NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
586273 |
2mlj   |
19823 | cing | 2-parsed | STAR | entry | full | 167 |
data_2mlj_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mlj
_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_2mlj 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mlj
_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 2mlj "Master copy" parsed_2mlj
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mlj
_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 2mlj.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mlj 1
1 2mlj.mr . . DYANA/DIANA 2 distance NOE simple 167 parsed_2mlj 1
1 2mlj.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mlj 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_2mlj
_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 UNKNOWN FUNCTION 28-FEB-14 2MLJ
*TITLE STRUCTURE OF LASSO PEPTIDE CAULONODIN V
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: CAULONODIN V;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: CAULOBACTER SP.;
*SOURCE 3 ORGANISM_TAXID: 366602;
*SOURCE 4 STRAIN: K31;
*SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008;
*SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET41A
*KEYWDS LARIAT PROTOKNOT, UNKNOWN FUNCTION
*EXPDTA SOLUTION NMR
*NUMMDL 15
*AUTHOR M.ZIMMERMANN, J.D.HEGEMANN, X.XIE, M.A.MARAHIEL
*REVDAT 1 14-JAN-15 2MLJ 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mlj
_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_2mlj 1
2 1 . . . parsed_2mlj 1
3 1 . . . parsed_2mlj 1
4 1 . . . parsed_2mlj 1
5 1 . . . parsed_2mlj 1
6 1 . . . parsed_2mlj 1
7 1 . . . parsed_2mlj 1
8 1 . . . parsed_2mlj 1
9 1 . . . parsed_2mlj 1
10 1 . . . parsed_2mlj 1
11 1 . . . parsed_2mlj 1
12 1 . . . parsed_2mlj 1
13 1 . . . parsed_2mlj 1
14 1 . . . parsed_2mlj 1
15 1 . . . parsed_2mlj 1
16 1 . . . parsed_2mlj 1
17 1 . . . parsed_2mlj 1
18 1 . . . parsed_2mlj 1
19 1 . . . parsed_2mlj 1
20 1 . . . parsed_2mlj 1
21 1 . . . parsed_2mlj 1
22 1 . . . parsed_2mlj 1
23 1 . . . parsed_2mlj 1
24 1 . . . parsed_2mlj 1
25 1 . . . parsed_2mlj 1
26 1 . . . parsed_2mlj 1
27 1 . . . parsed_2mlj 1
28 1 . . . parsed_2mlj 1
29 1 . . . parsed_2mlj 1
30 1 . . . parsed_2mlj 1
31 1 . . . parsed_2mlj 1
32 1 . . . parsed_2mlj 1
33 1 . . . parsed_2mlj 1
34 1 . . . parsed_2mlj 1
35 1 . . . parsed_2mlj 1
36 1 . . . parsed_2mlj 1
37 1 . . . parsed_2mlj 1
38 1 . . . parsed_2mlj 1
39 1 . . . parsed_2mlj 1
40 1 . . . parsed_2mlj 1
41 1 . . . parsed_2mlj 1
42 1 . . . parsed_2mlj 1
43 1 . . . parsed_2mlj 1
44 1 . . . parsed_2mlj 1
45 1 . . . parsed_2mlj 1
46 1 . . . parsed_2mlj 1
47 1 . . . parsed_2mlj 1
48 1 . . . parsed_2mlj 1
49 1 . . . parsed_2mlj 1
50 1 . . . parsed_2mlj 1
51 1 . . . parsed_2mlj 1
52 1 . . . parsed_2mlj 1
53 1 . . . parsed_2mlj 1
54 1 . . . parsed_2mlj 1
55 1 . . . parsed_2mlj 1
56 1 . . . parsed_2mlj 1
57 1 . . . parsed_2mlj 1
58 1 . . . parsed_2mlj 1
59 1 . . . parsed_2mlj 1
60 1 . . . parsed_2mlj 1
61 1 . . . parsed_2mlj 1
