NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
563754 |
2m9e   |
19291 | cing | 2-parsed | STAR | entry | full | 256 |
data_2m9e_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2m9e
_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_2m9e 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2m9e
_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 2m9e "Master copy" parsed_2m9e
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2m9e
_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 2m9e.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m9e 1
1 2m9e.mr . . DYANA/DIANA 2 distance NOE simple 222 parsed_2m9e 1
1 2m9e.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 34 parsed_2m9e 1
1 2m9e.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m9e 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_2m9e
_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 ISOMERASE 07-JUN-13 2M9E
*TITLE NMR SOLUTION STRUCTURE OF PIN1 WW DOMAIN MUTANT 5-1
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACTING 1;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: MODIFIED WW DOMAIN (UNP RESIDUES 6-39, SEE REMARK 999);
*COMPND 5 SYNONYM: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE PIN1, PPIASE PIN1,
*COMPND 6 ROTAMASE PIN1;
*COMPND 7 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 4 ORGANISM_COMMON: HUMAN;
*SOURCE 5 ORGANISM_TAXID: 9606
*KEYWDS N-GLYCOSYLATION, ENHANCED AROMATIC SEQUON, WW DOMAIN, CH-PI
*KEYWDS 2 INTERACTION, ISOMERASE
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR S.ENCK, W.CHEN, J.L.PRICE, E.T.POWERS, C.WONG, H.J.DYSON, J.W.KELLY
*REVDAT 1 26-JUN-13 2M9E 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2m9e
_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_2m9e 1
2 1 . . . parsed_2m9e 1
3 1 . . . parsed_2m9e 1
4 1 . . . parsed_2m9e 1
5 1 . . . parsed_2m9e 1
6 1 . . . parsed_2m9e 1
7 1 . . . parsed_2m9e 1
8 1 . . . parsed_2m9e 1
9 1 . . . parsed_2m9e 1
10 1 . . . parsed_2m9e 1
11 1 . . . parsed_2m9e 1
12 1 . . . parsed_2m9e 1
13 1 . . . parsed_2m9e 1
14 1 . . . parsed_2m9e 1
15 1 . . . parsed_2m9e 1
16 1 . . . parsed_2m9e 1
17 1 . . . parsed_2m9e 1
18 1 . . . parsed_2m9e 1
19 1 . . . parsed_2m9e 1
20 1 . . . parsed_2m9e 1
21 1 . . . parsed_2m9e 1
22 1 . . . parsed_2m9e 1
23 1 . . . parsed_2m9e 1
24 1 . . . parsed_2m9e 1
25 1 . . . parsed_2m9e 1
26 1 . . . parsed_2m9e 1
27 1 . . . parsed_2m9e 1
28 1 . . . parsed_2m9e 1
29 1 . . . parsed_2m9e 1
30 1 . . . parsed_2m9e 1
31 1 . . . parsed_2m9e 1
32 1 . . . parsed_2m9e 1
33 1 . . . parsed_2m9e 1
34 1 . . . parsed_2m9e 1
35 1 . . . parsed_2m9e 1
36 1 . . . parsed_2m9e 1
37 1 . . . parsed_2m9e 1
38 1 . . . parsed_2m9e 1
39 1 . . . parsed_2m9e 1
40 1 . . . parsed_2m9e 1
41 1 . . . parsed_2m9e 1
42 1 . . . parsed_2m9e 1
43 1 . . . parsed_2m9e 1
44 1 . . . parsed_2m9e 1
45 1 . . . parsed_2m9e 1
46 1 . . . parsed_2m9e 1
47 1 . . . parsed_2m9e 1
48 1 . . . parsed_2m9e 1
49 1 . . . parsed_2m9e 1
50 1 . . . parsed_2m9e 1
51 1 . . . parsed_2m9e 1
52 1 . . . parsed_2m9e 1
53 1 . . . parsed_2m9e 1
54 1 . . . parsed_2m9e 1
55 1 . . . parsed_2m9e 1
56 1 . . . parsed_2m9e 1
57 1 . . . parsed_2m9e 1
58 1 . . . parsed_2m9e 1
59 1 . . . parsed_2m9e 1
60 1 . . . parsed_2m9e 1
61 1 . . . parsed_2m9e 1
62 1 . . . parsed_2m9e 1
63 1 . . . parsed_2m9e 1
64 1 . . . parsed_2m9e 1
65 1 . . . parsed_2m9e 1
66 1 . . . parsed_2m9e 1
67 1 . . . parsed_2m9e 1
68 1 . . . parsed_2m9e 1
69 1 . . . parsed_2m9e 1
70 1 . . . parsed_2m9e 1
71 1 . . . parsed_2m9e 1
72 1 . . . parsed_2m9e 1
73 1 . . . parsed_2m9e 1
74 1 . . . parsed_2m9e 1
75 1 . . . parsed_2m9e 1
76 1 . . . parsed_2m9e 1
77 1 . . . parsed_2m9e 1
78 1 . . . parsed_2m9e 1
79 1 . . . parsed_2m9e 1
80 1 . . . parsed_2m9e 1
81 1 . . . parsed_2m9e 1
82 1 . . . parsed_2m9e 1
83 1 . . . parsed_2m9e 1
84 1 . . . parsed_2m9e 1
85 1 . . . parsed_2m9e 1
86 1 . . . parsed_2m9e 1
87 1 . . . parsed_2m9e 1
88 1 . . . parsed_2m9e 1
89 1 . . . parsed_2m9e 1
90 1 . . . parsed_2m9e 1
91 1 . . . parsed_2m9e 1
92 1 . . . parsed_2m9e 1
93 1 . . . parsed_2m9e 1
94 1 . . . parsed_2m9e 1
95 1 . . . parsed_2m9e 1
96 1 . . . parsed_2m9e 1
97 1 . . . parsed_2m9e 1
98 1 . . . parsed_2m9e 1
99 1 . . . parsed_2m9e 1
100 1 . . . parsed_2m9e 1
101 1 . . . parsed_2m9e 1
102 1 . . . parsed_2m9e 1
103 1 . . . parsed_2m9e 1
104 1 . . . parsed_2m9e 1
105 1 . . . parsed_2m9e 1
106 1 . . . parsed_2m9e 1
107 1 . . . parsed_2m9e 1
108 1 . . . parsed_2m9e 1
109 1 . . . parsed_2m9e 1
110 1 . . . parsed_2m9e 1
111 1 . . . parsed_2m9e 1
112 1 . . . parsed_2m9e 1
113 1 . . . parsed_2m9e 1
114 1 . . . parsed_2m9e 1
115 1 . . . parsed_2m9e 1
116 1 . . . parsed_2m9e 1
117 1 . . . parsed_2m9e 1
118 1 . . . parsed_2m9e 1
119 1 . . . parsed_2m9e 1
120 1 . . . parsed_2m9e 1
121 1 . . . parsed_2m9e 1
122 1 . . . parsed_2m9e 1
123 1 . . . parsed_2m9e 1
124 1 . . . parsed_2m9e 1
125 1 . . . parsed_2m9e 1
126 1 . . . parsed_2m9e 1
127 1 . . . parsed_2m9e 1
128 1 . . . parsed_2m9e 1
129 1 . . . parsed_2m9e 1
130 1 . . . parsed_2m9e 1
131 1 . . . parsed_2m9e 1
132 1 . . . parsed_2m9e 1
133 1 . . . parsed_2m9e 1
134 1 . . . parsed_2m9e 1
135 1 . . . parsed_2m9e 1
136 1 . . . parsed_2m9e 1
137 1 . . . parsed_2m9e 1
138 1 . . . parsed_2m9e 1
139 1 . . . parsed_2m9e 1
140 1 . . . parsed_2m9e 1
141 1 . . . parsed_2m9e 1
142 1 . . . parsed_2m9e 1
143 1 . . . parsed_2m9e 1
144 1 . . . parsed_2m9e 1
145 1 . . . parsed_2m9e 1
146 1 . . . parsed_2m9e 1
147 1 . . . parsed_2m9e 1
148 1 . . . parsed_2m9e 1
149 1 . . . parsed_2m9e 1
150 1 . . . parsed_2m9e 1
151 1 . . . parsed_2m9e 1
152 1 . . . parsed_2m9e 1
153 1 . . . parsed_2m9e 1
154 1 . . . parsed_2m9e 1
155 1 . . . parsed_2m9e 1
156 1 . . . parsed_2m9e 1
157 1 . . . parsed_2m9e 1
158 1 . . . parsed_2m9e 1
159 1 . . . parsed_2m9e 1
160 1 . . . parsed_2m9e 1
161 1 . . . parsed_2m9e 1
162 1 . . . parsed_2m9e 1
163 1 . . . parsed_2m9e 1
164 1 . . . parsed_2m9e 1
165 1 . . . parsed_2m9e 1
166 1 . . . parsed_2m9e 1
167 1 . . . parsed_2m9e 1
168 1 . . . parsed_2m9e 1
169 1 . . . parsed_2m9e 1
170 1 . . . parsed_2m9e 1
171 1 . . . parsed_2m9e 1
172 1 . . . parsed_2m9e 1
173 1 . . . parsed_2m9e 1
174 1 . . . parsed_2m9e 1
175 1 . . . parsed_2m9e 1
176 1 . . . parsed_2m9e 1
177 1 . . . parsed_2m9e 1
178 1 . . . parsed_2m9e 1
179 1 . . . parsed_2m9e 1
180 1 . . . parsed_2m9e 1
181 1 . . . parsed_2m9e 1
182 1 . . . parsed_2m9e 1
183 1 . . . parsed_2m9e 1
184 1 . . . parsed_2m9e 1
185 1 . . . parsed_2m9e 1
186 1 . . . parsed_2m9e 1
187 1 . . . parsed_2m9e 1
188 1 . . . parsed_2m9e 1
189 1 . . . parsed_2m9e 1
190 1 . . . parsed_2m9e 1
191 1 . . . parsed_2m9e 1
192 1 . . . parsed_2m9e 1
193 1 . . . parsed_2m9e 1
194 1 . . . parsed_2m9e 1
195 1 . . . parsed_2m9e 1
196 1 . . . parsed_2m9e 1
197 1 . . . parsed_2m9e 1
198 1 . . . parsed_2m9e 1
199 1 . . . parsed_2m9e 1
200 1 . . . parsed_2m9e 1
201 1 . . . parsed_2m9e 1
202 1 . . . parsed_2m9e 1
203 1 . . . parsed_2m9e 1
204 1 . . . parsed_2m9e 1
205 1 . . . parsed_2m9e 1
206 1 . . . parsed_2m9e 1
207 1 . . . parsed_2m9e 1
208 1 . . . parsed_2m9e 1
209 1 . . . parsed_2m9e 1
210 1 . . . parsed_2m9e 1
211 1 . . . parsed_2m9e 1
212 1 . . . parsed_2m9e 1
213 1 . . . parsed_2m9e 1
214 1 . . . parsed_2m9e 1
215 1 . . . parsed_2m9e 1
216 1 . . . parsed_2m9e 1
217 1 . . . parsed_2m9e 1
218 1 . . . parsed_2m9e 1
219 1 . . . parsed_2m9e 1
220 1 . . . parsed_2m9e 1
221 1 . . . parsed_2m9e 1
222 1 . . . parsed_2m9e 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 . . . . . . . . . 6 TRP HB2 parsed_2m9e 1
1 1 2 . . . . . . . . . 6 TRP H parsed_2m9e 1
2 1 1 . . . . . . . . . 6 TRP HB3 parsed_2m9e 1
2 1 2 . . . . . . . . . 6 TRP H parsed_2m9e 1
3 1 1 . . . . . . . . . 7 GLU HB2 parsed_2m9e 1
3 1 2 . . . . . . . . . 7 GLU H parsed_2m9e 1
4 1 1 . . . . . . . . . 8 LYS HB2 parsed_2m9e 1
4 1 2 . . . . . . . . . 8 LYS H parsed_2m9e 1
5 1 1 . . . . . . . . . 8 LYS HB3 parsed_2m9e 1
5 1 2 . . . . . . . . . 8 LYS H parsed_2m9e 1
6 1 1 . . . . . . . . . 9 ARG QB parsed_2m9e 1
6 1 2 . . . . . . . . . 9 ARG H parsed_2m9e 1
7 1 1 . . . . . . . . . 10 MET HB2 parsed_2m9e 1
7 1 2 . . . . . . . . . 10 MET H parsed_2m9e 1
8 1 1 . . . . . . . . . 11 PHE HB2 parsed_2m9e 1
