 1 1 . . . . . . . . . 2 ARG HB2 parsed_6rrl 1
57 1 2 . . . . . . . . . 2 ARG HE parsed_6rrl 1
58 1 1 . . . . . . . . . 3 ILE HA parsed_6rrl 1
58 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
59 1 1 . . . . . . . . . 6 ILE H parsed_6rrl 1
59 1 2 . . . . . . . . . 6 ILE QG2 parsed_6rrl 1
60 1 1 . . . . . . . . . 6 ILE H parsed_6rrl 1
60 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
61 1 1 . . . . . . . . . 6 ILE H parsed_6rrl 1
61 1 2 . . . . . . . . . 6 ILE HG13 parsed_6rrl 1
62 1 1 . . . . . . . . . 4 MET HA parsed_6rrl 1
62 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
63 1 1 . . . . . . . . . 6 ILE H parsed_6rrl 1
63 1 2 . . . . . . . . . 6 ILE HB parsed_6rrl 1
64 1 1 . . . . . . . . . 6 ILE H parsed_6rrl 1
64 1 2 . . . . . . . . . 6 ILE HG12 parsed_6rrl 1
65 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
65 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
66 1 1 . . . . . . . . . 7 LEU H parsed_6rrl 1
66 1 2 . . . . . . . . . 7 LEU HB2 parsed_6rrl 1
67 1 1 . . . . . . . . . 7 LEU H parsed_6rrl 1
67 1 2 . . . . . . . . . 7 LEU HG parsed_6rrl 1
68 1 1 . . . . . . . . . 7 LEU H parsed_6rrl 1
68 1 2 . . . . . . . . . 7 LEU HB3 parsed_6rrl 1
69 1 1 . . . . . . . . . 4 MET HA parsed_6rrl 1
69 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
70 1 1 . . . . . . . . . 6 ILE HB parsed_6rrl 1
70 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
71 1 1 . . . . . . . . . 7 LEU H parsed_6rrl 1
71 1 2 . . . . . . . . . 7 LEU QD2 parsed_6rrl 1
72 1 1 . . . . . . . . . 7 LEU H parsed_6rrl 1
72 1 2 . . . . . . . . . 7 LEU QD1 parsed_6rrl 1
73 1 1 . . . . . . . . . 12 LEU H parsed_6rrl 1
73 1 2 . . . . . . . . . 12 LEU HB3 parsed_6rrl 1
74 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
74 1 2 . . . . . . . . . 12 LEU H parsed_6rrl 1
75 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
75 1 2 . . . . . . . . . 12 LEU H parsed_6rrl 1
76 1 1 . . . . . . . . . 12 LEU H parsed_6rrl 1
76 1 2 . . . . . . . . . 12 LEU HB2 parsed_6rrl 1
77 1 1 . . . . . . . . . 11 LYS QB parsed_6rrl 1
77 1 2 . . . . . . . . . 12 LEU H parsed_6rrl 1
78 1 1 . . . . . . . . . 12 LEU H parsed_6rrl 1
78 1 2 . . . . . . . . . 12 LEU HG parsed_6rrl 1
79 1 1 . . . . . . . . . 11 LYS HA parsed_6rrl 1
79 1 2 . . . . . . . . . 12 LEU H parsed_6rrl 1
80 1 1 . . . . . . . . . 12 LEU H parsed_6rrl 1
80 1 2 . . . . . . . . . 12 LEU QD1 parsed_6rrl 1
81 1 1 . . . . . . . . . 1 PHE QE parsed_6rrl 1
81 1 2 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
82 1 1 . . . . . . . . . 1 PHE QE parsed_6rrl 1
82 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
83 1 1 . . . . . . . . . 12 LEU HB2 parsed_6rrl 1
83 1 2 . . . . . . . . . 12 LEU QD1 parsed_6rrl 1
84 1 1 . . . . . . . . . 7 LEU HB3 parsed_6rrl 1
84 1 2 . . . . . . . . . 7 LEU QD2 parsed_6rrl 1
85 1 1 . . . . . . . . . 5 ARG HA parsed_6rrl 1
85 1 2 . . . . . . . . . 5 ARG HE parsed_6rrl 1
86 1 1 . . . . . . . . . 5 ARG QB parsed_6rrl 1
86 1 2 . . . . . . . . . 5 ARG HE parsed_6rrl 1
87 1 1 . . . . . . . . . 11 LYS H parsed_6rrl 1