62 1 . . . parsed_2mlj 1
63 1 . . . parsed_2mlj 1
64 1 . . . parsed_2mlj 1
65 1 . . . parsed_2mlj 1
66 1 . . . parsed_2mlj 1
67 1 . . . parsed_2mlj 1
68 1 . . . parsed_2mlj 1
69 1 . . . parsed_2mlj 1
70 1 . . . parsed_2mlj 1
71 1 . . . parsed_2mlj 1
72 1 . . . parsed_2mlj 1
73 1 . . . parsed_2mlj 1
74 1 . . . parsed_2mlj 1
75 1 . . . parsed_2mlj 1
76 1 . . . parsed_2mlj 1
77 1 . . . parsed_2mlj 1
78 1 . . . parsed_2mlj 1
79 1 . . . parsed_2mlj 1
80 1 . . . parsed_2mlj 1
81 1 . . . parsed_2mlj 1
82 1 . . . parsed_2mlj 1
83 1 . . . parsed_2mlj 1
84 1 . . . parsed_2mlj 1
85 1 . . . parsed_2mlj 1
86 1 . . . parsed_2mlj 1
87 1 . . . parsed_2mlj 1
88 1 . . . parsed_2mlj 1
89 1 . . . parsed_2mlj 1
90 1 . . . parsed_2mlj 1
91 1 . . . parsed_2mlj 1
92 1 . . . parsed_2mlj 1
93 1 . . . parsed_2mlj 1
94 1 . . . parsed_2mlj 1
95 1 . . . parsed_2mlj 1
96 1 . . . parsed_2mlj 1
97 1 . . . parsed_2mlj 1
98 1 . . . parsed_2mlj 1
99 1 . . . parsed_2mlj 1
100 1 . . . parsed_2mlj 1
101 1 . . . parsed_2mlj 1
102 1 . . . parsed_2mlj 1
103 1 . . . parsed_2mlj 1
104 1 . . . parsed_2mlj 1
105 1 . . . parsed_2mlj 1
106 1 . . . parsed_2mlj 1
107 1 . . . parsed_2mlj 1
108 1 . . . parsed_2mlj 1
109 1 . . . parsed_2mlj 1
110 1 . . . parsed_2mlj 1
111 1 . . . parsed_2mlj 1
112 1 . . . parsed_2mlj 1
113 1 . . . parsed_2mlj 1
114 1 . . . parsed_2mlj 1
115 1 . . . parsed_2mlj 1
116 1 . . . parsed_2mlj 1
117 1 . . . parsed_2mlj 1
118 1 . . . parsed_2mlj 1
119 1 . . . parsed_2mlj 1
120 1 . . . parsed_2mlj 1
121 1 . . . parsed_2mlj 1
122 1 . . . parsed_2mlj 1
123 1 . . . parsed_2mlj 1
124 1 . . . parsed_2mlj 1
125 1 . . . parsed_2mlj 1
126 1 . . . parsed_2mlj 1
127 1 . . . parsed_2mlj 1
128 1 . . . parsed_2mlj 1
129 1 . . . parsed_2mlj 1
130 1 . . . parsed_2mlj 1
131 1 . . . parsed_2mlj 1
132 1 . . . parsed_2mlj 1
133 1 . . . parsed_2mlj 1
134 1 . . . parsed_2mlj 1
135 1 . . . parsed_2mlj 1
136 1 . . . parsed_2mlj 1
137 1 . . . parsed_2mlj 1
138 1 . . . parsed_2mlj 1
139 1 . . . parsed_2mlj 1
140 1 . . . parsed_2mlj 1
141 1 . . . parsed_2mlj 1
142 1 . . . parsed_2mlj 1
143 1 . . . parsed_2mlj 1
144 1 . . . parsed_2mlj 1
145 1 . . . parsed_2mlj 1
146 1 . . . parsed_2mlj 1
147 1 . . . parsed_2mlj 1
148 1 . . . parsed_2mlj 1
149 1 . . . parsed_2mlj 1
150 1 . . . parsed_2mlj 1
151 1 . . . parsed_2mlj 1
152 1 . . . parsed_2mlj 1
153 1 . . . parsed_2mlj 1
154 1 . . . parsed_2mlj 1
155 1 . . . parsed_2mlj 1
156 1 . . . parsed_2mlj 1
157 1 . . . parsed_2mlj 1
158 1 . . . parsed_2mlj 1
159 1 . . . parsed_2mlj 1
160 1 . . . parsed_2mlj 1
161 1 . . . parsed_2mlj 1
162 1 . . . parsed_2mlj 1
163 1 . . . parsed_2mlj 1
164 1 . . . parsed_2mlj 1
165 1 . . . parsed_2mlj 1
166 1 . . . parsed_2mlj 1
167 1 . . . parsed_2mlj 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 1 SER N parsed_2mlj 1
1 1 2 . . . . . . . . . 9 GLU CD parsed_2mlj 1
2 1 1 . . . . . . . . . 1 SER N parsed_2mlj 1
2 1 2 . . . . . . . . . 9 GLU OE1 parsed_2mlj 1
3 1 1 . . . . . . . . . 1 SER N parsed_2mlj 1