8 1 2 . . . . . . . . . 11 PHE H parsed_2m9e 1
9 1 1 . . . . . . . . . 11 PHE HB3 parsed_2m9e 1
9 1 2 . . . . . . . . . 11 PHE H parsed_2m9e 1
10 1 1 . . . . . . . . . 12 ALA QB parsed_2m9e 1
10 1 2 . . . . . . . . . 12 ALA H parsed_2m9e 1
11 1 1 . . . . . . . . . 13 ASN HB2 parsed_2m9e 1
11 1 2 . . . . . . . . . 13 ASN H parsed_2m9e 1
12 1 1 . . . . . . . . . 13 ASN HB3 parsed_2m9e 1
12 1 2 . . . . . . . . . 13 ASN H parsed_2m9e 1
13 1 1 . . . . . . . . . 16 VAL HB parsed_2m9e 1
13 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
14 1 1 . . . . . . . . . 19 PHE HB3 parsed_2m9e 1
14 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
15 1 1 . . . . . . . . . 19 PHE HB2 parsed_2m9e 1
15 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
16 1 1 . . . . . . . . . 20 ASN HB2 parsed_2m9e 1
16 1 2 . . . . . . . . . 20 ASN H parsed_2m9e 1
17 1 1 . . . . . . . . . 20 ASN HB3 parsed_2m9e 1
17 1 2 . . . . . . . . . 20 ASN H parsed_2m9e 1
18 1 1 . . . . . . . . . 22 ILE HB parsed_2m9e 1
18 1 2 . . . . . . . . . 22 ILE H parsed_2m9e 1
19 1 1 . . . . . . . . . 27 GLN QB parsed_2m9e 1
19 1 2 . . . . . . . . . 27 GLN H parsed_2m9e 1
20 1 1 . . . . . . . . . 28 PHE HB2 parsed_2m9e 1
20 1 2 . . . . . . . . . 28 PHE H parsed_2m9e 1
21 1 1 . . . . . . . . . 28 PHE HB3 parsed_2m9e 1
21 1 2 . . . . . . . . . 28 PHE H parsed_2m9e 1
22 1 1 . . . . . . . . . 2 LEU HB2 parsed_2m9e 1
22 1 2 . . . . . . . . . 2 LEU HA parsed_2m9e 1
23 1 1 . . . . . . . . . 2 LEU HB3 parsed_2m9e 1
23 1 2 . . . . . . . . . 2 LEU HA parsed_2m9e 1
24 1 1 . . . . . . . . . 6 TRP HB2 parsed_2m9e 1
24 1 2 . . . . . . . . . 6 TRP HA parsed_2m9e 1
25 1 1 . . . . . . . . . 6 TRP HB3 parsed_2m9e 1
25 1 2 . . . . . . . . . 6 TRP HA parsed_2m9e 1
26 1 1 . . . . . . . . . 7 GLU HB2 parsed_2m9e 1
26 1 2 . . . . . . . . . 7 GLU HA parsed_2m9e 1
27 1 1 . . . . . . . . . 8 LYS HB2 parsed_2m9e 1
27 1 2 . . . . . . . . . 8 LYS HA parsed_2m9e 1
28 1 1 . . . . . . . . . 8 LYS HB3 parsed_2m9e 1
28 1 2 . . . . . . . . . 8 LYS HA parsed_2m9e 1
29 1 1 . . . . . . . . . 9 ARG QB parsed_2m9e 1
29 1 2 . . . . . . . . . 9 ARG HA parsed_2m9e 1
30 1 1 . . . . . . . . . 10 MET HB2 parsed_2m9e 1
30 1 2 . . . . . . . . . 10 MET HA parsed_2m9e 1
31 1 1 . . . . . . . . . 10 MET HB3 parsed_2m9e 1
31 1 2 . . . . . . . . . 10 MET HA parsed_2m9e 1
32 1 1 . . . . . . . . . 11 PHE HB2 parsed_2m9e 1
32 1 2 . . . . . . . . . 11 PHE HA parsed_2m9e 1
33 1 1 . . . . . . . . . 11 PHE HB3 parsed_2m9e 1
33 1 2 . . . . . . . . . 11 PHE HA parsed_2m9e 1
34 1 1 . . . . . . . . . 13 ASN HB2 parsed_2m9e 1
34 1 2 . . . . . . . . . 13 ASN HA parsed_2m9e 1
35 1 1 . . . . . . . . . 13 ASN HB3 parsed_2m9e 1
35 1 2 . . . . . . . . . 13 ASN HA parsed_2m9e 1
36 1 1 . . . . . . . . . 16 VAL HB parsed_2m9e 1
36 1 2 . . . . . . . . . 16 VAL HA parsed_2m9e 1
37 1 1 . . . . . . . . . 17 TYR HB2 parsed_2m9e 1
37 1 2 . . . . . . . . . 17 TYR HA parsed_2m9e 1
38 1 1 . . . . . . . . . 17 TYR HB3 parsed_2m9e 1
38 1 2 . . . . . . . . . 17 TYR HA parsed_2m9e 1
39 1 1 . . . . . . . . . 18 TYR HB2 parsed_2m9e 1
39 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
40 1 1 . . . . . . . . . 18 TYR HB3 parsed_2m9e 1
40 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
41 1 1 . . . . . . . . . 19 PHE HB3 parsed_2m9e 1
41 1 2 . . . . . . . . . 19 PHE HA parsed_2m9e 1
42 1 1 . . . . . . . . . 19 PHE HB2 parsed_2m9e 1
42 1 2 . . . . . . . . . 19 PHE HA parsed_2m9e 1
43 1 1 . . . . . . . . . 20 ASN HB2 parsed_2m9e 1
43 1 2 . . . . . . . . . 20 ASN HA parsed_2m9e 1
44 1 1 . . . . . . . . . 20 ASN HB3 parsed_2m9e 1
44 1 2 . . . . . . . . . 20 ASN HA parsed_2m9e 1
45 1 1 . . . . . . . . . 21 HIS HB2 parsed_2m9e 1
45 1 2 . . . . . . . . . 21 HIS HA parsed_2m9e 1
46 1 1 . . . . . . . . . 22 ILE HB parsed_2m9e 1
46 1 2 . . . . . . . . . 22 ILE HA parsed_2m9e 1
47 1 1 . . . . . . . . . 24 ASN HB2 parsed_2m9e 1
47 1 2 . . . . . . . . . 24 ASN HA parsed_2m9e 1
48 1 1 . . . . . . . . . 26 SER QB parsed_2m9e 1
48 1 2 . . . . . . . . . 26 SER HA parsed_2m9e 1
49 1 1 . . . . . . . . . 27 GLN QB parsed_2m9e 1
49 1 2 . . . . . . . . . 27 GLN HA parsed_2m9e 1
50 1 1 . . . . . . . . . 28 PHE HB3 parsed_2m9e 1
50 1 2 . . . . . . . . . 28 PHE HA parsed_2m9e 1
51 1 1 . . . . . . . . . 29 GLU HB2 parsed_2m9e 1
51 1 2 . . . . . . . . . 29 GLU HA parsed_2m9e 1
52 1 1 . . . . . . . . . 29 GLU HB3 parsed_2m9e 1
52 1 2 . . . . . . . . . 29 GLU HA parsed_2m9e 1
53 1 1 . . . . . . . . . 30 ARG QB parsed_2m9e 1
53 1 2 . . . . . . . . . 30 ARG HA parsed_2m9e 1
54 1 1 . . . . . . . . . 9 ARG HG2 parsed_2m9e 1
54 1 2 . . . . . . . . . 9 ARG H parsed_2m9e 1
55 1 1 . . . . . . . . . 9 ARG HG3 parsed_2m9e 1
55 1 2 . . . . . . . . . 9 ARG H parsed_2m9e 1
56 1 1 . . . . . . . . . 15 THR QG2 parsed_2m9e 1
56 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
57 1 1 . . . . . . . . . 16 VAL QG1 parsed_2m9e 1
57 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
58 1 1 . . . . . . . . . 16 VAL QG2 parsed_2m9e 1
58 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
59 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
59 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
60 1 1 . . . . . . . . . 17 TYR QE parsed_2m9e 1
60 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
61 1 1 . . . . . . . . . 17 TYR HB2 parsed_2m9e 1
61 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
62 1 1 . . . . . . . . . 17 TYR HB3 parsed_2m9e 1
62 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
63 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
63 1 2 . . . . . . . . . 18 TYR H parsed_2m9e 1
64 1 1 . . . . . . . . . 18 TYR QE parsed_2m9e 1
64 1 2 . . . . . . . . . 18 TYR H parsed_2m9e 1
65 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
65 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
66 1 1 . . . . . . . . . 18 TYR QE parsed_2m9e 1
66 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
67 1 1 . . . . . . . . . 19 PHE QD parsed_2m9e 1
67 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
68 1 1 . . . . . . . . . 28 PHE HB2 parsed_2m9e 1
68 1 2 . . . . . . . . . 28 PHE QD parsed_2m9e 1
69 1 1 . . . . . . . . . 28 PHE HB3 parsed_2m9e 1
69 1 2 . . . . . . . . . 28 PHE QD parsed_2m9e 1
70 1 1 . . . . . . . . . 28 PHE QD parsed_2m9e 1
70 1 2 . . . . . . . . . 28 PHE H parsed_2m9e 1
71 1 1 . . . . . . . . . 28 PHE QE parsed_2m9e 1
71 1 2 . . . . . . . . . 28 PHE HA parsed_2m9e 1
72 1 1 . . . . . . . . . 6 TRP H parsed_2m9e 1
72 1 2 . . . . . . . . . 7 GLU H parsed_2m9e 1
73 1 1 . . . . . . . . . 7 GLU H parsed_2m9e 1
73 1 2 . . . . . . . . . 8 LYS H parsed_2m9e 1
74 1 1 . . . . . . . . . 8 LYS H parsed_2m9e 1
74 1 2 . . . . . . . . . 9 ARG H parsed_2m9e 1
75 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
75 1 2 . . . . . . . . . 10 MET H parsed_2m9e 1
76 1 1 . . . . . . . . . 10 MET H parsed_2m9e 1
76 1 2 . . . . . . . . . 11 PHE H parsed_2m9e 1
77 1 1 . . . . . . . . . 13 ASN H parsed_2m9e 1
77 1 2 . . . . . . . . . 14 GLY H parsed_2m9e 1
78 1 1 . . . . . . . . . 14 GLY H parsed_2m9e 1
78 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
79 1 1 . . . . . . . . . 15 THR H parsed_2m9e 1
79 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
80 1 1 . . . . . . . . . 17 TYR H parsed_2m9e 1
80 1 2 . . . . . . . . . 18 TYR H parsed_2m9e 1
81 1 1 . . . . . . . . . 18 TYR H parsed_2m9e 1
81 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
82 1 1 . . . . . . . . . 19 PHE H parsed_2m9e 1
82 1 2 . . . . . . . . . 20 ASN H parsed_2m9e 1
83 1 1 . . . . . . . . . 25 ALA H parsed_2m9e 1
83 1 2 . . . . . . . . . 26 SER H parsed_2m9e 1
84 1 1 . . . . . . . . . 28 PHE H parsed_2m9e 1
84 1 2 . . . . . . . . . 29 GLU H parsed_2m9e 1
85 1 1 . . . . . . . . . 5 GLY HA3 parsed_2m9e 1
85 1 2 . . . . . . . . . 6 TRP H parsed_2m9e 1
86 1 1 . . . . . . . . . 6 TRP HA parsed_2m9e 1
86 1 2 . . . . . . . . . 7 GLU H parsed_2m9e 1
87 1 1 . . . . . . . . . 7 GLU HA parsed_2m9e 1
87 1 2 . . . . . . . . . 8 LYS H parsed_2m9e 1
88 1 1 . . . . . . . . . 8 LYS HA parsed_2m9e 1
88 1 2 . . . . . . . . . 9 ARG H parsed_2m9e 1
89 1 1 . . . . . . . . . 9 ARG HA parsed_2m9e 1
89 1 2 . . . . . . . . . 10 MET H parsed_2m9e 1
90 1 1 . . . . . . . . . 10 MET HA parsed_2m9e 1