87 1 2 . . . . . . . . . 11 LYS QE parsed_6rrl 1
88 1 1 . . . . . . . . . 2 ARG H parsed_6rrl 1
88 1 2 . . . . . . . . . 2 ARG QD parsed_6rrl 1
89 1 1 . . . . . . . . . 2 ARG H parsed_6rrl 1
89 1 2 . . . . . . . . . 2 ARG HG3 parsed_6rrl 1
90 1 1 . . . . . . . . . 2 ARG H parsed_6rrl 1
90 1 2 . . . . . . . . . 2 ARG HE parsed_6rrl 1
91 1 1 . . . . . . . . . 2 ARG H parsed_6rrl 1
91 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
92 1 1 . . . . . . . . . 2 ARG H parsed_6rrl 1
92 1 2 . . . . . . . . . 2 ARG HG2 parsed_6rrl 1
93 1 1 . . . . . . . . . 1 PHE QB parsed_6rrl 1
93 1 2 . . . . . . . . . 2 ARG H parsed_6rrl 1
94 1 1 . . . . . . . . . 9 VAL HA parsed_6rrl 1
94 1 2 . . . . . . . . . 9 VAL QG1 parsed_6rrl 1
95 1 1 . . . . . . . . . 11 LYS QB parsed_6rrl 1
95 1 2 . . . . . . . . . 11 LYS QE parsed_6rrl 1
96 1 1 . . . . . . . . . 3 ILE HA parsed_6rrl 1
96 1 2 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
97 1 1 . . . . . . . . . 4 MET HB2 parsed_6rrl 1
97 1 2 . . . . . . . . . 4 MET QE parsed_6rrl 1
98 1 1 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
98 1 2 . . . . . . . . . 4 MET HG2 parsed_6rrl 1
99 1 1 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
99 1 2 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
100 1 1 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
100 1 2 . . . . . . . . . 3 ILE HG13 parsed_6rrl 1
101 1 1 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
101 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
102 1 1 . . . . . . . . . 3 ILE H parsed_6rrl 1
102 1 2 . . . . . . . . . 3 ILE HG12 parsed_6rrl 1
103 1 1 . . . . . . . . . 2 ARG HB2 parsed_6rrl 1
103 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
104 1 1 . . . . . . . . . 3 ILE H parsed_6rrl 1
104 1 2 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
105 1 1 . . . . . . . . . 3 ILE H parsed_6rrl 1
105 1 2 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
106 1 1 . . . . . . . . . 2 ARG HG2 parsed_6rrl 1
106 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
107 1 1 . . . . . . . . . 2 ARG HA parsed_6rrl 1
107 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
108 1 1 . . . . . . . . . 3 ILE H parsed_6rrl 1
108 1 2 . . . . . . . . . 3 ILE HG13 parsed_6rrl 1
109 1 1 . . . . . . . . . 3 ILE H parsed_6rrl 1
109 1 2 . . . . . . . . . 3 ILE HB parsed_6rrl 1
110 1 1 . . . . . . . . . 2 ARG HB2 parsed_6rrl 1
110 1 2 . . . . . . . . . 2 ARG HG2 parsed_6rrl 1
111 1 1 . . . . . . . . . 11 LYS QB parsed_6rrl 1
111 1 2 . . . . . . . . . 11 LYS HD3 parsed_6rrl 1
112 1 1 . . . . . . . . . 11 LYS HA parsed_6rrl 1
112 1 2 . . . . . . . . . 11 LYS HD3 parsed_6rrl 1
113 1 1 . . . . . . . . . 5 ARG QB parsed_6rrl 1
113 1 2 . . . . . . . . . 5 ARG HD2 parsed_6rrl 1
114 1 1 . . . . . . . . . 2 ARG HB3 parsed_6rrl 1
114 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
115 1 1 . . . . . . . . . 12 LEU HB3 parsed_6rrl 1
115 1 2 . . . . . . . . . 12 LEU QD2 parsed_6rrl 1
116 1 1 . . . . . . . . . 12 LEU HA parsed_6rrl 1