3 1 2 . . . . . . . . . 9 GLU CG parsed_2mlj 1
4 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
4 1 2 . . . . . . . . . 9 GLU CD parsed_2mlj 1
5 1 1 . . . . . . . . . 1 SER CA parsed_2mlj 1
5 1 2 . . . . . . . . . 9 GLU CD parsed_2mlj 1
6 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
6 1 2 . . . . . . . . . 1 GLY CA parsed_2mlj 1
7 1 1 . . . . . . . . . 1 SER CA parsed_2mlj 1
7 1 2 . . . . . . . . . 9 GLU OE1 parsed_2mlj 1
8 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
8 1 2 . . . . . . . . . 9 GLU OE1 parsed_2mlj 1
9 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
9 1 2 . . . . . . . . . 1 SER HA parsed_2mlj 1
10 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
10 1 2 . . . . . . . . . 1 SER HB2 parsed_2mlj 1
11 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
11 1 2 . . . . . . . . . 1 SER HB3 parsed_2mlj 1
12 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
12 1 2 . . . . . . . . . 2 ILE H parsed_2mlj 1
13 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
13 1 2 . . . . . . . . . 3 GLY H parsed_2mlj 1
14 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
14 1 2 . . . . . . . . . 9 GLU HB2 parsed_2mlj 1
15 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
15 1 2 . . . . . . . . . 9 GLU QG parsed_2mlj 1
16 1 1 . . . . . . . . . 1 SER H parsed_2mlj 1
16 1 2 . . . . . . . . . 17 TRP HA parsed_2mlj 1
17 1 1 . . . . . . . . . 1 SER HA parsed_2mlj 1
17 1 2 . . . . . . . . . 1 SER HB3 parsed_2mlj 1
18 1 1 . . . . . . . . . 1 SER HA parsed_2mlj 1
18 1 2 . . . . . . . . . 2 ILE H parsed_2mlj 1
19 1 1 . . . . . . . . . 1 SER HB2 parsed_2mlj 1
19 1 2 . . . . . . . . . 17 TRP HZ3 parsed_2mlj 1
20 1 1 . . . . . . . . . 1 SER HB3 parsed_2mlj 1
20 1 2 . . . . . . . . . 2 ILE H parsed_2mlj 1
21 1 1 . . . . . . . . . 1 SER HB3 parsed_2mlj 1
21 1 2 . . . . . . . . . 2 ILE QD1 parsed_2mlj 1
22 1 1 . . . . . . . . . 2 ILE H parsed_2mlj 1
22 1 2 . . . . . . . . . 2 ILE HA parsed_2mlj 1
23 1 1 . . . . . . . . . 2 ILE H parsed_2mlj 1
23 1 2 . . . . . . . . . 2 ILE QG2 parsed_2mlj 1
24 1 1 . . . . . . . . . 2 ILE H parsed_2mlj 1
24 1 2 . . . . . . . . . 2 ILE HG12 parsed_2mlj 1
25 1 1 . . . . . . . . . 2 ILE H parsed_2mlj 1
25 1 2 . . . . . . . . . 2 ILE HG13 parsed_2mlj 1
26 1 1 . . . . . . . . . 2 ILE H parsed_2mlj 1
26 1 2 . . . . . . . . . 3 GLY H parsed_2mlj 1
27 1 1 . . . . . . . . . 2 ILE H parsed_2mlj 1
27 1 2 . . . . . . . . . 18 PRO HD3 parsed_2mlj 1
28 1 1 . . . . . . . . . 2 ILE HA parsed_2mlj 1
28 1 2 . . . . . . . . . 2 ILE HB parsed_2mlj 1
29 1 1 . . . . . . . . . 2 ILE HA parsed_2mlj 1
29 1 2 . . . . . . . . . 2 ILE QD1 parsed_2mlj 1
30 1 1 . . . . . . . . . 2 ILE HA parsed_2mlj 1
30 1 2 . . . . . . . . . 3 GLY H parsed_2mlj 1
31 1 1 . . . . . . . . . 2 ILE HB parsed_2mlj 1
31 1 2 . . . . . . . . . 2 ILE QG2 parsed_2mlj 1
32 1 1 . . . . . . . . . 2 ILE HG12 parsed_2mlj 1
32 1 2 . . . . . . . . . 2 ILE HG13 parsed_2mlj 1
33 1 1 . . . . . . . . . 2 ILE QD1 parsed_2mlj 1