90 1 2 . . . . . . . . . 11 PHE H parsed_2m9e 1
91 1 1 . . . . . . . . . 13 ASN HA parsed_2m9e 1
91 1 2 . . . . . . . . . 14 GLY H parsed_2m9e 1
92 1 1 . . . . . . . . . 14 GLY HA2 parsed_2m9e 1
92 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
93 1 1 . . . . . . . . . 15 THR HA parsed_2m9e 1
93 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
94 1 1 . . . . . . . . . 16 VAL HA parsed_2m9e 1
94 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
95 1 1 . . . . . . . . . 16 VAL HA parsed_2m9e 1
95 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
96 1 1 . . . . . . . . . 17 TYR HA parsed_2m9e 1
96 1 2 . . . . . . . . . 18 TYR H parsed_2m9e 1
97 1 1 . . . . . . . . . 18 TYR HA parsed_2m9e 1
97 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
98 1 1 . . . . . . . . . 19 PHE HA parsed_2m9e 1
98 1 2 . . . . . . . . . 20 ASN H parsed_2m9e 1
99 1 1 . . . . . . . . . 21 HIS HA parsed_2m9e 1
99 1 2 . . . . . . . . . 22 ILE H parsed_2m9e 1
100 1 1 . . . . . . . . . 22 ILE HA parsed_2m9e 1
100 1 2 . . . . . . . . . 23 THR H parsed_2m9e 1
101 1 1 . . . . . . . . . 25 ALA HA parsed_2m9e 1
101 1 2 . . . . . . . . . 26 SER H parsed_2m9e 1
102 1 1 . . . . . . . . . 26 SER HA parsed_2m9e 1
102 1 2 . . . . . . . . . 27 GLN H parsed_2m9e 1
103 1 1 . . . . . . . . . 27 GLN HA parsed_2m9e 1
103 1 2 . . . . . . . . . 28 PHE H parsed_2m9e 1
104 1 1 . . . . . . . . . 28 PHE HA parsed_2m9e 1
104 1 2 . . . . . . . . . 29 GLU H parsed_2m9e 1
105 1 1 . . . . . . . . . 29 GLU HA parsed_2m9e 1
105 1 2 . . . . . . . . . 30 ARG H parsed_2m9e 1
106 1 1 . . . . . . . . . 31 PRO HA parsed_2m9e 1
106 1 2 . . . . . . . . . 32 SER H parsed_2m9e 1
107 1 1 . . . . . . . . . 32 SER HA parsed_2m9e 1
107 1 2 . . . . . . . . . 33 GLY H parsed_2m9e 1
108 1 1 . . . . . . . . . 9 ARG QB parsed_2m9e 1
108 1 2 . . . . . . . . . 10 MET H parsed_2m9e 1
109 1 1 . . . . . . . . . 10 MET HB2 parsed_2m9e 1
109 1 2 . . . . . . . . . 11 PHE H parsed_2m9e 1
110 1 1 . . . . . . . . . 10 MET HB3 parsed_2m9e 1
110 1 2 . . . . . . . . . 11 PHE H parsed_2m9e 1
111 1 1 . . . . . . . . . 11 PHE HB2 parsed_2m9e 1
111 1 2 . . . . . . . . . 12 ALA H parsed_2m9e 1
112 1 1 . . . . . . . . . 11 PHE HB3 parsed_2m9e 1
112 1 2 . . . . . . . . . 12 ALA H parsed_2m9e 1
113 1 1 . . . . . . . . . 12 ALA QB parsed_2m9e 1
113 1 2 . . . . . . . . . 13 ASN H parsed_2m9e 1
114 1 1 . . . . . . . . . 15 THR HB parsed_2m9e 1
114 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
115 1 1 . . . . . . . . . 16 VAL HB parsed_2m9e 1
115 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
116 1 1 . . . . . . . . . 18 TYR HB2 parsed_2m9e 1
116 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
117 1 1 . . . . . . . . . 19 PHE HB2 parsed_2m9e 1
117 1 2 . . . . . . . . . 20 ASN H parsed_2m9e 1
118 1 1 . . . . . . . . . 26 SER QB parsed_2m9e 1
118 1 2 . . . . . . . . . 27 GLN H parsed_2m9e 1
119 1 1 . . . . . . . . . 27 GLN QB parsed_2m9e 1
119 1 2 . . . . . . . . . 28 PHE H parsed_2m9e 1
120 1 1 . . . . . . . . . 31 PRO HB3 parsed_2m9e 1
120 1 2 . . . . . . . . . 32 SER H parsed_2m9e 1
121 1 1 . . . . . . . . . 31 PRO HB2 parsed_2m9e 1
121 1 2 . . . . . . . . . 32 SER H parsed_2m9e 1
122 1 1 . . . . . . . . . 8 LYS QG parsed_2m9e 1
122 1 2 . . . . . . . . . 9 ARG H parsed_2m9e 1
123 1 1 . . . . . . . . . 15 THR QG2 parsed_2m9e 1
123 1 2 . . . . . . . . . 16 VAL H parsed_2m9e 1
124 1 1 . . . . . . . . . 16 VAL QG2 parsed_2m9e 1
124 1 2 . . . . . . . . . 15 THR HA parsed_2m9e 1
125 1 1 . . . . . . . . . 16 VAL QG1 parsed_2m9e 1
125 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
126 1 1 . . . . . . . . . 16 VAL QG2 parsed_2m9e 1
126 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
127 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
127 1 2 . . . . . . . . . 16 VAL HA parsed_2m9e 1
128 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
128 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
129 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
129 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
130 1 1 . . . . . . . . . 21 HIS HD2 parsed_2m9e 1
130 1 2 . . . . . . . . . 22 ILE H parsed_2m9e 1
131 1 1 . . . . . . . . . 21 HIS HD2 parsed_2m9e 1
131 1 2 . . . . . . . . . 22 ILE HA parsed_2m9e 1
132 1 1 . . . . . . . . . 22 ILE QG2 parsed_2m9e 1
132 1 2 . . . . . . . . . 23 THR HA parsed_2m9e 1
133 1 1 . . . . . . . . . 28 PHE QD parsed_2m9e 1
133 1 2 . . . . . . . . . 29 GLU H parsed_2m9e 1
134 1 1 . . . . . . . . . 31 PRO HG2 parsed_2m9e 1
134 1 2 . . . . . . . . . 32 SER H parsed_2m9e 1
135 1 1 . . . . . . . . . 31 PRO HD3 parsed_2m9e 1
135 1 2 . . . . . . . . . 30 ARG HA parsed_2m9e 1
136 1 1 . . . . . . . . . 31 PRO HD2 parsed_2m9e 1
136 1 2 . . . . . . . . . 30 ARG HA parsed_2m9e 1
137 1 1 . . . . . . . . . 11 PHE H parsed_2m9e 1
137 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
138 1 1 . . . . . . . . . 12 ALA HA parsed_2m9e 1
138 1 2 . . . . . . . . . 14 GLY H parsed_2m9e 1
139 1 1 . . . . . . . . . 19 PHE HA parsed_2m9e 1
139 1 2 . . . . . . . . . 26 SER HA parsed_2m9e 1
140 1 1 . . . . . . . . . 7 GLU HB2 parsed_2m9e 1
140 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
141 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
141 1 2 . . . . . . . . . 16 VAL QG1 parsed_2m9e 1
142 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
142 1 2 . . . . . . . . . 16 VAL QG2 parsed_2m9e 1
143 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
143 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
144 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
144 1 2 . . . . . . . . . 18 TYR QD parsed_2m9e 1
145 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
145 1 2 . . . . . . . . . 18 TYR QE parsed_2m9e 1
146 1 1 . . . . . . . . . 10 MET HA parsed_2m9e 1
146 1 2 . . . . . . . . . 16 VAL QG1 parsed_2m9e 1
147 1 1 . . . . . . . . . 10 MET HA parsed_2m9e 1
147 1 2 . . . . . . . . . 16 VAL QG2 parsed_2m9e 1
148 1 1 . . . . . . . . . 10 MET H parsed_2m9e 1
148 1 2 . . . . . . . . . 17 TYR QE parsed_2m9e 1
149 1 1 . . . . . . . . . 11 PHE H parsed_2m9e 1
149 1 2 . . . . . . . . . 15 THR HB parsed_2m9e 1
150 1 1 . . . . . . . . . 11 PHE H parsed_2m9e 1
150 1 2 . . . . . . . . . 17 TYR QE parsed_2m9e 1
151 1 1 . . . . . . . . . 11 PHE HB2 parsed_2m9e 1
151 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
152 1 1 . . . . . . . . . 11 PHE HB3 parsed_2m9e 1
152 1 2 . . . . . . . . . 15 THR H parsed_2m9e 1
153 1 1 . . . . . . . . . 12 ALA QB parsed_2m9e 1
153 1 2 . . . . . . . . . 14 GLY H parsed_2m9e 1
154 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
154 1 2 . . . . . . . . . 19 PHE HA parsed_2m9e 1
155 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
155 1 2 . . . . . . . . . 26 SER HA parsed_2m9e 1
156 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
156 1 2 . . . . . . . . . 27 GLN H parsed_2m9e 1
157 1 1 . . . . . . . . . 17 TYR QE parsed_2m9e 1
157 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
158 1 1 . . . . . . . . . 19 PHE HB2 parsed_2m9e 1
158 1 2 . . . . . . . . . 26 SER HA parsed_2m9e 1
159 1 1 . . . . . . . . . 19 PHE HZ parsed_2m9e 1
159 1 2 . . . . . . . . . 24 ASN H parsed_2m9e 1
160 1 1 . . . . . . . . . 9 ARG QB parsed_2m9e 1
160 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
161 1 1 . . . . . . . . . 9 ARG QB parsed_2m9e 1
161 1 2 . . . . . . . . . 17 TYR QE parsed_2m9e 1
162 1 1 . . . . . . . . . 9 ARG HG2 parsed_2m9e 1
162 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
163 1 1 . . . . . . . . . 9 ARG HG2 parsed_2m9e 1
163 1 2 . . . . . . . . . 19 PHE QD parsed_2m9e 1
164 1 1 . . . . . . . . . 11 PHE QD parsed_2m9e 1
164 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
165 1 1 . . . . . . . . . 11 PHE HB2 parsed_2m9e 1
165 1 2 . . . . . . . . . 15 THR HB parsed_2m9e 1
166 1 1 . . . . . . . . . 11 PHE HB3 parsed_2m9e 1
166 1 2 . . . . . . . . . 15 THR HB parsed_2m9e 1
167 1 1 . . . . . . . . . 15 THR QG2 parsed_2m9e 1
167 1 2 . . . . . . . . . 17 TYR QD parsed_2m9e 1
168 1 1 . . . . . . . . . 15 THR QG2 parsed_2m9e 1
168 1 2 . . . . . . . . . 28 PHE QD parsed_2m9e 1
169 1 1 . . . . . . . . . 15 THR QG2 parsed_2m9e 1
169 1 2 . . . . . . . . . 28 PHE QE parsed_2m9e 1