116 1 2 . . . . . . . . . 12 LEU QD2 parsed_6rrl 1
117 1 1 . . . . . . . . . 12 LEU H parsed_6rrl 1
117 1 2 . . . . . . . . . 12 LEU QD2 parsed_6rrl 1
118 1 1 . . . . . . . . . 12 LEU HB2 parsed_6rrl 1
118 1 2 . . . . . . . . . 12 LEU QD2 parsed_6rrl 1
119 1 1 . . . . . . . . . 5 ARG HA parsed_6rrl 1
119 1 2 . . . . . . . . . 5 ARG HG2 parsed_6rrl 1
120 1 1 . . . . . . . . . 1 PHE HA parsed_6rrl 1
120 1 2 . . . . . . . . . 1 PHE QE parsed_6rrl 1
121 1 1 . . . . . . . . . 8 ARG H parsed_6rrl 1
121 1 2 . . . . . . . . . 8 ARG QB parsed_6rrl 1
122 1 1 . . . . . . . . . 5 ARG HA parsed_6rrl 1
122 1 2 . . . . . . . . . 8 ARG H parsed_6rrl 1
123 1 1 . . . . . . . . . 8 ARG H parsed_6rrl 1
123 1 2 . . . . . . . . . 8 ARG HG2 parsed_6rrl 1
124 1 1 . . . . . . . . . 8 ARG H parsed_6rrl 1
124 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
125 1 1 . . . . . . . . . 8 ARG H parsed_6rrl 1
125 1 2 . . . . . . . . . 8 ARG HG3 parsed_6rrl 1
126 1 1 . . . . . . . . . 8 ARG H parsed_6rrl 1
126 1 2 . . . . . . . . . 8 ARG HE parsed_6rrl 1
127 1 1 . . . . . . . . . 8 ARG H parsed_6rrl 1
127 1 2 . . . . . . . . . 8 ARG QD parsed_6rrl 1
128 1 1 . . . . . . . . . 2 ARG HA parsed_6rrl 1
128 1 2 . . . . . . . . . 2 ARG HE parsed_6rrl 1
129 1 1 . . . . . . . . . 12 LEU HA parsed_6rrl 1
129 1 2 . . . . . . . . . 12 LEU HG parsed_6rrl 1
130 1 1 . . . . . . . . . 12 LEU HB2 parsed_6rrl 1
130 1 2 . . . . . . . . . 12 LEU HG parsed_6rrl 1
131 1 1 . . . . . . . . . 8 ARG QB parsed_6rrl 1
131 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
132 1 1 . . . . . . . . . 9 VAL H parsed_6rrl 1
132 1 2 . . . . . . . . . 9 VAL QG2 parsed_6rrl 1
133 1 1 . . . . . . . . . 9 VAL H parsed_6rrl 1
133 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
134 1 1 . . . . . . . . . 8 ARG HG2 parsed_6rrl 1
134 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
135 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
135 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
136 1 1 . . . . . . . . . 9 VAL H parsed_6rrl 1
136 1 2 . . . . . . . . . 9 VAL QG1 parsed_6rrl 1
137 1 1 . . . . . . . . . 9 VAL H parsed_6rrl 1
137 1 2 . . . . . . . . . 9 VAL HB parsed_6rrl 1
138 1 1 . . . . . . . . . 7 LEU QD2 parsed_6rrl 1
138 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
139 1 1 . . . . . . . . . 8 ARG HG3 parsed_6rrl 1
139 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
140 1 1 . . . . . . . . . 11 LYS HA parsed_6rrl 1
140 1 2 . . . . . . . . . 11 LYS QE parsed_6rrl 1
141 1 1 . . . . . . . . . 6 ILE QG2 parsed_6rrl 1
141 1 2 . . . . . . . . . 6 ILE HG12 parsed_6rrl 1
142 1 1 . . . . . . . . . 11 LYS HA parsed_6rrl 1
142 1 2 . . . . . . . . . 11 LYS HD2 parsed_6rrl 1
143 1 1 . . . . . . . . . 6 ILE HA parsed_6rrl 1
143 1 2 . . . . . . . . . 9 VAL HB parsed_6rrl 1
144 1 1 . . . . . . . . . 1 PHE QB parsed_6rrl 1
144 1 2 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
145 1 1 . . . . . . . . . 7 LEU HB2 parsed_6rrl 1
145 1 2 . . . . . . . . . 7 LEU QD2 parsed_6rrl 1
146 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