33 1 2 . . . . . . . . . 2 ILE HG12 parsed_2mlj 1
34 1 1 . . . . . . . . . 2 ILE QD1 parsed_2mlj 1
34 1 2 . . . . . . . . . 2 ILE HG13 parsed_2mlj 1
35 1 1 . . . . . . . . . 2 ILE QD1 parsed_2mlj 1
35 1 2 . . . . . . . . . 14 GLN QG parsed_2mlj 1
36 1 1 . . . . . . . . . 3 GLY H parsed_2mlj 1
36 1 2 . . . . . . . . . 3 GLY HA2 parsed_2mlj 1
37 1 1 . . . . . . . . . 3 GLY H parsed_2mlj 1
37 1 2 . . . . . . . . . 3 GLY HA3 parsed_2mlj 1
38 1 1 . . . . . . . . . 3 GLY HA2 parsed_2mlj 1
38 1 2 . . . . . . . . . 3 GLY HA3 parsed_2mlj 1
39 1 1 . . . . . . . . . 3 GLY HA2 parsed_2mlj 1
39 1 2 . . . . . . . . . 4 ASP H parsed_2mlj 1
40 1 1 . . . . . . . . . 3 GLY HA2 parsed_2mlj 1
40 1 2 . . . . . . . . . 16 TYR HB2 parsed_2mlj 1
41 1 1 . . . . . . . . . 3 GLY HA3 parsed_2mlj 1
41 1 2 . . . . . . . . . 4 ASP H parsed_2mlj 1
42 1 1 . . . . . . . . . 4 ASP H parsed_2mlj 1
42 1 2 . . . . . . . . . 4 ASP HA parsed_2mlj 1
43 1 1 . . . . . . . . . 4 ASP H parsed_2mlj 1
43 1 2 . . . . . . . . . 4 ASP QB parsed_2mlj 1
44 1 1 . . . . . . . . . 4 ASP H parsed_2mlj 1
44 1 2 . . . . . . . . . 5 SER H parsed_2mlj 1
45 1 1 . . . . . . . . . 4 ASP HA parsed_2mlj 1
45 1 2 . . . . . . . . . 4 ASP QB parsed_2mlj 1
46 1 1 . . . . . . . . . 4 ASP HA parsed_2mlj 1
46 1 2 . . . . . . . . . 5 SER H parsed_2mlj 1
47 1 1 . . . . . . . . . 4 ASP HA parsed_2mlj 1
47 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
48 1 1 . . . . . . . . . 5 SER H parsed_2mlj 1
48 1 2 . . . . . . . . . 5 SER HA parsed_2mlj 1
49 1 1 . . . . . . . . . 5 SER H parsed_2mlj 1
49 1 2 . . . . . . . . . 5 SER QB parsed_2mlj 1
50 1 1 . . . . . . . . . 5 SER H parsed_2mlj 1
50 1 2 . . . . . . . . . 16 TYR HB2 parsed_2mlj 1
51 1 1 . . . . . . . . . 5 SER H parsed_2mlj 1
51 1 2 . . . . . . . . . 16 TYR HB3 parsed_2mlj 1
52 1 1 . . . . . . . . . 5 SER HA parsed_2mlj 1
52 1 2 . . . . . . . . . 5 SER QB parsed_2mlj 1
53 1 1 . . . . . . . . . 5 SER HA parsed_2mlj 1
53 1 2 . . . . . . . . . 6 GLY H parsed_2mlj 1
54 1 1 . . . . . . . . . 5 SER HA parsed_2mlj 1
54 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
55 1 1 . . . . . . . . . 5 SER QB parsed_2mlj 1
55 1 2 . . . . . . . . . 6 GLY H parsed_2mlj 1
56 1 1 . . . . . . . . . 6 GLY H parsed_2mlj 1
56 1 2 . . . . . . . . . 6 GLY HA2 parsed_2mlj 1
57 1 1 . . . . . . . . . 6 GLY H parsed_2mlj 1
57 1 2 . . . . . . . . . 6 GLY HA3 parsed_2mlj 1
58 1 1 . . . . . . . . . 6 GLY H parsed_2mlj 1
58 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
59 1 1 . . . . . . . . . 6 GLY HA3 parsed_2mlj 1
59 1 2 . . . . . . . . . 6 GLY HA2 parsed_2mlj 1
60 1 1 . . . . . . . . . 6 GLY HA2 parsed_2mlj 1
60 1 2 . . . . . . . . . 7 LEU H parsed_2mlj 1
61 1 1 . . . . . . . . . 6 GLY HA3 parsed_2mlj 1
61 1 2 . . . . . . . . . 7 LEU H parsed_2mlj 1
62 1 1 . . . . . . . . . 7 LEU H parsed_2mlj 1
62 1 2 . . . . . . . . . 7 LEU HA parsed_2mlj 1
63 1 1 . . . . . . . . . 7 LEU H parsed_2mlj 1
63 1 2 . . . . . . . . . 7 LEU QB parsed_2mlj 1