170 1 1 . . . . . . . . . 15 THR QG2 parsed_2m9e 1
170 1 2 . . . . . . . . . 28 PHE HZ parsed_2m9e 1
171 1 1 . . . . . . . . . 17 TYR HB2 parsed_2m9e 1
171 1 2 . . . . . . . . . 28 PHE QD parsed_2m9e 1
172 1 1 . . . . . . . . . 17 TYR HB3 parsed_2m9e 1
172 1 2 . . . . . . . . . 28 PHE QE parsed_2m9e 1
173 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
173 1 2 . . . . . . . . . 19 PHE HB3 parsed_2m9e 1
174 1 1 . . . . . . . . . 17 TYR QD parsed_2m9e 1
174 1 2 . . . . . . . . . 26 SER QB parsed_2m9e 1
175 1 1 . . . . . . . . . 17 TYR QE parsed_2m9e 1
175 1 2 . . . . . . . . . 19 PHE QD parsed_2m9e 1
176 1 1 . . . . . . . . . 17 TYR QE parsed_2m9e 1
176 1 2 . . . . . . . . . 19 PHE HB2 parsed_2m9e 1
177 1 1 . . . . . . . . . 17 TYR QE parsed_2m9e 1
177 1 2 . . . . . . . . . 26 SER QB parsed_2m9e 1
178 1 1 . . . . . . . . . 19 PHE QD parsed_2m9e 1
178 1 2 . . . . . . . . . 21 HIS HB3 parsed_2m9e 1
179 1 1 . . . . . . . . . 19 PHE QD parsed_2m9e 1
179 1 2 . . . . . . . . . 21 HIS HB2 parsed_2m9e 1
180 1 1 . . . . . . . . . 19 PHE QE parsed_2m9e 1
180 1 2 . . . . . . . . . 21 HIS HB3 parsed_2m9e 1
181 1 1 . . . . . . . . . 19 PHE QE parsed_2m9e 1
181 1 2 . . . . . . . . . 21 HIS HB2 parsed_2m9e 1
182 1 1 . . . . . . . . . 7 GLU H parsed_2m9e 1
182 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
183 1 1 . . . . . . . . . 7 GLU H parsed_2m9e 1
183 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
184 1 1 . . . . . . . . . 7 GLU H parsed_2m9e 1
184 1 2 . . . . . . . . . 20 ASN HA parsed_2m9e 1
185 1 1 . . . . . . . . . 8 LYS HA parsed_2m9e 1
185 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
186 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
186 1 2 . . . . . . . . . 17 TYR H parsed_2m9e 1
187 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
187 1 2 . . . . . . . . . 18 TYR HA parsed_2m9e 1
188 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 1
188 1 2 . . . . . . . . . 19 PHE H parsed_2m9e 1
189 1 1 . . . . . . . . . 18 TYR H parsed_2m9e 1
189 1 2 . . . . . . . . . 27 GLN H parsed_2m9e 1
190 1 1 . . . . . . . . . 19 PHE HA parsed_2m9e 1
190 1 2 . . . . . . . . . 27 GLN H parsed_2m9e 1
191 1 1 . . . . . . . . . 20 ASN H parsed_2m9e 1
191 1 2 . . . . . . . . . 26 SER HA parsed_2m9e 1
192 1 1 . . . . . . . . . 5 GLY H parsed_2m9e 1
192 1 2 . . . . . . . . . 22 ILE QD1 parsed_2m9e 1
193 1 1 . . . . . . . . . 5 GLY HA2 parsed_2m9e 1
193 1 2 . . . . . . . . . 22 ILE QD1 parsed_2m9e 1
194 1 1 . . . . . . . . . 5 GLY HA3 parsed_2m9e 1
194 1 2 . . . . . . . . . 22 ILE QD1 parsed_2m9e 1
195 1 1 . . . . . . . . . 6 TRP HA parsed_2m9e 1
195 1 2 . . . . . . . . . 2 LEU QD1 parsed_2m9e 1
196 1 1 . . . . . . . . . 7 GLU H parsed_2m9e 1
196 1 2 . . . . . . . . . 2 LEU QD1 parsed_2m9e 1
197 1 1 . . . . . . . . . 8 LYS H parsed_2m9e 1
197 1 2 . . . . . . . . . 18 TYR QD parsed_2m9e 1
198 1 1 . . . . . . . . . 8 LYS H parsed_2m9e 1
198 1 2 . . . . . . . . . 18 TYR QE parsed_2m9e 1
199 1 1 . . . . . . . . . 20 ASN H parsed_2m9e 1
199 1 2 . . . . . . . . . 25 ALA QB parsed_2m9e 1
200 1 1 . . . . . . . . . 25 ALA H parsed_2m9e 1
200 1 2 . . . . . . . . . 20 ASN HB2 parsed_2m9e 1
201 1 1 . . . . . . . . . 25 ALA H parsed_2m9e 1
201 1 2 . . . . . . . . . 20 ASN HB3 parsed_2m9e 1
202 1 1 . . . . . . . . . 27 GLN H parsed_2m9e 1
202 1 2 . . . . . . . . . 6 TRP HH2 parsed_2m9e 1
203 1 1 . . . . . . . . . 30 ARG H parsed_2m9e 1
203 1 2 . . . . . . . . . 18 TYR QD parsed_2m9e 1
204 1 1 . . . . . . . . . 30 ARG HA parsed_2m9e 1
204 1 2 . . . . . . . . . 18 TYR QD parsed_2m9e 1
205 1 1 . . . . . . . . . 30 ARG HA parsed_2m9e 1
205 1 2 . . . . . . . . . 18 TYR QE parsed_2m9e 1
206 1 1 . . . . . . . . . 2 LEU HG parsed_2m9e 1
206 1 2 . . . . . . . . . 18 TYR QE parsed_2m9e 1
207 1 1 . . . . . . . . . 2 LEU QD2 parsed_2m9e 1
207 1 2 . . . . . . . . . 18 TYR QD parsed_2m9e 1
208 1 1 . . . . . . . . . 2 LEU QD2 parsed_2m9e 1
208 1 2 . . . . . . . . . 18 TYR QE parsed_2m9e 1
209 1 1 . . . . . . . . . 2 LEU QD1 parsed_2m9e 1
209 1 2 . . . . . . . . . 6 TRP HB3 parsed_2m9e 1
210 1 1 . . . . . . . . . 2 LEU QD1 parsed_2m9e 1
210 1 2 . . . . . . . . . 18 TYR QD parsed_2m9e 1
211 1 1 . . . . . . . . . 2 LEU QD1 parsed_2m9e 1
211 1 2 . . . . . . . . . 18 TYR QE parsed_2m9e 1
212 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
212 1 2 . . . . . . . . . 30 ARG QB parsed_2m9e 1
213 1 1 . . . . . . . . . 18 TYR QE parsed_2m9e 1
213 1 2 . . . . . . . . . 30 ARG QB parsed_2m9e 1
214 1 1 . . . . . . . . . 18 TYR QE parsed_2m9e 1
214 1 2 . . . . . . . . . 30 ARG HG3 parsed_2m9e 1
215 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
215 1 2 . . . . . . . . . 31 PRO HG3 parsed_2m9e 1
216 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
216 1 2 . . . . . . . . . 31 PRO HG2 parsed_2m9e 1
217 1 1 . . . . . . . . . 18 TYR QE parsed_2m9e 1
217 1 2 . . . . . . . . . 31 PRO HG3 parsed_2m9e 1
218 1 1 . . . . . . . . . 18 TYR QD parsed_2m9e 1
218 1 2 . . . . . . . . . 31 PRO HD3 parsed_2m9e 1
219 1 1 . . . . . . . . . 18 TYR QE parsed_2m9e 1
219 1 2 . . . . . . . . . 31 PRO HD3 parsed_2m9e 1
220 1 1 . . . . . . . . . 20 ASN HB2 parsed_2m9e 1
220 1 2 . . . . . . . . . 25 ALA QB parsed_2m9e 1
221 1 1 . . . . . . . . . 23 THR HB parsed_2m9e 1
221 1 2 . . . . . . . . . 25 ALA QB parsed_2m9e 1
222 1 1 . . . . . . . . . 23 THR HG1 parsed_2m9e 1
222 1 2 . . . . . . . . . 25 ALA QB parsed_2m9e 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 . . . . . . . 4.00 parsed_2m9e 1
2 1 . . . . . . . 4.00 parsed_2m9e 1
3 1 . . . . . . . 4.00 parsed_2m9e 1
4 1 . . . . . . . 4.00 parsed_2m9e 1
5 1 . . . . . . . 4.00 parsed_2m9e 1
6 1 . . . . . . . 4.50 parsed_2m9e 1
7 1 . . . . . . . 4.00 parsed_2m9e 1
8 1 . . . . . . . 4.00 parsed_2m9e 1
9 1 . . . . . . . 4.00 parsed_2m9e 1
10 1 . . . . . . . 5.00 parsed_2m9e 1
11 1 . . . . . . . 4.00 parsed_2m9e 1
12 1 . . . . . . . 4.00 parsed_2m9e 1
13 1 . . . . . . . 3.00 parsed_2m9e 1
14 1 . . . . . . . 4.00 parsed_2m9e 1
15 1 . . . . . . . 4.00 parsed_2m9e 1
16 1 . . . . . . . 4.00 parsed_2m9e 1
17 1 . . . . . . . 4.00 parsed_2m9e 1
18 1 . . . . . . . 3.50 parsed_2m9e 1
19 1 . . . . . . . 4.00 parsed_2m9e 1
20 1 . . . . . . . 4.00 parsed_2m9e 1
21 1 . . . . . . . 4.00 parsed_2m9e 1
22 1 . . . . . . . 4.00 parsed_2m9e 1
23 1 . . . . . . . 4.00 parsed_2m9e 1
24 1 . . . . . . . 4.00 parsed_2m9e 1
25 1 . . . . . . . 4.00 parsed_2m9e 1
26 1 . . . . . . . 3.00 parsed_2m9e 1
27 1 . . . . . . . 4.00 parsed_2m9e 1
28 1 . . . . . . . 4.00 parsed_2m9e 1
29 1 . . . . . . . 3.50 parsed_2m9e 1
30 1 . . . . . . . 4.00 parsed_2m9e 1
31 1 . . . . . . . 4.00 parsed_2m9e 1
32 1 . . . . . . . 4.50 parsed_2m9e 1
33 1 . . . . . . . 4.00 parsed_2m9e 1
34 1 . . . . . . . 3.00 parsed_2m9e 1
35 1 . . . . . . . 3.00 parsed_2m9e 1
36 1 . . . . . . . 3.50 parsed_2m9e 1
37 1 . . . . . . . 3.00 parsed_2m9e 1
38 1 . . . . . . . 3.00 parsed_2m9e 1
39 1 . . . . . . . 3.50 parsed_2m9e 1
40 1 . . . . . . . 3.50 parsed_2m9e 1
41 1 . . . . . . . 4.00 parsed_2m9e 1
42 1 . . . . . . . 4.00 parsed_2m9e 1
43 1 . . . . . . . 4.00 parsed_2m9e 1
44 1 . . . . . . . 4.00 parsed_2m9e 1
45 1 . . . . . . . 3.50 parsed_2m9e 1
46 1 . . . . . . . 4.00 parsed_2m9e 1
47 1 . . . . . . . 3.50 parsed_2m9e 1
48 1 . . . . . . . 4.00 parsed_2m9e 1
49 1 . . . . . . . 3.50 parsed_2m9e 1
50 1 . . . . . . . 3.50 parsed_2m9e 1
51 1 . . . . . . . 3.50 parsed_2m9e 1
52 1 . . . . . . . 4.00 parsed_2m9e 1
53 1 . . . . . . . 4.00 parsed_2m9e 1
54 1 . . . . . . . 4.50 parsed_2m9e 1
55 1 . . . . . . . 4.50 parsed_2m9e 1
56 1 . . . . . . . 5.00 parsed_2m9e 1
57 1 . . . . . . . 5.00 parsed_2m9e 1
58 1 . . . . . . . 5.00 parsed_2m9e 1
59 1 . . . . . . . 4.00 parsed_2m9e 1
60 1 . . . . . . . 5.00 parsed_2m9e 1
61 1 . . . . . . . 3.50 parsed_2m9e 1
62 1 . . . . . . . 3.50 parsed_2m9e 1
63 1 . . . . . . . 4.00 parsed_2m9e 1
64 1 . . . . . . . 5.50 parsed_2m9e 1
65 1 . . . . . . . 4.00 parsed_2m9e 1
66 1 . . . . . . . 5.00 parsed_2m9e 1
67 1 . . . . . . . 5.00 parsed_2m9e 1
68 1 . . . . . . . 4.00 parsed_2m9e 1
69 1 . . . . . . . 4.00 parsed_2m9e 1
70 1 . . . . . . . 4.00 parsed_2m9e 1
71 1 . . . . . . . 5.00 parsed_2m9e 1
72 1 . . . . . . . 5.00 parsed_2m9e 1