146 1 2 . . . . . . . . . 7 LEU QD2 parsed_6rrl 1
147 1 1 . . . . . . . . . 3 ILE HA parsed_6rrl 1
147 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
148 1 1 . . . . . . . . . 6 ILE HA parsed_6rrl 1
148 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
149 1 1 . . . . . . . . . 6 ILE QG2 parsed_6rrl 1
149 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
150 1 1 . . . . . . . . . 6 ILE H parsed_6rrl 1
150 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
151 1 1 . . . . . . . . . 6 ILE HB parsed_6rrl 1
151 1 2 . . . . . . . . . 6 ILE QD1 parsed_6rrl 1
152 1 1 . . . . . . . . . 8 ARG HA parsed_6rrl 1
152 1 2 . . . . . . . . . 8 ARG HG3 parsed_6rrl 1
153 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
153 1 2 . . . . . . . . . 10 LEU HB2 parsed_6rrl 1
154 1 1 . . . . . . . . . 3 ILE HB parsed_6rrl 1
154 1 2 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
155 1 1 . . . . . . . . . 3 ILE HA parsed_6rrl 1
155 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
156 1 1 . . . . . . . . . 4 MET HG3 parsed_6rrl 1
156 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
157 1 1 . . . . . . . . . 4 MET HB3 parsed_6rrl 1
157 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
158 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
158 1 2 . . . . . . . . . 5 ARG HG3 parsed_6rrl 1
159 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
159 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
160 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
160 1 2 . . . . . . . . . 5 ARG HE parsed_6rrl 1
161 1 1 . . . . . . . . . 4 MET HG2 parsed_6rrl 1
161 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
162 1 1 . . . . . . . . . 4 MET HB2 parsed_6rrl 1
162 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
163 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
163 1 2 . . . . . . . . . 5 ARG QB parsed_6rrl 1
164 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
164 1 2 . . . . . . . . . 5 ARG HG2 parsed_6rrl 1
165 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
165 1 2 . . . . . . . . . 5 ARG HD3 parsed_6rrl 1
166 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
166 1 2 . . . . . . . . . 4 MET HB3 parsed_6rrl 1
167 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
167 1 2 . . . . . . . . . 4 MET HG2 parsed_6rrl 1
168 1 1 . . . . . . . . . 3 ILE QD1 parsed_6rrl 1
168 1 2 . . . . . . . . . 4 MET H parsed_6rrl 1
169 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
169 1 2 . . . . . . . . . 4 MET HB2 parsed_6rrl 1
170 1 1 . . . . . . . . . 3 ILE QG2 parsed_6rrl 1
170 1 2 . . . . . . . . . 4 MET H parsed_6rrl 1
171 1 1 . . . . . . . . . 3 ILE HB parsed_6rrl 1
171 1 2 . . . . . . . . . 4 MET H parsed_6rrl 1
172 1 1 . . . . . . . . . 4 MET H parsed_6rrl 1
172 1 2 . . . . . . . . . 5 ARG H parsed_6rrl 1
173 1 1 . . . . . . . . . 10 LEU H parsed_6rrl 1
173 1 2 . . . . . . . . . 10 LEU QD1 parsed_6rrl 1
174 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
174 1 2 . . . . . . . . . 10 LEU QD1 parsed_6rrl 1