64 1 1 . . . . . . . . . 7 LEU H parsed_2mlj 1
64 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
65 1 1 . . . . . . . . . 7 LEU HA parsed_2mlj 1
65 1 2 . . . . . . . . . 7 LEU QB parsed_2mlj 1
66 1 1 . . . . . . . . . 7 LEU HA parsed_2mlj 1
66 1 2 . . . . . . . . . 8 ARG H parsed_2mlj 1
67 1 1 . . . . . . . . . 7 LEU QB parsed_2mlj 1
67 1 2 . . . . . . . . . 8 ARG H parsed_2mlj 1
68 1 1 . . . . . . . . . 7 LEU QB parsed_2mlj 1
68 1 2 . . . . . . . . . 17 TRP HD1 parsed_2mlj 1
69 1 1 . . . . . . . . . 8 ARG H parsed_2mlj 1
69 1 2 . . . . . . . . . 8 ARG HA parsed_2mlj 1
70 1 1 . . . . . . . . . 8 ARG H parsed_2mlj 1
70 1 2 . . . . . . . . . 8 ARG HB2 parsed_2mlj 1
71 1 1 . . . . . . . . . 8 ARG H parsed_2mlj 1
71 1 2 . . . . . . . . . 8 ARG HB3 parsed_2mlj 1
72 1 1 . . . . . . . . . 8 ARG H parsed_2mlj 1
72 1 2 . . . . . . . . . 8 ARG HG2 parsed_2mlj 1
73 1 1 . . . . . . . . . 8 ARG H parsed_2mlj 1
73 1 2 . . . . . . . . . 8 ARG HG3 parsed_2mlj 1
74 1 1 . . . . . . . . . 8 ARG H parsed_2mlj 1
74 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
75 1 1 . . . . . . . . . 8 ARG HA parsed_2mlj 1
75 1 2 . . . . . . . . . 8 ARG HB3 parsed_2mlj 1
76 1 1 . . . . . . . . . 8 ARG HA parsed_2mlj 1
76 1 2 . . . . . . . . . 9 GLU H parsed_2mlj 1
77 1 1 . . . . . . . . . 8 ARG HA parsed_2mlj 1
77 1 2 . . . . . . . . . 16 TYR HA parsed_2mlj 1
78 1 1 . . . . . . . . . 8 ARG HA parsed_2mlj 1
78 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
79 1 1 . . . . . . . . . 8 ARG HB2 parsed_2mlj 1
79 1 2 . . . . . . . . . 8 ARG HB3 parsed_2mlj 1
80 1 1 . . . . . . . . . 8 ARG HB3 parsed_2mlj 1
80 1 2 . . . . . . . . . 8 ARG HG2 parsed_2mlj 1
81 1 1 . . . . . . . . . 8 ARG HB3 parsed_2mlj 1
81 1 2 . . . . . . . . . 9 GLU H parsed_2mlj 1
82 1 1 . . . . . . . . . 8 ARG HB3 parsed_2mlj 1
82 1 2 . . . . . . . . . 10 SER H parsed_2mlj 1
83 1 1 . . . . . . . . . 8 ARG HG2 parsed_2mlj 1
83 1 2 . . . . . . . . . 8 ARG HG3 parsed_2mlj 1
84 1 1 . . . . . . . . . 8 ARG HD2 parsed_2mlj 1
84 1 2 . . . . . . . . . 8 ARG HE parsed_2mlj 1
85 1 1 . . . . . . . . . 9 GLU H parsed_2mlj 1
85 1 2 . . . . . . . . . 9 GLU HA parsed_2mlj 1
86 1 1 . . . . . . . . . 9 GLU H parsed_2mlj 1
86 1 2 . . . . . . . . . 9 GLU HB2 parsed_2mlj 1
87 1 1 . . . . . . . . . 9 GLU H parsed_2mlj 1
87 1 2 . . . . . . . . . 9 GLU HB3 parsed_2mlj 1
88 1 1 . . . . . . . . . 9 GLU H parsed_2mlj 1
88 1 2 . . . . . . . . . 9 GLU QG parsed_2mlj 1
89 1 1 . . . . . . . . . 9 GLU H parsed_2mlj 1
89 1 2 . . . . . . . . . 16 TYR HA parsed_2mlj 1
90 1 1 . . . . . . . . . 9 GLU HA parsed_2mlj 1
90 1 2 . . . . . . . . . 9 GLU HB3 parsed_2mlj 1
91 1 1 . . . . . . . . . 9 GLU HA parsed_2mlj 1
91 1 2 . . . . . . . . . 10 SER H parsed_2mlj 1
92 1 1 . . . . . . . . . 9 GLU HA parsed_2mlj 1
92 1 2 . . . . . . . . . 17 TRP HD1 parsed_2mlj 1
93 1 1 . . . . . . . . . 9 GLU HA parsed_2mlj 1
93 1 2 . . . . . . . . . 17 TRP HE1 parsed_2mlj 1
94 1 1 . . . . . . . . . 9 GLU HB2 parsed_2mlj 1
94 1 2 . . . . . . . . . 10 SER H parsed_2mlj 1