73 1 . . . . . . . 5.00 parsed_2m9e 1
74 1 . . . . . . . 4.50 parsed_2m9e 1
75 1 . . . . . . . 4.50 parsed_2m9e 1
76 1 . . . . . . . 5.00 parsed_2m9e 1
77 1 . . . . . . . 4.00 parsed_2m9e 1
78 1 . . . . . . . 3.50 parsed_2m9e 1
79 1 . . . . . . . 4.50 parsed_2m9e 1
80 1 . . . . . . . 4.50 parsed_2m9e 1
81 1 . . . . . . . 4.50 parsed_2m9e 1
82 1 . . . . . . . 5.00 parsed_2m9e 1
83 1 . . . . . . . 5.00 parsed_2m9e 1
84 1 . . . . . . . 4.00 parsed_2m9e 1
85 1 . . . . . . . 4.00 parsed_2m9e 1
86 1 . . . . . . . 3.00 parsed_2m9e 1
87 1 . . . . . . . 3.00 parsed_2m9e 1
88 1 . . . . . . . 3.00 parsed_2m9e 1
89 1 . . . . . . . 3.00 parsed_2m9e 1
90 1 . . . . . . . 3.00 parsed_2m9e 1
91 1 . . . . . . . 4.00 parsed_2m9e 1
92 1 . . . . . . . 4.00 parsed_2m9e 1
93 1 . . . . . . . 3.00 parsed_2m9e 1
94 1 . . . . . . . 5.00 parsed_2m9e 1
95 1 . . . . . . . 3.00 parsed_2m9e 1
96 1 . . . . . . . 3.00 parsed_2m9e 1
97 1 . . . . . . . 3.00 parsed_2m9e 1
98 1 . . . . . . . 3.00 parsed_2m9e 1
99 1 . . . . . . . 4.00 parsed_2m9e 1
100 1 . . . . . . . 4.00 parsed_2m9e 1
101 1 . . . . . . . 3.00 parsed_2m9e 1
102 1 . . . . . . . 3.50 parsed_2m9e 1
103 1 . . . . . . . 3.50 parsed_2m9e 1
104 1 . . . . . . . 5.00 parsed_2m9e 1
105 1 . . . . . . . 3.00 parsed_2m9e 1
106 1 . . . . . . . 3.00 parsed_2m9e 1
107 1 . . . . . . . 3.50 parsed_2m9e 1
108 1 . . . . . . . 5.00 parsed_2m9e 1
109 1 . . . . . . . 4.50 parsed_2m9e 1
110 1 . . . . . . . 4.00 parsed_2m9e 1
111 1 . . . . . . . 5.00 parsed_2m9e 1
112 1 . . . . . . . 5.00 parsed_2m9e 1
113 1 . . . . . . . 5.00 parsed_2m9e 1
114 1 . . . . . . . 4.00 parsed_2m9e 1
115 1 . . . . . . . 4.50 parsed_2m9e 1
116 1 . . . . . . . 4.50 parsed_2m9e 1
117 1 . . . . . . . 4.50 parsed_2m9e 1
118 1 . . . . . . . 3.50 parsed_2m9e 1
119 1 . . . . . . . 5.00 parsed_2m9e 1
120 1 . . . . . . . 4.50 parsed_2m9e 1
121 1 . . . . . . . 4.50 parsed_2m9e 1
122 1 . . . . . . . 4.50 parsed_2m9e 1
123 1 . . . . . . . 5.00 parsed_2m9e 1
124 1 . . . . . . . 5.40 parsed_2m9e 1
125 1 . . . . . . . 5.60 parsed_2m9e 1
126 1 . . . . . . . 4.00 parsed_2m9e 1
127 1 . . . . . . . 4.00 parsed_2m9e 1
128 1 . . . . . . . 4.50 parsed_2m9e 1
129 1 . . . . . . . 5.00 parsed_2m9e 1
130 1 . . . . . . . 4.00 parsed_2m9e 1
131 1 . . . . . . . 5.00 parsed_2m9e 1
132 1 . . . . . . . 5.00 parsed_2m9e 1
133 1 . . . . . . . 5.40 parsed_2m9e 1
134 1 . . . . . . . 5.00 parsed_2m9e 1
135 1 . . . . . . . 4.00 parsed_2m9e 1
136 1 . . . . . . . 4.00 parsed_2m9e 1
137 1 . . . . . . . 5.00 parsed_2m9e 1
138 1 . . . . . . . 4.00 parsed_2m9e 1
139 1 . . . . . . . 4.00 parsed_2m9e 1
140 1 . . . . . . . 5.60 parsed_2m9e 1
141 1 . . . . . . . 5.00 parsed_2m9e 1
142 1 . . . . . . . 5.00 parsed_2m9e 1
143 1 . . . . . . . 5.00 parsed_2m9e 1
144 1 . . . . . . . 5.50 parsed_2m9e 1
145 1 . . . . . . . 5.50 parsed_2m9e 1
146 1 . . . . . . . 6.00 parsed_2m9e 1
147 1 . . . . . . . 5.00 parsed_2m9e 1
148 1 . . . . . . . 5.60 parsed_2m9e 1
149 1 . . . . . . . 4.50 parsed_2m9e 1
150 1 . . . . . . . 5.00 parsed_2m9e 1
151 1 . . . . . . . 4.50 parsed_2m9e 1
152 1 . . . . . . . 4.00 parsed_2m9e 1
153 1 . . . . . . . 5.60 parsed_2m9e 1
154 1 . . . . . . . 5.00 parsed_2m9e 1
155 1 . . . . . . . 4.00 parsed_2m9e 1
156 1 . . . . . . . 4.50 parsed_2m9e 1
157 1 . . . . . . . 5.00 parsed_2m9e 1
158 1 . . . . . . . 4.50 parsed_2m9e 1
159 1 . . . . . . . 4.20 parsed_2m9e 1
160 1 . . . . . . . 5.60 parsed_2m9e 1
161 1 . . . . . . . 5.00 parsed_2m9e 1
162 1 . . . . . . . 6.00 parsed_2m9e 1
163 1 . . . . . . . 5.00 parsed_2m9e 1
164 1 . . . . . . . 5.00 parsed_2m9e 1
165 1 . . . . . . . 4.00 parsed_2m9e 1
166 1 . . . . . . . 4.00 parsed_2m9e 1
167 1 . . . . . . . 6.00 parsed_2m9e 1
168 1 . . . . . . . 5.00 parsed_2m9e 1
169 1 . . . . . . . 5.60 parsed_2m9e 1
170 1 . . . . . . . 6.00 parsed_2m9e 1
171 1 . . . . . . . 3.50 parsed_2m9e 1
172 1 . . . . . . . 5.00 parsed_2m9e 1
173 1 . . . . . . . 5.60 parsed_2m9e 1
174 1 . . . . . . . 4.00 parsed_2m9e 1
175 1 . . . . . . . 4.50 parsed_2m9e 1
176 1 . . . . . . . 4.00 parsed_2m9e 1
177 1 . . . . . . . 4.50 parsed_2m9e 1
178 1 . . . . . . . 4.00 parsed_2m9e 1
179 1 . . . . . . . 4.50 parsed_2m9e 1
180 1 . . . . . . . 3.00 parsed_2m9e 1
181 1 . . . . . . . 4.50 parsed_2m9e 1
182 1 . . . . . . . 4.00 parsed_2m9e 1
183 1 . . . . . . . 4.50 parsed_2m9e 1
184 1 . . . . . . . 4.00 parsed_2m9e 1
185 1 . . . . . . . 4.50 parsed_2m9e 1
186 1 . . . . . . . 4.00 parsed_2m9e 1
187 1 . . . . . . . 4.00 parsed_2m9e 1
188 1 . . . . . . . 5.00 parsed_2m9e 1
189 1 . . . . . . . 4.50 parsed_2m9e 1
190 1 . . . . . . . 5.00 parsed_2m9e 1
191 1 . . . . . . . 4.50 parsed_2m9e 1
192 1 . . . . . . . 6.00 parsed_2m9e 1
193 1 . . . . . . . 5.00 parsed_2m9e 1
194 1 . . . . . . . 5.00 parsed_2m9e 1
195 1 . . . . . . . 6.00 parsed_2m9e 1
196 1 . . . . . . . 6.00 parsed_2m9e 1
197 1 . . . . . . . 5.00 parsed_2m9e 1
198 1 . . . . . . . 5.00 parsed_2m9e 1
199 1 . . . . . . . 5.00 parsed_2m9e 1
200 1 . . . . . . . 4.00 parsed_2m9e 1
201 1 . . . . . . . 4.00 parsed_2m9e 1
202 1 . . . . . . . 4.50 parsed_2m9e 1
203 1 . . . . . . . 5.60 parsed_2m9e 1
204 1 . . . . . . . 4.00 parsed_2m9e 1
205 1 . . . . . . . 4.00 parsed_2m9e 1
206 1 . . . . . . . 5.60 parsed_2m9e 1
207 1 . . . . . . . 5.00 parsed_2m9e 1
208 1 . . . . . . . 5.50 parsed_2m9e 1
209 1 . . . . . . . 5.60 parsed_2m9e 1
210 1 . . . . . . . 5.00 parsed_2m9e 1
211 1 . . . . . . . 5.60 parsed_2m9e 1
212 1 . . . . . . . 5.00 parsed_2m9e 1
213 1 . . . . . . . 5.00 parsed_2m9e 1
214 1 . . . . . . . 5.60 parsed_2m9e 1
215 1 . . . . . . . 4.50 parsed_2m9e 1
216 1 . . . . . . . 5.00 parsed_2m9e 1
217 1 . . . . . . . 5.60 parsed_2m9e 1
218 1 . . . . . . . 4.50 parsed_2m9e 1
219 1 . . . . . . . 4.50 parsed_2m9e 1
220 1 . . . . . . . 5.00 parsed_2m9e 1
221 1 . . . . . . . 5.60 parsed_2m9e 1
222 1 . . . . . . . 5.60 parsed_2m9e 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 "SEA003 5-residue turn without GlcNAc" 1 1 1 39 parsed_2m9e 1
2 "intra-residue distance restraints" 3 1 3 35 parsed_2m9e 1
3 HA/H 5 2 5 7 parsed_2m9e 1
4 "5 GLY HA2 5 GLY H 3.00 # 469 0.4381" 7 1 7 38 parsed_2m9e 1
5 "5 GLY HA3 5 GLY H 2.96 # 470 0.4729" 8 1 8 38 parsed_2m9e 1
6 "6 TRP HA 6 TRP H 2.81 # 472 0.6576" 9 1 9 37 parsed_2m9e 1
7 "7 GLU HA 7 GLU H 3.23 # 473 0.2742" 10 1 10 37 parsed_2m9e 1
8 "8 LYS HA 8 LYS H 3.29 # 474 0.2460" 11 1 11 37 parsed_2m9e 1
9 "10 MET HA 10 MET H 3.35 # 252 0.2181 only 003" 12 1 12 48 parsed_2m9e 1
10 "12 ALA HA 12 ALA H 3.61 # 299 0.1326" 13 1 13 39 parsed_2m9e 1
11 "13 ASN HA 13 ASN H 3.18 # 479 0.3045" 14 1 14 39 parsed_2m9e 1
12 "14 GLY HA3 14 GLY H 2.48 # 481 1.4101" 15 1 15 40 parsed_2m9e 1
13 "15 THR HA 15 THR H 3.04 # 482 0.4023 only 003" 16 1 16 48 parsed_2m9e 1
14 "17 TYR HA 17 TYR H 3.46 # 483 0.1777" 17 1 17 39 parsed_2m9e 1
15 "19 PHE HA 19 PHE H 3.60 # 305 0.1349" 18 1 18 39 parsed_2m9e 1
16 "21 HIS HA 21 HIS H 2.74 # 484 0.7687" 19 1 19 39 parsed_2m9e 1
17 "23 THR HA 23 THR H 2.63 # 488 0.9817" 20 1 20 39 parsed_2m9e 1
18 "25 ALA HA 25 ALA H 3.01 # 490 0.4318" 21 1 21 39 parsed_2m9e 1
19 "26 SER HA 26 SER H 3.41 # 491 0.1940" 22 1 22 39 parsed_2m9e 1
20 "27 GLN HA 27 GLN H 3.56 # 492 0.1468" 23 1 23 39 parsed_2m9e 1
21 "28 PHE HA 28 PHE H 3.50 # 493 0.1641 003 slight ol" 24 1 24 53 parsed_2m9e 1
22 "30 ARG HA 30 ARG H 3.31 # 497 0.2365" 25 1 25 39 parsed_2m9e 1
23 HB/H 27 2 27 7 parsed_2m9e 1
24 "412,414 1.0667" 29 25 29 40 parsed_2m9e 1
25 "413,415 0.9153" 30 25 30 40 parsed_2m9e 1
26 "416,417 0.3087" 31 25 31 40 parsed_2m9e 1
27 "418,420 0.4923" 32 25 32 40 parsed_2m9e 1
28 "419,421 0.5709" 33 25 33 40 parsed_2m9e 1
29 "272 0.2964 2 protons" 34 24 34 45 parsed_2m9e 1
30 "422,423 0.1994" 35 27 35 42 parsed_2m9e 1
31 "106,288 0.3064" 36 27 36 42 parsed_2m9e 1
32 "107,289 0.2858" 37 27 37 42 parsed_2m9e 1
33 "296 0.2144" 38 26 38 37 parsed_2m9e 1
34 "426 0.0716" 39 27 39 38 parsed_2m9e 1
35 "425,427 0.2664" 40 27 40 42 parsed_2m9e 1
36 "267 0.9991" 41 26 41 37 parsed_2m9e 1
37 "85,301 0.3681" 42 27 42 41 parsed_2m9e 1
38 "97,303 0.2590" 43 27 43 41 parsed_2m9e 1
39 "429,431 0.5075" 44 27 44 42 parsed_2m9e 1
40 "430,432 0.6080" 45 27 45 42 parsed_2m9e 1