175 1 1 . . . . . . . . . 10 LEU HB3 parsed_6rrl 1
175 1 2 . . . . . . . . . 10 LEU QD1 parsed_6rrl 1
176 1 1 . . . . . . . . . 10 LEU HA parsed_6rrl 1
176 1 2 . . . . . . . . . 10 LEU QD1 parsed_6rrl 1
177 1 1 . . . . . . . . . 10 LEU HB2 parsed_6rrl 1
177 1 2 . . . . . . . . . 10 LEU QD1 parsed_6rrl 1
178 1 1 . . . . . . . . . 8 ARG QB parsed_6rrl 1
178 1 2 . . . . . . . . . 8 ARG HE parsed_6rrl 1
179 1 1 . . . . . . . . . 8 ARG HA parsed_6rrl 1
179 1 2 . . . . . . . . . 8 ARG HE parsed_6rrl 1
180 1 1 . . . . . . . . . 11 LYS QG parsed_6rrl 1
180 1 2 . . . . . . . . . 11 LYS QZ parsed_6rrl 1
181 1 1 . . . . . . . . . 11 LYS QB parsed_6rrl 1
181 1 2 . . . . . . . . . 11 LYS QZ parsed_6rrl 1
182 1 1 . . . . . . . . . 11 LYS HA parsed_6rrl 1
182 1 2 . . . . . . . . . 11 LYS QZ parsed_6rrl 1
183 1 1 . . . . . . . . . 7 LEU HB2 parsed_6rrl 1
183 1 2 . . . . . . . . . 7 LEU QD1 parsed_6rrl 1
184 1 1 . . . . . . . . . 7 LEU HA parsed_6rrl 1
184 1 2 . . . . . . . . . 7 LEU QD1 parsed_6rrl 1
185 1 1 . . . . . . . . . 7 LEU HB3 parsed_6rrl 1
185 1 2 . . . . . . . . . 7 LEU QD1 parsed_6rrl 1
186 1 1 . . . . . . . . . 4 MET HA parsed_6rrl 1
186 1 2 . . . . . . . . . 7 LEU QD1 parsed_6rrl 1
187 1 1 . . . . . . . . . 5 ARG HA parsed_6rrl 1
187 1 2 . . . . . . . . . 5 ARG HD2 parsed_6rrl 1
188 1 1 . . . . . . . . . 5 ARG H parsed_6rrl 1
188 1 2 . . . . . . . . . 5 ARG HD2 parsed_6rrl 1
189 1 1 . . . . . . . . . 5 ARG HA parsed_6rrl 1
189 1 2 . . . . . . . . . 5 ARG HD3 parsed_6rrl 1
190 1 1 . . . . . . . . . 5 ARG QB parsed_6rrl 1
190 1 2 . . . . . . . . . 5 ARG HD3 parsed_6rrl 1
191 1 1 . . . . . . . . . 8 ARG HA parsed_6rrl 1
191 1 2 . . . . . . . . . 8 ARG QD parsed_6rrl 1
192 1 1 . . . . . . . . . 12 LEU HB3 parsed_6rrl 1
192 1 2 . . . . . . . . . 12 LEU QD1 parsed_6rrl 1
193 1 1 . . . . . . . . . 12 LEU HA parsed_6rrl 1
193 1 2 . . . . . . . . . 12 LEU QD1 parsed_6rrl 1
194 1 1 . . . . . . . . . 10 LEU HA parsed_6rrl 1
194 1 2 . . . . . . . . . 10 LEU HG parsed_6rrl 1
195 1 1 . . . . . . . . . 1 PHE O parsed_6rrl 1
195 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
196 1 1 . . . . . . . . . 1 PHE C parsed_6rrl 1
196 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
197 1 1 . . . . . . . . . 1 PHE O parsed_6rrl 1
197 1 2 . . . . . . . . . 3 ILE N parsed_6rrl 1
198 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
198 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
199 1 1 . . . . . . . . . 3 ILE C parsed_6rrl 1
199 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
200 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
200 1 2 . . . . . . . . . 6 ILE N parsed_6rrl 1
201 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
201 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
202 1 1 . . . . . . . . . 3 ILE C parsed_6rrl 1
202 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
203 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
203 1 2 . . . . . . . . . 7 LEU N parsed_6rrl 1
204 1 1 . . . . . . . . . 6 ILE O parsed_6rrl 1