95 1 1 . . . . . . . . . 9 GLU HB3 parsed_2mlj 1
95 1 2 . . . . . . . . . 10 SER H parsed_2mlj 1
96 1 1 . . . . . . . . . 10 SER H parsed_2mlj 1
96 1 2 . . . . . . . . . 10 SER HA parsed_2mlj 1
97 1 1 . . . . . . . . . 10 SER H parsed_2mlj 1
97 1 2 . . . . . . . . . 10 SER HB3 parsed_2mlj 1
98 1 1 . . . . . . . . . 10 SER H parsed_2mlj 1
98 1 2 . . . . . . . . . 13 SER HB3 parsed_2mlj 1
99 1 1 . . . . . . . . . 10 SER HA parsed_2mlj 1
99 1 2 . . . . . . . . . 11 MET H parsed_2mlj 1
100 1 1 . . . . . . . . . 10 SER HB3 parsed_2mlj 1
100 1 2 . . . . . . . . . 11 MET H parsed_2mlj 1
101 1 1 . . . . . . . . . 10 SER HB3 parsed_2mlj 1
101 1 2 . . . . . . . . . 14 GLN H parsed_2mlj 1
102 1 1 . . . . . . . . . 10 SER HB2 parsed_2mlj 1
102 1 2 . . . . . . . . . 11 MET H parsed_2mlj 1
103 1 1 . . . . . . . . . 10 SER HB2 parsed_2mlj 1
103 1 2 . . . . . . . . . 16 TYR H parsed_2mlj 1
104 1 1 . . . . . . . . . 11 MET H parsed_2mlj 1
104 1 2 . . . . . . . . . 11 MET HA parsed_2mlj 1
105 1 1 . . . . . . . . . 11 MET H parsed_2mlj 1
105 1 2 . . . . . . . . . 11 MET QB parsed_2mlj 1
106 1 1 . . . . . . . . . 11 MET H parsed_2mlj 1
106 1 2 . . . . . . . . . 11 MET HG2 parsed_2mlj 1
107 1 1 . . . . . . . . . 11 MET H parsed_2mlj 1
107 1 2 . . . . . . . . . 12 SER H parsed_2mlj 1
108 1 1 . . . . . . . . . 11 MET HA parsed_2mlj 1
108 1 2 . . . . . . . . . 11 MET QB parsed_2mlj 1
109 1 1 . . . . . . . . . 11 MET HA parsed_2mlj 1
109 1 2 . . . . . . . . . 12 SER H parsed_2mlj 1
110 1 1 . . . . . . . . . 11 MET HG3 parsed_2mlj 1
110 1 2 . . . . . . . . . 11 MET HG2 parsed_2mlj 1
111 1 1 . . . . . . . . . 12 SER H parsed_2mlj 1
111 1 2 . . . . . . . . . 12 SER HA parsed_2mlj 1
112 1 1 . . . . . . . . . 12 SER H parsed_2mlj 1
112 1 2 . . . . . . . . . 12 SER HB2 parsed_2mlj 1
113 1 1 . . . . . . . . . 12 SER H parsed_2mlj 1
113 1 2 . . . . . . . . . 12 SER HB3 parsed_2mlj 1
114 1 1 . . . . . . . . . 12 SER H parsed_2mlj 1
114 1 2 . . . . . . . . . 13 SER H parsed_2mlj 1
115 1 1 . . . . . . . . . 13 SER H parsed_2mlj 1
115 1 2 . . . . . . . . . 13 SER HA parsed_2mlj 1
116 1 1 . . . . . . . . . 13 SER H parsed_2mlj 1
116 1 2 . . . . . . . . . 13 SER HB3 parsed_2mlj 1
117 1 1 . . . . . . . . . 13 SER H parsed_2mlj 1
117 1 2 . . . . . . . . . 13 SER HB2 parsed_2mlj 1
118 1 1 . . . . . . . . . 13 SER HA parsed_2mlj 1
118 1 2 . . . . . . . . . 14 GLN H parsed_2mlj 1
119 1 1 . . . . . . . . . 13 SER HB2 parsed_2mlj 1
119 1 2 . . . . . . . . . 15 THR H parsed_2mlj 1
120 1 1 . . . . . . . . . 14 GLN H parsed_2mlj 1
120 1 2 . . . . . . . . . 14 GLN HA parsed_2mlj 1
121 1 1 . . . . . . . . . 14 GLN H parsed_2mlj 1
121 1 2 . . . . . . . . . 14 GLN QB parsed_2mlj 1
122 1 1 . . . . . . . . . 14 GLN H parsed_2mlj 1
122 1 2 . . . . . . . . . 14 GLN QG parsed_2mlj 1
123 1 1 . . . . . . . . . 14 GLN H parsed_2mlj 1
123 1 2 . . . . . . . . . 15 THR H parsed_2mlj 1
124 1 1 . . . . . . . . . 14 GLN HA parsed_2mlj 1
124 1 2 . . . . . . . . . 15 THR H parsed_2mlj 1