41 "433,434 0.7151" 46 26 46 41 parsed_2m9e 1
42 "437 0.4015 2 protons" 47 26 47 47 parsed_2m9e 1
43 "282 0.2622" 48 27 48 38 parsed_2m9e 1
44 "283 0.1997" 49 27 49 38 parsed_2m9e 1
45 HB/HA 51 2 51 8 parsed_2m9e 1
46 "439 0.3059" 53 26 53 37 parsed_2m9e 1
47 "440 0.5656" 54 26 54 37 parsed_2m9e 1
48 "441 0.2966" 55 26 55 37 parsed_2m9e 1
49 "442 0.2611" 56 26 56 37 parsed_2m9e 1
50 "443 0.8694" 57 26 57 37 parsed_2m9e 1
51 "444 0.3330" 58 26 58 37 parsed_2m9e 1
52 "445 0.3533" 59 26 59 37 parsed_2m9e 1
53 "446 0.5149 2 protons" 60 25 60 46 parsed_2m9e 1
54 "447 0.2776" 61 28 61 39 parsed_2m9e 1
55 "448 0.3488" 62 28 62 39 parsed_2m9e 1
56 "449 0.0850" 63 28 63 39 parsed_2m9e 1
57 "450 0.2150" 64 28 64 39 parsed_2m9e 1
58 "98 1.4100" 65 28 65 38 parsed_2m9e 1
59 "99 1.1186" 66 27 66 37 parsed_2m9e 1
60 "451 0.5660" 67 27 67 38 parsed_2m9e 1
61 "452 1.4827" 68 28 68 39 parsed_2m9e 1
62 "453 0.9995" 69 28 69 39 parsed_2m9e 1
63 "454 0.4787" 70 28 70 39 parsed_2m9e 1
64 "455 0.5662" 71 28 71 39 parsed_2m9e 1
65 "84 0.2441" 72 28 72 38 parsed_2m9e 1
66 "438 0.3530" 73 28 73 39 parsed_2m9e 1
67 "456 0.2854" 74 28 74 39 parsed_2m9e 1
68 "457 0.2346" 75 28 75 39 parsed_2m9e 1
69 "459 0.8734" 76 28 76 39 parsed_2m9e 1
70 "460 0.3806" 77 27 77 38 parsed_2m9e 1
71 "461 0.6132" 78 28 78 39 parsed_2m9e 1
72 "121 0.3155 2 protons" 79 27 79 48 parsed_2m9e 1
73 "463 0.8542 2 protons" 80 27 80 48 parsed_2m9e 1
74 "465 0.5462" 81 28 81 39 parsed_2m9e 1
75 "466 0.5632" 82 28 82 39 parsed_2m9e 1
76 "467 0.4935" 83 28 83 39 parsed_2m9e 1
77 "468 0.5259 2 protons" 84 27 84 48 parsed_2m9e 1
78 others 86 2 86 9 parsed_2m9e 1
79 "276 0.1317" 88 25 88 36 parsed_2m9e 1
80 "277 0.2390" 89 25 89 36 parsed_2m9e 1
81 "244 0.2152" 90 27 90 38 parsed_2m9e 1
82 "262 0.2641" 91 27 91 38 parsed_2m9e 1
83 "263 0.6573" 92 27 92 38 parsed_2m9e 1
84 "169,269 0.3612" 93 26 93 41 parsed_2m9e 1
85 "152,270 0.0272 very weak" 94 26 94 51 parsed_2m9e 1
86 "89 0.6783" 95 28 95 38 parsed_2m9e 1
87 "90 0.8474" 96 28 96 38 parsed_2m9e 1
88 "381 0.4434" 97 26 97 37 parsed_2m9e 1
89 "380 0.2197" 98 26 98 37 parsed_2m9e 1
90 "375 0.4702" 99 27 99 38 parsed_2m9e 1
91 "374 0.1860" 100 27 100 38 parsed_2m9e 1
92 "190,309 0.1820" 101 26 101 41 parsed_2m9e 1
93 "100,227 0.3541 ol" 102 28 102 46 parsed_2m9e 1
94 "101,228 0.5403" 103 28 103 43 parsed_2m9e 1
95 "232,284 0.2585" 104 26 104 41 parsed_2m9e 1
96 "198 0.0757 003 very weak" 105 27 105 52 parsed_2m9e 1
97 "sequential distance restraints" 108 1 108 32 parsed_2m9e 1
98 "H/H: values of both cross peaks were mediated (in some cases not due to phasing problems)" 110 1 110 91 parsed_2m9e 1
99 "13,14 0.3667 calibration peak" 112 23 112 53 parsed_2m9e 1
100 "15,16 0.0651 calibration peak" 113 23 113 53 parsed_2m9e 1
101 "17,18 0.1636 calibration peak" 114 23 114 53 parsed_2m9e 1
102 "19,20 0.0854 calibration peak" 115 24 115 54 parsed_2m9e 1
103 "253 0.0469 only 003" 116 25 116 45 parsed_2m9e 1
104 "236,260 0.3482" 117 25 117 40 parsed_2m9e 1
105 "249,261 0.6093" 118 25 118 40 parsed_2m9e 1
106 "271 0.1261" 119 25 119 36 parsed_2m9e 1
107 "21,22 0.1498 calibration peak" 120 25 120 55 parsed_2m9e 1
108 "23,24 0.0785 calibration peak, only 003" 121 25 121 65 parsed_2m9e 1
109 "25,26 0.0409 calibration peak" 122 25 122 55 parsed_2m9e 1
110 "27,28 0.1034 calibration peak, very weak" 123 25 123 66 parsed_2m9e 1
111 "285 0.2699" 124 25 124 36 parsed_2m9e 1
112 HA/H 126 1 126 6 parsed_2m9e 1
113 "471 0.1478" 128 25 128 36 parsed_2m9e 1
114 "1 0.9138 calibration peak" 129 24 129 50 parsed_2m9e 1
115 "2 1.3504 calibration peak" 130 24 130 50 parsed_2m9e 1
116 "3 2.7518 calibration peak, 003 ol, 004 slight ol" 131 24 131 73 parsed_2m9e 1
117 "4 1.2490 calibration peak" 132 25 132 51 parsed_2m9e 1
118 "476 1.5317" 133 26 133 37 parsed_2m9e 1
119 "259 0.2325" 134 26 134 37 parsed_2m9e 1
120 "130 0.2453" 135 27 135 38 parsed_2m9e 1
121 "132 1.5824" 136 26 136 38 parsed_2m9e 1
122 "248 0.0577 only 003" 137 26 137 46 parsed_2m9e 1
123 "5 1.4646 calibration peak, 004 slight ol" 138 26 138 67 parsed_2m9e 1
124 "6 1.5739 calibration peak ol?" 139 26 139 56 parsed_2m9e 1
125 "7 0.9833 calibration peak" 140 26 140 52 parsed_2m9e 1
126 "8 0.8932 calibration peak" 141 26 141 52 parsed_2m9e 1
127 "485 0.3187" 142 26 142 37 parsed_2m9e 1
128 "487 0.1492" 143 26 143 37 parsed_2m9e 1
129 "9 2.1920 calibration peak" 144 26 144 52 parsed_2m9e 1
130 "10,11 0.6337 calibration peak" 145 26 145 56 parsed_2m9e 1
131 "12 0.4004 calibration peak, 004 H2O line" 146 26 146 67 parsed_2m9e 1
132 "494 0.0291" 147 26 147 37 parsed_2m9e 1
133 "496 1.3720" 148 26 148 37 parsed_2m9e 1
134 "500 1.2915" 149 26 149 37 parsed_2m9e 1
135 "501 0.8094" 150 26 150 37 parsed_2m9e 1
136 HA/HA 152 1 152 7 parsed_2m9e 1
137 -- 154 1 154 4 parsed_2m9e 1
138 HB/H 156 1 156 6 parsed_2m9e 1
139 "53,251 0.3275 2 protons" 158 25 158 49 parsed_2m9e 1
140 "70,286 0.1225" 159 27 159 41 parsed_2m9e 1
141 "71,287 0.1705" 160 27 160 41 parsed_2m9e 1
142 "297 0.0774" 161 27 161 38 parsed_2m9e 1
143 "298 0.0812" 162 27 162 38 parsed_2m9e 1
144 "61,233 0.1426" 163 26 163 40 parsed_2m9e 1
145 "133 0.3318" 164 26 164 37 parsed_2m9e 1
146 "268 0.2368" 165 26 165 37 parsed_2m9e 1
147 "302 0.1716" 166 27 166 38 parsed_2m9e 1
148 "96 0.1069" 167 27 167 37 parsed_2m9e 1
149 "128,310 0.1634 2 protons" 168 26 168 51 parsed_2m9e 1
150 "281 0.2917 only 003, 2 protons" 169 26 169 57 parsed_2m9e 1
151 "329 0.2019" 170 27 170 38 parsed_2m9e 1
152 "330 0.1822" 171 27 171 38 parsed_2m9e 1
153 HB/HA 173 2 173 8 parsed_2m9e 1
154 "3 PRO HB2 2 LEU HA 3.62 # 349 0.1319" 175 1 175 39 parsed_2m9e 1
155 "12 ALA QB 13 ASN HA 4.86 # 60 0.0838" 176 1 176 39 parsed_2m9e 1
156 SC/SC 178 2 178 8 parsed_2m9e 1
157 "2 LEU QD1 3 PRO HD2 4.85 # 333 0.0866 ol HE?" 180 1 180 47 parsed_2m9e 1
158 "2 LEU QD1 3 PRO HD3 5.37 # 334 0.0316" 181 1 181 40 parsed_2m9e 1
159 "11 PHE HB3 12 ALA QB 4.99 # 117 0.0661" 182 1 182 41 parsed_2m9e 1
160 "16 VAL QG1 17 TYR QD 4.93 # 58,154 0.0739" 183 1 183 44 parsed_2m9e 1
161 "16 VAL QG2 17 TYR QD 5.28 # 59,155 0.0385" 184 1 184 44 parsed_2m9e 1
162 "21 HIS HD2 22 ILE QD1 4.93 # 195 0.0744" 185 1 185 42 parsed_2m9e 1
163 "22 ILE QG2 23 THR HB 4.80 # 320 0.0941" 186 1 186 41 parsed_2m9e 1
164 "30 ARG QB 31 PRO HD3 4.44 # 356 0.1826" 187 1 187 41 parsed_2m9e 1
165 "30 ARG QB 31 PRO HD3 4.42 # 357 0.1913" 188 1 188 41 parsed_2m9e 1
166 "30 ARG HG2 31 PRO HD3 3.70 # 352 0.1130" 189 1 189 42 parsed_2m9e 1
167 "30 ARG HG2 31 PRO HD2 4.02 # 353 0.0621" 190 1 190 42 parsed_2m9e 1
168 "30 ARG HG3 31 PRO HD3 3.57 # 354 0.1434" 191 1 191 42 parsed_2m9e 1
169 "30 ARG HG3 31 PRO HD2 3.57 # 355 0.1434 sic! 004 ol" 192 1 192 54 parsed_2m9e 1
170 others 194 1 194 8 parsed_2m9e 1
171 "275 0.2723 2 protons" 196 24 196 45 parsed_2m9e 1
172 "65,266 0.4461" 197 27 197 41 parsed_2m9e 1
173 "16 VAL QG1 15 THR HA 6.00 # 54 0.1242" 198 1 198 40 parsed_2m9e 1
174 "55 0.4548" 199 28 199 38 parsed_2m9e 1
175 "264 0.4631" 200 27 200 38 parsed_2m9e 1
176 "265 0.4398" 201 27 201 38 parsed_2m9e 1
177 "161 0.1778" 202 27 202 38 parsed_2m9e 1
178 "163 0.0875" 203 27 203 38 parsed_2m9e 1
179 "308 0.0915" 204 26 204 37 parsed_2m9e 1
180 "197 0.0645" 205 27 205 38 parsed_2m9e 1
181 "196 0.0280" 206 28 206 39 parsed_2m9e 1
182 "319 0.3010" 207 28 207 39 parsed_2m9e 1
183 "230,254 0.0500" 208 26 208 41 parsed_2m9e 1
184 "318 0.0516" 209 27 209 38 parsed_2m9e 1
185 "498 0.6227" 210 28 210 39 parsed_2m9e 1
186 "499 0.6647" 211 28 211 39 parsed_2m9e 1
187 "long-range distances on turn side" 217 1 217 35 parsed_2m9e 1
188 BB/BB 219 2 219 8 parsed_2m9e 1
189 "11 PHE H 13 ASN HA 6.00 # 291 0.3483" 221 1 221 39 parsed_2m9e 1
190 "250 0.0658" 222 25 222 36 parsed_2m9e 1
191 "258 0.3627" 223 26 223 37 parsed_2m9e 1
192 "31,32 0.2330 calibration peak" 224 27 224 57 parsed_2m9e 1
193 SC/BB 226 2 226 8 parsed_2m9e 1
194 "300 0.0888" 228 26 228 37 parsed_2m9e 1
195 "273 0.1345" 229 26 229 37 parsed_2m9e 1
196 "274 0.2672 slight ol" 230 26 230 47 parsed_2m9e 1
197 "170 0.0660" 231 25 231 36 parsed_2m9e 1
198 "278 0.0505" 232 25 232 36 parsed_2m9e 1
199 "279 0.0234" 233 25 233 36 parsed_2m9e 1
200 "56 0.1578" 234 28 234 38 parsed_2m9e 1