204 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
205 1 1 . . . . . . . . . 6 ILE C parsed_6rrl 1
205 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
206 1 1 . . . . . . . . . 6 ILE O parsed_6rrl 1
206 1 2 . . . . . . . . . 9 VAL N parsed_6rrl 1
207 1 1 . . . . . . . . . 4 MET O parsed_6rrl 1
207 1 2 . . . . . . . . . 8 ARG H parsed_6rrl 1
208 1 1 . . . . . . . . . 4 MET C parsed_6rrl 1
208 1 2 . . . . . . . . . 8 ARG H parsed_6rrl 1
209 1 1 . . . . . . . . . 4 MET O parsed_6rrl 1
209 1 2 . . . . . . . . . 8 ARG N parsed_6rrl 1
210 1 1 . . . . . . . . . 7 LEU O parsed_6rrl 1
210 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
211 1 1 . . . . . . . . . 7 LEU C parsed_6rrl 1
211 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
212 1 1 . . . . . . . . . 7 LEU O parsed_6rrl 1
212 1 2 . . . . . . . . . 10 LEU N parsed_6rrl 1
213 1 1 . . . . . . . . . 8 ARG O parsed_6rrl 1
213 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
214 1 1 . . . . . . . . . 8 ARG C parsed_6rrl 1
214 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
215 1 1 . . . . . . . . . 8 ARG O parsed_6rrl 1
215 1 2 . . . . . . . . . 11 LYS N parsed_6rrl 1
216 1 1 . . . . . . . . . 1 PHE O parsed_6rrl 1
216 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
217 1 1 . . . . . . . . . 1 PHE C parsed_6rrl 1
217 1 2 . . . . . . . . . 3 ILE H parsed_6rrl 1
218 1 1 . . . . . . . . . 1 PHE O parsed_6rrl 1
218 1 2 . . . . . . . . . 3 ILE N parsed_6rrl 1
219 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
219 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
220 1 1 . . . . . . . . . 3 ILE C parsed_6rrl 1
220 1 2 . . . . . . . . . 6 ILE H parsed_6rrl 1
221 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
221 1 2 . . . . . . . . . 6 ILE N parsed_6rrl 1
222 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
222 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
223 1 1 . . . . . . . . . 3 ILE C parsed_6rrl 1
223 1 2 . . . . . . . . . 7 LEU H parsed_6rrl 1
224 1 1 . . . . . . . . . 3 ILE O parsed_6rrl 1
224 1 2 . . . . . . . . . 7 LEU N parsed_6rrl 1
225 1 1 . . . . . . . . . 6 ILE O parsed_6rrl 1
225 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
226 1 1 . . . . . . . . . 6 ILE C parsed_6rrl 1
226 1 2 . . . . . . . . . 9 VAL H parsed_6rrl 1
227 1 1 . . . . . . . . . 6 ILE O parsed_6rrl 1
227 1 2 . . . . . . . . . 9 VAL N parsed_6rrl 1
228 1 1 . . . . . . . . . 4 MET O parsed_6rrl 1
228 1 2 . . . . . . . . . 8 ARG H parsed_6rrl 1
229 1 1 . . . . . . . . . 4 MET C parsed_6rrl 1
229 1 2 . . . . . . . . . 8 ARG H parsed_6rrl 1
230 1 1 . . . . . . . . . 4 MET O parsed_6rrl 1
230 1 2 . . . . . . . . . 8 ARG N parsed_6rrl 1
231 1 1 . . . . . . . . . 7 LEU O parsed_6rrl 1
231 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
232 1 1 . . . . . . . . . 7 LEU C parsed_6rrl 1
232 1 2 . . . . . . . . . 10 LEU H parsed_6rrl 1
233 1 1 . . . . . . . . . 7 LEU O parsed_6rrl 1
233 1 2 . . . . . . . . . 10 LEU N parsed_6rrl 1
234 1 1 . . . . . . . . . 8 ARG O parsed_6rrl 1