125 1 1 . . . . . . . . . 14 GLN QB parsed_2mlj 1
125 1 2 . . . . . . . . . 14 GLN QG parsed_2mlj 1
126 1 1 . . . . . . . . . 14 GLN HE22 parsed_2mlj 1
126 1 2 . . . . . . . . . 14 GLN HE21 parsed_2mlj 1
127 1 1 . . . . . . . . . 15 THR H parsed_2mlj 1
127 1 2 . . . . . . . . . 15 THR HA parsed_2mlj 1
128 1 1 . . . . . . . . . 15 THR H parsed_2mlj 1
128 1 2 . . . . . . . . . 15 THR QG2 parsed_2mlj 1
129 1 1 . . . . . . . . . 15 THR HA parsed_2mlj 1
129 1 2 . . . . . . . . . 15 THR QG2 parsed_2mlj 1
130 1 1 . . . . . . . . . 15 THR HA parsed_2mlj 1
130 1 2 . . . . . . . . . 16 TYR H parsed_2mlj 1
131 1 1 . . . . . . . . . 15 THR HB parsed_2mlj 1
131 1 2 . . . . . . . . . 15 THR QG2 parsed_2mlj 1
132 1 1 . . . . . . . . . 15 THR HB parsed_2mlj 1
132 1 2 . . . . . . . . . 16 TYR H parsed_2mlj 1
133 1 1 . . . . . . . . . 15 THR QG2 parsed_2mlj 1
133 1 2 . . . . . . . . . 16 TYR H parsed_2mlj 1
134 1 1 . . . . . . . . . 16 TYR H parsed_2mlj 1
134 1 2 . . . . . . . . . 16 TYR HA parsed_2mlj 1
135 1 1 . . . . . . . . . 16 TYR H parsed_2mlj 1
135 1 2 . . . . . . . . . 16 TYR HB2 parsed_2mlj 1
136 1 1 . . . . . . . . . 16 TYR H parsed_2mlj 1
136 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
137 1 1 . . . . . . . . . 16 TYR HA parsed_2mlj 1
137 1 2 . . . . . . . . . 16 TYR HB2 parsed_2mlj 1
138 1 1 . . . . . . . . . 16 TYR HA parsed_2mlj 1
138 1 2 . . . . . . . . . 16 TYR HB3 parsed_2mlj 1
139 1 1 . . . . . . . . . 16 TYR HA parsed_2mlj 1
139 1 2 . . . . . . . . . 17 TRP H parsed_2mlj 1
140 1 1 . . . . . . . . . 16 TYR HB2 parsed_2mlj 1
140 1 2 . . . . . . . . . 16 TYR HB3 parsed_2mlj 1
141 1 1 . . . . . . . . . 16 TYR QD parsed_2mlj 1
141 1 2 . . . . . . . . . 16 TYR HB2 parsed_2mlj 1
142 1 1 . . . . . . . . . 16 TYR HB3 parsed_2mlj 1
142 1 2 . . . . . . . . . 16 TYR QD parsed_2mlj 1
143 1 1 . . . . . . . . . 16 TYR HB3 parsed_2mlj 1
143 1 2 . . . . . . . . . 17 TRP H parsed_2mlj 1
144 1 1 . . . . . . . . . 17 TRP H parsed_2mlj 1
144 1 2 . . . . . . . . . 17 TRP HA parsed_2mlj 1
145 1 1 . . . . . . . . . 17 TRP H parsed_2mlj 1
145 1 2 . . . . . . . . . 17 TRP HB2 parsed_2mlj 1
146 1 1 . . . . . . . . . 17 TRP H parsed_2mlj 1
146 1 2 . . . . . . . . . 17 TRP HB3 parsed_2mlj 1
147 1 1 . . . . . . . . . 17 TRP H parsed_2mlj 1
147 1 2 . . . . . . . . . 17 TRP HD1 parsed_2mlj 1
148 1 1 . . . . . . . . . 17 TRP HA parsed_2mlj 1
148 1 2 . . . . . . . . . 17 TRP HE3 parsed_2mlj 1
149 1 1 . . . . . . . . . 17 TRP HA parsed_2mlj 1
149 1 2 . . . . . . . . . 18 PRO HD3 parsed_2mlj 1
150 1 1 . . . . . . . . . 17 TRP HA parsed_2mlj 1
150 1 2 . . . . . . . . . 18 PRO HD2 parsed_2mlj 1
151 1 1 . . . . . . . . . 17 TRP HB2 parsed_2mlj 1
151 1 2 . . . . . . . . . 17 TRP HB3 parsed_2mlj 1
152 1 1 . . . . . . . . . 17 TRP HB2 parsed_2mlj 1
152 1 2 . . . . . . . . . 17 TRP HD1 parsed_2mlj 1
153 1 1 . . . . . . . . . 17 TRP HB3 parsed_2mlj 1
153 1 2 . . . . . . . . . 17 TRP HD1 parsed_2mlj 1
154 1 1 . . . . . . . . . 17 TRP HB3 parsed_2mlj 1