201 "57 0.2385" 235 28 235 38 parsed_2m9e 1
202 "150 0.0068" 236 26 236 37 parsed_2m9e 1
203 "290 0.0925" 237 26 237 37 parsed_2m9e 1
204 "151,292 0.0401" 238 26 238 41 parsed_2m9e 1
205 "246 0.1971 only 003" 239 27 239 47 parsed_2m9e 1
206 "116,245 0.1410" 240 27 240 42 parsed_2m9e 1
207 "255 0.0403" 241 26 241 37 parsed_2m9e 1
208 "164 0.0361" 242 27 242 38 parsed_2m9e 1
209 "165 0.2250" 243 27 243 38 parsed_2m9e 1
210 "173,312 0.1040" 244 26 244 41 parsed_2m9e 1
211 "307 0.0534" 245 26 245 37 parsed_2m9e 1
212 "95 0.1388" 246 28 246 38 parsed_2m9e 1
213 "204 0.1298" 247 26 247 37 parsed_2m9e 1
214 SC/SC 249 2 249 8 parsed_2m9e 1
215 "153 0.1206 2 protons" 251 26 251 47 parsed_2m9e 1
216 "52,136 0.0655 2 protons, 004 stronger" 252 26 252 64 parsed_2m9e 1
217 "9 ARG QB 19 PHE QD 6.00 # 179 0.1158 2 protons" 253 1 253 50 parsed_2m9e 1
218 "156 0.0014 very weak" 254 27 254 48 parsed_2m9e 1
219 "178 0.2012" 255 27 255 38 parsed_2m9e 1
220 "166,218 0.2863" 256 27 256 42 parsed_2m9e 1
221 "104 0.2485" 257 28 257 39 parsed_2m9e 1
222 "105 0.1480" 258 28 258 39 parsed_2m9e 1
223 "67,157 0.0254" 259 28 259 42 parsed_2m9e 1
224 "64,224 0.1788" 260 28 260 42 parsed_2m9e 1
225 "63,199 0.1081" 261 28 261 42 parsed_2m9e 1
226 "62,222 0.0265" 262 28 262 42 parsed_2m9e 1
227 "91,225 0.1977" 263 28 263 42 parsed_2m9e 1
228 "200 0.0327" 264 28 264 39 parsed_2m9e 1
229 "158 0.0544" 265 28 265 39 parsed_2m9e 1
230 "122,159 0.2462 2 protons" 266 27 266 52 parsed_2m9e 1
231 "147,188 0.0873" 267 27 267 42 parsed_2m9e 1
232 "94 0.2634 004 stronger" 268 28 268 51 parsed_2m9e 1
233 "120,143 0.0882 2 protons" 269 27 269 52 parsed_2m9e 1
234 "180 0.5108" 270 28 270 39 parsed_2m9e 1
235 "181 0.2029" 271 28 271 39 parsed_2m9e 1
236 "182 0.4349" 272 28 272 39 parsed_2m9e 1
237 "183 0.1096" 273 28 273 39 parsed_2m9e 1
238 "long-range distances on beta sheet side" 289 1 289 41 parsed_2m9e 1
239 BB/BB 291 2 291 8 parsed_2m9e 1
240 "40,41 0.1755 calibration peak" 293 24 293 54 parsed_2m9e 1
241 "34 0.1277 calibration peak, only 003" 294 25 294 62 parsed_2m9e 1
242 "33 0.2343 calibration peak" 295 25 295 52 parsed_2m9e 1
243 "36 0.0696 calibration peak" 296 25 296 52 parsed_2m9e 1
244 "42,43 0.2961 calibration peak" 297 24 297 54 parsed_2m9e 1
245 "35 0.2924 calibration peak" 298 25 298 52 parsed_2m9e 1
246 "44,45 0.0538 calibration peak" 299 24 299 54 parsed_2m9e 1
247 "46,47 0.1492 calibration peak, slight ol" 300 25 300 66 parsed_2m9e 1
248 "39 0.0654 calibration peak" 301 26 301 53 parsed_2m9e 1
249 "37,38 0.1566 calibration peak" 302 26 302 56 parsed_2m9e 1
250 SC/BB 304 2 304 8 parsed_2m9e 1
251 "4 PRO HA 22 ILE QD1 6.00 # 323 0.0402" 306 1 306 40 parsed_2m9e 1
252 "331 0.0479 004 vw" 307 26 307 44 parsed_2m9e 1
253 "321 0.2683" 308 28 308 39 parsed_2m9e 1
254 "322 0.3178" 309 28 309 39 parsed_2m9e 1
255 "6 TRP H 2 LEU QD1 6.00 # 341 0.0686" 310 1 310 38 parsed_2m9e 1
256 "338 0.0756" 311 26 311 37 parsed_2m9e 1
257 "342 0.0477" 312 25 312 36 parsed_2m9e 1
258 "7 GLU HA 2 LEU QD2 5.60 # 335 0.0615" 313 1 313 39 parsed_2m9e 1
259 "7 GLU HA 2 LEU QD1 6.00 # 336 0.4488" 314 1 314 39 parsed_2m9e 1
260 "379 0.0554" 315 25 315 36 parsed_2m9e 1
261 "378 0.0659" 316 25 316 36 parsed_2m9e 1
262 "19 PHE H 6 TRP HE3 4.00 # 405 0.2158" 317 1 317 39 parsed_2m9e 1
263 "19 PHE HA 6 TRP HE3 5.00 # 403 0.0620" 318 1 318 40 parsed_2m9e 1
264 "20 ASN H 6 TRP HE3 4.00 # 404 0.3136" 319 1 319 39 parsed_2m9e 1
265 "348 0.1523" 320 26 320 37 parsed_2m9e 1
266 "382 0.2835" 321 27 321 38 parsed_2m9e 1
267 "383 0.3831" 322 27 322 38 parsed_2m9e 1
268 "393 0.1056" 323 26 323 37 parsed_2m9e 1
269 "377 0.0627" 324 26 324 37 parsed_2m9e 1
270 "373 0.2656 ol 004" 325 27 325 45 parsed_2m9e 1
271 "372 0.2702 ol 004" 326 27 326 45 parsed_2m9e 1
272 SC/SC 328 2 328 8 parsed_2m9e 1
273 "369 0.0928" 330 26 330 37 parsed_2m9e 1
274 "325,363 0.6024" 331 27 331 42 parsed_2m9e 1
275 "324,362 0.8047" 332 27 332 42 parsed_2m9e 1
276 "332 0.1361" 333 27 333 38 parsed_2m9e 1
277 "340 0.5093" 334 27 334 38 parsed_2m9e 1
278 "339 0.4583" 335 27 335 38 parsed_2m9e 1
279 "3 PRO HB2 6 TRP HD1 4.00 # 389 0.1526" 336 1 336 40 parsed_2m9e 1
280 "3 PRO HG3 6 TRP HD1 4.50 # 350,388 0.1312" 337 1 337 44 parsed_2m9e 1
281 "3 PRO HG2 6 TRP HD1 4.00 # 351 0.4887" 338 1 338 40 parsed_2m9e 1
282 "3 PRO HD3 31 PRO HG2 6.00 # 317 0.1283" 339 1 339 41 parsed_2m9e 1
283 "4 PRO HD2 6 TRP HD1 5.60 # 390 0.0269" 340 1 340 40 parsed_2m9e 1
284 "4 PRO HD3 6 TRP HD1 6.00 # 391 0.0289" 341 1 341 40 parsed_2m9e 1
285 "6 TRP HE1 3 PRO HB2 4.50 # 408 0.0846" 342 1 342 40 parsed_2m9e 1
286 "6 TRP HE1 3 PRO HB3 5.00 # 411 0.0632" 343 1 343 40 parsed_2m9e 1
287 "6 TRP HE1 3 PRO HG3 5.00 # 409 0.0562" 344 1 344 40 parsed_2m9e 1
288 "6 TRP HE1 31 PRO HB3 5.00 # 406 0.0672" 345 1 345 41 parsed_2m9e 1
289 "6 TRP HE1 31 PRO HB2 5.50 # 407 0.1186" 346 1 346 41 parsed_2m9e 1
290 "6 TRP HD1 31 PRO HB2 5.00 # 326 0.0872" 347 1 347 41 parsed_2m9e 1
291 "6 TRP HD1 31 PRO HG3 5.00 # 315 0.0932" 348 1 348 41 parsed_2m9e 1
292 "6 TRP HE3 18 TYR QD 5.00 # 376 0.2362" 349 1 349 40 parsed_2m9e 1
293 "6 TRP HE3 31 PRO HG3 4.50 # 316,395 0.1170" 350 1 350 45 parsed_2m9e 1
294 "6 TRP HE3 31 PRO HG2 5.00 # 397 0.0755" 351 1 351 41 parsed_2m9e 1
295 "6 TRP HE3 31 PRO HD3 5.60 # 402 0.0614" 352 1 352 41 parsed_2m9e 1
296 "6 TRP HZ3 25 ALA QB 5.00 # 345,387 0.2262" 353 1 353 44 parsed_2m9e 1
297 "6 TRP HH2 20 ASN HB2 4.50 # 384 0.1437" 354 1 354 41 parsed_2m9e 1
298 "6 TRP HH2 20 ASN HB3 6.00 # 385 0.0667" 355 1 355 41 parsed_2m9e 1
299 "6 TRP HH2 25 ALA QB 5.00 # 346,386 0.3621" 356 1 356 44 parsed_2m9e 1
300 "6 TRP HZ2 25 ALA QB 5.00 # 401 0.2082" 357 1 357 40 parsed_2m9e 1
301 "6 TRP HZ2 20 ASN HB2 4.50 # 394 0.1562" 358 1 358 41 parsed_2m9e 1
302 "6 TRP HZ2 25 ALA QB 5.60 # 347 0.0867" 359 1 359 40 parsed_2m9e 1
303 "6 TRP HZ2 31 PRO HB3 4.50 # 327,399 0.1843" 360 1 360 45 parsed_2m9e 1
304 "6 TRP HZ2 31 PRO HB2 5.60 # 328,400 0.1286" 361 1 361 45 parsed_2m9e 1
305 "6 TRP HZ2 31 PRO HG3 5.50 # 396 0.0996" 362 1 362 41 parsed_2m9e 1
306 "6 TRP HZ2 31 PRO HG2 6.00 # 398 0.0714" 363 1 363 41 parsed_2m9e 1
307 "368 0.1773 2 protons" 364 27 364 48 parsed_2m9e 1
308 "367 0.2665 2 protons" 365 27 365 48 parsed_2m9e 1
309 "366 0.0474" 366 28 366 39 parsed_2m9e 1
310 "314,360 0.1089" 367 28 367 43 parsed_2m9e 1
311 "361 0.0549" 368 28 368 39 parsed_2m9e 1
312 "313 0.0541" 369 28 369 39 parsed_2m9e 1
313 "359,371 0.1983" 370 28 370 43 parsed_2m9e 1
314 "358,370 0.1320" 371 28 371 43 parsed_2m9e 1
315 "343 0.2163" 372 28 372 39 parsed_2m9e 1
316 "392 0.0919" 373 27 373 38 parsed_2m9e 1
317 "344 0.2717 yes it?s the OH" 374 28 374 55 parsed_2m9e 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2m9e
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_2m9e 2
2 1 . . . parsed_2m9e 2
3 1 . . . parsed_2m9e 2
4 1 . . . parsed_2m9e 2
5 1 . . . parsed_2m9e 2
6 1 . . . parsed_2m9e 2
7 1 . . . parsed_2m9e 2
8 1 . . . parsed_2m9e 2
9 1 . . . parsed_2m9e 2
10 1 . . . parsed_2m9e 2
11 1 . . . parsed_2m9e 2
12 1 . . . parsed_2m9e 2
13 1 . . . parsed_2m9e 2
14 1 . . . parsed_2m9e 2
15 1 . . . parsed_2m9e 2
16 1 . . . parsed_2m9e 2
17 1 . . . parsed_2m9e 2
18 1 . . . parsed_2m9e 2
19 1 . . . parsed_2m9e 2
20 1 . . . parsed_2m9e 2
21 1 . . . parsed_2m9e 2
22 1 . . . parsed_2m9e 2
23 1 . . . parsed_2m9e 2
24 1 . . . parsed_2m9e 2
25 1 . . . parsed_2m9e 2
26 1 . . . parsed_2m9e 2
27 1 . . . parsed_2m9e 2
28 1 . . . parsed_2m9e 2
29 1 . . . parsed_2m9e 2
30 1 . . . parsed_2m9e 2
31 1 . . . parsed_2m9e 2
32 1 . . . parsed_2m9e 2
33 1 . . . parsed_2m9e 2
34 1 . . . parsed_2m9e 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 . . . . . . . . . 6 TRP H parsed_2m9e 2
1 1 2 . . . . . . . . . 3 PRO O parsed_2m9e 2
2 1 1 . . . . . . . . . 6 TRP N parsed_2m9e 2
2 1 2 . . . . . . . . . 3 PRO O parsed_2m9e 2
3 1 1 . . . . . . . . . 7 GLU H parsed_2m9e 2
3 1 2 . . . . . . . . . 19 PHE O parsed_2m9e 2
4 1 1 . . . . . . . . . 7 GLU N parsed_2m9e 2
4 1 2 . . . . . . . . . 19 PHE O parsed_2m9e 2
5 1 1 . . . . . . . . . 9 ARG H parsed_2m9e 2
5 1 2 . . . . . . . . . 17 TYR O parsed_2m9e 2
6 1 1 . . . . . . . . . 9 ARG N parsed_2m9e 2
6 1 2 . . . . . . . . . 17 TYR O parsed_2m9e 2