234 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
235 1 1 . . . . . . . . . 8 ARG C parsed_6rrl 1
235 1 2 . . . . . . . . . 11 LYS H parsed_6rrl 1
236 1 1 . . . . . . . . . 8 ARG O parsed_6rrl 1
236 1 2 . . . . . . . . . 11 LYS N parsed_6rrl 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
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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
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156 "peak 630 #plist 1" 156 39 156 56 parsed_6rrl 1
157 "peak 632 #plist 1" 157 39 157 56 parsed_6rrl 1
158 "peak 633 #plist 1" 158 39 158 56 parsed_6rrl 1
159 "peak 634 #plist 1" 159 39 159 56 parsed_6rrl 1
160 "peak 635 #plist 1" 160 39 160 56 parsed_6rrl 1
161 "peak 636 #plist 1" 161 39 161 56 parsed_6rrl 1
162 "peak 637 #plist 1" 162 39 162 56 parsed_6rrl 1
163 "peak 638 #plist 1" 163 39 163 56 parsed_6rrl 1
164 "peak 641 #plist 1" 164 39 164 56 parsed_6rrl 1
165 "peak 642 #plist 1" 165 39 165 56 parsed_6rrl 1
166 "peak 646 #plist 1" 166 39 166 56 parsed_6rrl 1
167 "peak 650 #plist 1" 167 39 167 56 parsed_6rrl 1
168 "peak 652 #plist 1" 168 39 168 56 parsed_6rrl 1
169 "peak 653 #plist 1" 169 39 169 56 parsed_6rrl 1
170 "peak 654 #plist 1" 170 39 170 56 parsed_6rrl 1
171 "peak 655 #plist 1" 171 39 171 56 parsed_6rrl 1
172 "peak 657 #plist 1" 172 39 172 56 parsed_6rrl 1
173 "peak 658 #plist 1" 173 39 173 56 parsed_6rrl 1
174 "peak 660 #plist 1" 174 39 174 56 parsed_6rrl 1
175 "peak 662 #plist 1" 175 39 175 56 parsed_6rrl 1
176 "peak 663 #plist 1" 176 39 176 56 parsed_6rrl 1
177 "peak 664 #plist 1" 177 39 177 56 parsed_6rrl 1
178 "peak 665 #plist 1" 178 39 178 56 parsed_6rrl 1
179 "peak 668 #plist 1" 179 39 179 56 parsed_6rrl 1
180 "peak 669 #plist 1" 180 39 180 56 parsed_6rrl 1
181 "peak 676 #plist 1" 181 39 181 56 parsed_6rrl 1
182 "peak 678 #plist 1" 182 39 182 56 parsed_6rrl 1
183 "peak 680 #plist 1" 183 39 183 56 parsed_6rrl 1
184 "peak 683 #plist 1" 184 39 184 56 parsed_6rrl 1
185 "peak 685 #plist 1" 185 39 185 56 parsed_6rrl 1
186 "peak 687 #plist 1" 186 39 186 56 parsed_6rrl 1
187 "peak 688 #plist 1" 187 39 187 56 parsed_6rrl 1
188 "peak 691 #plist 1" 188 39 188 56 parsed_6rrl 1
189 "peak 696 #plist 1" 189 39 189 56 parsed_6rrl 1
190 "peak 699 #plist 1" 190 39 190 56 parsed_6rrl 1
191 "peak 702 #plist 1" 191 39 191 56 parsed_6rrl 1
192 "peak 708 #plist 1" 192 39 192 56 parsed_6rrl 1
193 "peak 714 #plist 1" 193 39 193 56 parsed_6rrl 1
194 "peak 715 #plist 1" 194 39 194 56 parsed_6rrl 1
195 "peak 725 #plist 1" 195 39 195 56 parsed_6rrl 1
196 "Restraints file 2: chi.aco" 196 1 196 28 parsed_6rrl 1
197 "Restraints file 4: hbond.upl" 231 1 231 30 parsed_6rrl 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
;
6 ILE CHI1 -90 -30
;
198 1 199 1 parsed_6rrl 1
2 "7 LEU CHI1 -90 -30" 200 1 200 19 parsed_6rrl 1
3
;
7 LEU CHI2 150 210
;
201 1 202 1 parsed_6rrl 1
4
;
9 VAL CHI1 150 210
#10 LEU CHI1 -90 -30
#10 LEU CHI2 150 210
;
203 1 206 20 parsed_6rrl 1
5
;
3 ILE CHI1 -90 -30
#6 ILE CHI12 150 210# Restraints file 3: hbond.lol