7 1 1 . . . . . . . . . 11 PHE H parsed_2m9e 2
7 1 2 . . . . . . . . . 15 THR O parsed_2m9e 2
8 1 1 . . . . . . . . . 11 PHE N parsed_2m9e 2
8 1 2 . . . . . . . . . 15 THR O parsed_2m9e 2
9 1 1 . . . . . . . . . 14 GLY H parsed_2m9e 2
9 1 2 . . . . . . . . . 11 PHE O parsed_2m9e 2
10 1 1 . . . . . . . . . 14 GLY N parsed_2m9e 2
10 1 2 . . . . . . . . . 11 PHE O parsed_2m9e 2
11 1 1 . . . . . . . . . 15 THR H parsed_2m9e 2
11 1 2 . . . . . . . . . 11 PHE O parsed_2m9e 2
12 1 1 . . . . . . . . . 15 THR N parsed_2m9e 2
12 1 2 . . . . . . . . . 11 PHE O parsed_2m9e 2
13 1 1 . . . . . . . . . 17 TYR H parsed_2m9e 2
13 1 2 . . . . . . . . . 9 ARG O parsed_2m9e 2
14 1 1 . . . . . . . . . 17 TYR N parsed_2m9e 2
14 1 2 . . . . . . . . . 9 ARG O parsed_2m9e 2
15 1 1 . . . . . . . . . 18 TYR H parsed_2m9e 2
15 1 2 . . . . . . . . . 27 GLN O parsed_2m9e 2
16 1 1 . . . . . . . . . 18 TYR N parsed_2m9e 2
16 1 2 . . . . . . . . . 27 GLN O parsed_2m9e 2
17 1 1 . . . . . . . . . 19 PHE H parsed_2m9e 2
17 1 2 . . . . . . . . . 7 GLU O parsed_2m9e 2
18 1 1 . . . . . . . . . 19 PHE N parsed_2m9e 2
18 1 2 . . . . . . . . . 7 GLU O parsed_2m9e 2
19 1 1 . . . . . . . . . 20 ASN H parsed_2m9e 2
19 1 2 . . . . . . . . . 25 ALA O parsed_2m9e 2
20 1 1 . . . . . . . . . 20 ASN N parsed_2m9e 2
20 1 2 . . . . . . . . . 25 ALA O parsed_2m9e 2
21 1 1 . . . . . . . . . 21 HIS H parsed_2m9e 2
21 1 2 . . . . . . . . . 5 GLY O parsed_2m9e 2
22 1 1 . . . . . . . . . 21 HIS N parsed_2m9e 2
22 1 2 . . . . . . . . . 5 GLY O parsed_2m9e 2
23 1 1 . . . . . . . . . 22 ILE H parsed_2m9e 2
23 1 2 . . . . . . . . . 20 ASN OD1 parsed_2m9e 2
24 1 1 . . . . . . . . . 22 ILE N parsed_2m9e 2
24 1 2 . . . . . . . . . 20 ASN OD1 parsed_2m9e 2
25 1 1 . . . . . . . . . 23 THR H parsed_2m9e 2
25 1 2 . . . . . . . . . 20 ASN OD1 parsed_2m9e 2
26 1 1 . . . . . . . . . 23 THR N parsed_2m9e 2
26 1 2 . . . . . . . . . 20 ASN OD1 parsed_2m9e 2
27 1 1 . . . . . . . . . 24 ASN H parsed_2m9e 2
27 1 2 . . . . . . . . . 20 ASN O parsed_2m9e 2
28 1 1 . . . . . . . . . 24 ASN N parsed_2m9e 2
28 1 2 . . . . . . . . . 20 ASN O parsed_2m9e 2
29 1 1 . . . . . . . . . 25 ALA H parsed_2m9e 2
29 1 2 . . . . . . . . . 23 THR OG1 parsed_2m9e 2
30 1 1 . . . . . . . . . 25 ALA N parsed_2m9e 2
30 1 2 . . . . . . . . . 23 THR OG1 parsed_2m9e 2
31 1 1 . . . . . . . . . 27 GLN H parsed_2m9e 2
31 1 2 . . . . . . . . . 18 TYR O parsed_2m9e 2
32 1 1 . . . . . . . . . 27 GLN N parsed_2m9e 2
32 1 2 . . . . . . . . . 18 TYR O parsed_2m9e 2
33 1 1 . . . . . . . . . 28 PHE H parsed_2m9e 2
33 1 2 . . . . . . . . . 29 GLU OE1 parsed_2m9e 2
34 1 1 . . . . . . . . . 28 PHE N parsed_2m9e 2
34 1 2 . . . . . . . . . 29 GLU OE1 parsed_2m9e 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 2.40 parsed_2m9e 2
2 1 . . . . . . . 3.40 parsed_2m9e 2
3 1 . . . . . . . 2.20 parsed_2m9e 2
4 1 . . . . . . . 3.00 parsed_2m9e 2
5 1 . . . . . . . 2.00 parsed_2m9e 2
6 1 . . . . . . . 3.00 parsed_2m9e 2
7 1 . . . . . . . 2.00 parsed_2m9e 2
8 1 . . . . . . . 3.00 parsed_2m9e 2
9 1 . . . . . . . 2.40 parsed_2m9e 2
10 1 . . . . . . . 3.40 parsed_2m9e 2
11 1 . . . . . . . 3.00 parsed_2m9e 2
12 1 . . . . . . . 3.80 parsed_2m9e 2
13 1 . . . . . . . 2.30 parsed_2m9e 2
14 1 . . . . . . . 3.30 parsed_2m9e 2
15 1 . . . . . . . 2.30 parsed_2m9e 2
16 1 . . . . . . . 3.30 parsed_2m9e 2
17 1 . . . . . . . 2.00 parsed_2m9e 2
18 1 . . . . . . . 3.00 parsed_2m9e 2
19 1 . . . . . . . 2.30 parsed_2m9e 2
20 1 . . . . . . . 3.30 parsed_2m9e 2
21 1 . . . . . . . 2.30 parsed_2m9e 2
22 1 . . . . . . . 3.30 parsed_2m9e 2
23 1 . . . . . . . 2.30 parsed_2m9e 2
24 1 . . . . . . . 3.30 parsed_2m9e 2
25 1 . . . . . . . 2.30 parsed_2m9e 2
26 1 . . . . . . . 3.30 parsed_2m9e 2
27 1 . . . . . . . 2.30 parsed_2m9e 2
28 1 . . . . . . . 3.30 parsed_2m9e 2
29 1 . . . . . . . 2.20 parsed_2m9e 2
30 1 . . . . . . . 3.20 parsed_2m9e 2
31 1 . . . . . . . 2.40 parsed_2m9e 2
32 1 . . . . . . . 3.40 parsed_2m9e 2
33 1 . . . . . . . 2.40 parsed_2m9e 2
34 1 . . . . . . . 3.40 parsed_2m9e 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 "Hydrogen bonding restraints SEA003 5-residue turn without GlcNAc" 1 1 1 67 parsed_2m9e 2
2 "Hbonds.lol (lol = lower distance limit)" 4 1 4 42 parsed_2m9e 2
3 "6 TRP H 3 PRO O 1.80 # +0.8 OK" 6 1 6 52 parsed_2m9e 2
4 "6 TRP N 3 PRO O 2.70 # +0.8" 7 1 7 48 parsed_2m9e 2
5 "7 GLU H 19 PHE O 1.80 # -1.7 PDB: big angle" 8 1 8 64 parsed_2m9e 2
6 "7 GLU N 19 PHE O 2.70 # -1.7" 9 1 9 48 parsed_2m9e 2
7 "9 ARG H 17 TYR O 1.80 # -3.4 OK" 10 1 10 52 parsed_2m9e 2
8 "9 ARG N 17 TYR O 2.70 # -3.4" 11 1 11 48 parsed_2m9e 2
9 "11 PHE H 15 THR O 1.80 # -2.5 OK" 12 1 12 52 parsed_2m9e 2
10 "11 PHE N 15 THR O 2.70 # -2.5" 13 1 13 48 parsed_2m9e 2
11 "14 GLY H 11 PHE O 1.80 # -3.2 bridged with THR15 +0.40" 14 1 14 74 parsed_2m9e 2
12 "14 GLY N 11 PHE O 2.70 # -3.2" 15 1 15 48 parsed_2m9e 2
13 "15 THR H 11 PHE O 1.80 # -4.6 bridged with GLY14 +0.80" 16 1 16 74 parsed_2m9e 2
14 "15 THR N 11 PHE O 2.70 # -4.6" 17 1 17 48 parsed_2m9e 2
15 "17 TYR H 9 ARG O 1.80 # -2.8 OK but long in pdb +0.30" 18 1 18 74 parsed_2m9e 2
16 "17 TYR N 9 ARG O 2.70 # -2.8" 19 1 19 48 parsed_2m9e 2
17 "18 TYR H 27 GLN O 1.80 # -4.2 C-terminal mobility or Ar sc? +0.30" 20 1 20 85 parsed_2m9e 2
18 "18 TYR N 27 GLN O 2.70 # -4.2" 21 1 21 48 parsed_2m9e 2
19 "19 PHE H 7 GLU O 1.80 # +0.5 OK" 22 1 22 52 parsed_2m9e 2
20 "19 PHE N 7 GLU O 2.70 # +0.5" 23 1 23 48 parsed_2m9e 2
21 "20 ASN H 25 ALA O 1.80 # -3.8 OK +0.30" 24 1 24 58 parsed_2m9e 2
22 "20 ASN N 25 ALA O 2.70 # -3.8" 25 1 25 48 parsed_2m9e 2
23 "21 HIS H 5 GLY O 1.80 # -0.7 PDB: big angle +0.30" 26 1 26 70 parsed_2m9e 2
24 "21 HIS N 5 GLY O 2.70 # -0.7" 27 1 27 48 parsed_2m9e 2
25 "22 ILE H 20 ASN OD1 1.80 # -5.3 bridged with THR23 +0.30" 28 1 28 74 parsed_2m9e 2
26 "22 ILE N 20 ASN OD1 2.70 # -5.3" 29 1 29 48 parsed_2m9e 2
27 "23 THR H 20 ASN OD1 1.80 # -1.1 bridged with ILE22 +0.30" 30 1 30 74 parsed_2m9e 2
28 "23 THR N 20 ASN OD1 2.70 # -1.1" 31 1 31 48 parsed_2m9e 2
29 "24 ASN H 20 ASN O 1.80 # -1.8 PDB: big angle +0.30" 32 1 32 70 parsed_2m9e 2
30 "24 ASN N 20 ASN O 2.70 # -1.8" 33 1 33 48 parsed_2m9e 2
31 "25 ALA H 23 THR OG1 1.80 # -1.1 OK +0.20" 34 1 34 58 parsed_2m9e 2
32 "25 ALA N 23 THR OG1 2.70 # -1.1" 35 1 35 48 parsed_2m9e 2
33 "27 GLN H 18 TYR O 1.80 # -5.4 but present in PDB. Ar sc? +0.40" 36 1 36 82 parsed_2m9e 2
34 "27 GLN N 18 TYR O 2.70 # -5.4" 37 1 37 48 parsed_2m9e 2
35 "28 PHE H 29 GLU OE1 1.80 # -5.1 high mobility? +0.40" 38 1 38 70 parsed_2m9e 2
36 "28 PHE N 29 GLU OE1 2.70 # -5.1" 39 1 39 48 parsed_2m9e 2
37 "Hbonds.upl (upl = upper distance limit)" 42 1 42 42 parsed_2m9e 2
38 "+0.8 OK" 44 41 44 50 parsed_2m9e 2
39 +0.8 45 41 45 46 parsed_2m9e 2
40 "-1.7 PDB: big angle" 46 41 46 62 parsed_2m9e 2
41 -1.7 47 41 47 46 parsed_2m9e 2
42 "-3.4 OK" 48 41 48 50 parsed_2m9e 2
43 -3.4 49 41 49 46 parsed_2m9e 2
44 "-2.5 OK" 50 41 50 50 parsed_2m9e 2
45 -2.5 51 41 51 46 parsed_2m9e 2
46 "-3.2 bridged with THR15 +0.40" 52 41 52 72 parsed_2m9e 2
47 -3.2 53 41 53 46 parsed_2m9e 2
48 "-4.6 bridged with GLY14 +0.80" 54 41 54 72 parsed_2m9e 2
49 -4.6 55 41 55 46 parsed_2m9e 2
50 "-2.8 OK but long in pdb +0.30" 56 41 56 72 parsed_2m9e 2
51 -2.8 57 41 57 46 parsed_2m9e 2
52 "-4.2 C-terminal mobility or Ar sc? +0.30" 58 41 58 83 parsed_2m9e 2
53 -4.2 59 41 59 46 parsed_2m9e 2
54 "+0.5 OK" 60 41 60 50 parsed_2m9e 2
55 +0.5 61 41 61 46 parsed_2m9e 2
56 "-3.8 OK +0.30" 62 41 62 56 parsed_2m9e 2
57 -3.8 63 41 63 46 parsed_2m9e 2
58 "-0.7 PDB: big angle +0.30" 64 41 64 68 parsed_2m9e 2
59 -0.7 65 41 65 46 parsed_2m9e 2
60 "-5.3 bridged with THR23 +0.30" 66 41 66 72 parsed_2m9e 2
61 -5.3 67 41 67 46 parsed_2m9e 2
62 "-1.1 bridged with ILE22 +0.30" 68 41 68 72 parsed_2m9e 2
63 -1.1 69 41 69 46 parsed_2m9e 2
64 "-1.8 PDB: big angle +0.30" 70 41 70 68 parsed_2m9e 2
65 -1.8 71 41 71 46 parsed_2m9e 2
66 "-1.1 OK +0.20" 72 41 72 56 parsed_2m9e 2
67 -1.1 73 41 73 46 parsed_2m9e 2
68 "-5.4 but present in PDB. Ar sc? +0.40" 74 41 74 80 parsed_2m9e 2
69 -5.4 75 41 75 46 parsed_2m9e 2
70 "-5.1 high mobility? +0.40" 76 41 76 68 parsed_2m9e 2
71 -5.1 77 41 77 46 parsed_2m9e 2
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