;
208 1 209 51 parsed_6rrl 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6rrl
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_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 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -107.6 -67.6 . . 2 ARG . . . . . . . . . . . . . parsed_6rrl 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 62.5 145.4 . . 2 ARG . . . . . . . . . . . . . parsed_6rrl 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.7 -34.7 . . 3 ILE . . . . . . . . . . . . . parsed_6rrl 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.8 -2.8 . . 3 ILE . . . . . . . . . . . . . parsed_6rrl 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.0 -47.0 . . 4 MET . . . . . . . . . . . . . parsed_6rrl 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.8 -13.8 . . 4 MET . . . . . . . . . . . . . parsed_6rrl 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.5 -49.5 . . 5 ARG . . . . . . . . . . . . . parsed_6rrl 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.8 -14.8 . . 5 ARG . . . . . . . . . . . . . parsed_6rrl 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.7 -47.7 . . 6 ILE . . . . . . . . . . . . . parsed_6rrl 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.8 -19.8 . . 6 ILE . . . . . . . . . . . . . parsed_6rrl 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.6 -47.6 . . 7 LEU . . . . . . . . . . . . . parsed_6rrl 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.9 -16.9 . . 7 LEU . . . . . . . . . . . . . parsed_6rrl 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.7 -46.7 . . 8 ARG . . . . . . . . . . . . . parsed_6rrl 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.7 -9.7 . . 8 ARG . . . . . . . . . . . . . parsed_6rrl 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.8 -57.8 . . 9 VAL . . . . . . . . . . . . . parsed_6rrl 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.1 2.4 . . 9 VAL . . . . . . . . . . . . . parsed_6rrl 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 "Restraints file 5: talos.aco" 1 1 1 30 parsed_6rrl 1
2 "2 R -87.618 103.933 9.144 20.730 1.264 0.664 25 11 Strong" 3 1 3 72 parsed_6rrl 1
3 "3 I -64.684 -32.807 5.580 7.189 0.934 0.691 10 12 Generous" 7 1 7 74 parsed_6rrl 1
4 "4 M -66.978 -33.761 5.133 5.561 0.721 0.713 25 12 Strong" 11 1 11 72 parsed_6rrl 1
5 "5 R -69.529 -34.811 4.592 5.566 0.503 0.750 25 12 Strong" 15 1 15 72 parsed_6rrl 1
6 "6 I -67.703 -39.752 4.462 5.933 0.392 0.768 25 12 Strong" 19 1 19 72 parsed_6rrl 1
7 "7 L -67.629 -36.900 4.253 5.201 0.398 0.765 25 12 Strong" 23 1 23 72 parsed_6rrl 1
8 "8 R -66.735 -29.669 4.933 8.255 0.403 0.729 25 12 Strong" 27 1 27 72 parsed_6rrl 1
9 "9 V -77.783 -19.303 7.788 10.874 0.531 0.699 25 12 Strong" 31 1 31 72 parsed_6rrl 1
10 "11 K -84.020 103.107 9.815 20.688 1.100 0.633 25 12 Strong" 35 1 35 72 parsed_6rrl 1
11 "11 LYS PHI -104.0 -64.0" 36 1 36 34 parsed_6rrl 1
12 "11 LYS PSI 61.7 144.5" 37 1 37 34 parsed_6rrl 1
stop_
save_
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