154 1 2 . . . . . . . . . 17 TRP HE3 parsed_2mlj 1
155 1 1 . . . . . . . . . 17 TRP HB3 parsed_2mlj 1
155 1 2 . . . . . . . . . 18 PRO HD2 parsed_2mlj 1
156 1 1 . . . . . . . . . 17 TRP HE1 parsed_2mlj 1
156 1 2 . . . . . . . . . 17 TRP HD1 parsed_2mlj 1
157 1 1 . . . . . . . . . 17 TRP HZ3 parsed_2mlj 1
157 1 2 . . . . . . . . . 17 TRP HE3 parsed_2mlj 1
158 1 1 . . . . . . . . . 17 TRP HH2 parsed_2mlj 1
158 1 2 . . . . . . . . . 17 TRP HE3 parsed_2mlj 1
159 1 1 . . . . . . . . . 17 TRP HE3 parsed_2mlj 1
159 1 2 . . . . . . . . . 18 PRO HD3 parsed_2mlj 1
160 1 1 . . . . . . . . . 17 TRP HE3 parsed_2mlj 1
160 1 2 . . . . . . . . . 18 PRO HD2 parsed_2mlj 1
161 1 1 . . . . . . . . . 17 TRP HE1 parsed_2mlj 1
161 1 2 . . . . . . . . . 17 TRP HZ2 parsed_2mlj 1
162 1 1 . . . . . . . . . 17 TRP HZ3 parsed_2mlj 1
162 1 2 . . . . . . . . . 17 TRP HZ2 parsed_2mlj 1
163 1 1 . . . . . . . . . 18 PRO HA parsed_2mlj 1
163 1 2 . . . . . . . . . 18 PRO HB3 parsed_2mlj 1
164 1 1 . . . . . . . . . 18 PRO HA parsed_2mlj 1
164 1 2 . . . . . . . . . 18 PRO HB2 parsed_2mlj 1
165 1 1 . . . . . . . . . 18 PRO HD3 parsed_2mlj 1
165 1 2 . . . . . . . . . 18 PRO HB3 parsed_2mlj 1
166 1 1 . . . . . . . . . 18 PRO HD3 parsed_2mlj 1
166 1 2 . . . . . . . . . 18 PRO HG3 parsed_2mlj 1
167 1 1 . . . . . . . . . 18 PRO HD2 parsed_2mlj 1
167 1 2 . . . . . . . . . 18 PRO HG3 parsed_2mlj 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 . . . . . . . 1.33 parsed_2mlj 1
2 1 . . . . . . . 2.26 parsed_2mlj 1
3 1 . . . . . . . 2.41 parsed_2mlj 1
4 1 . . . . . . . 2.06 parsed_2mlj 1
5 1 . . . . . . . 2.42 parsed_2mlj 1
6 1 . . . . . . . 2.09 parsed_2mlj 1
7 1 . . . . . . . 2.78 parsed_2mlj 1
8 1 . . . . . . . 3.17 parsed_2mlj 1
9 1 . . . . . . . 2.68 parsed_2mlj 1
10 1 . . . . . . . 2.96 parsed_2mlj 1
11 1 . . . . . . . 2.86 parsed_2mlj 1
12 1 . . . . . . . 2.68 parsed_2mlj 1
13 1 . . . . . . . 2.86 parsed_2mlj 1
14 1 . . . . . . . 3.24 parsed_2mlj 1
15 1 . . . . . . . 3.34 parsed_2mlj 1
16 1 . . . . . . . 2.68 parsed_2mlj 1
17 1 . . . . . . . 2.40 parsed_2mlj 1
18 1 . . . . . . . 3.17 parsed_2mlj 1
19 1 . . . . . . . 2.65 parsed_2mlj 1
20 1 . . . . . . . 2.55 parsed_2mlj 1
21 1 . . . . . . . 4.01 parsed_2mlj 1
22 1 . . . . . . . 2.71 parsed_2mlj 1
23 1 . . . . . . . 3.45 parsed_2mlj 1
24 1 . . . . . . . 2.40 parsed_2mlj 1
25 1 . . . . . . . 3.02 parsed_2mlj 1
26 1 . . . . . . . 2.40 parsed_2mlj 1
27 1 . . . . . . . 3.48 parsed_2mlj 1
28 1 . . . . . . . 2.40 parsed_2mlj 1
29 1 . . . . . . . 3.42 parsed_2mlj 1
30 1 . . . . . . . 2.93 parsed_2mlj 1
31 1 . . . . . . . 3.42 parsed_2mlj 1
32 1 . . . . . . . 2.40 parsed_2mlj 1
33 1 . . . . . . . 3.42 parsed_2mlj 1
34 1 . . . . . . . 3.42 parsed_2mlj 1
35 1 . . . . . . . 4.30 parsed_2mlj 1
36 1 . . . . . . . 2.40 parsed_2mlj 1
37 1 . . . . . . . 2.52 parsed_2mlj 1
38 1 . . . . . . . 2.40 parsed_2mlj 1
39 1 . . . . . . . 2.49 parsed_2mlj 1
40 1 . . . . . . . 2.96 parsed_2mlj 1
41 1 . . . . . . . 2.40 parsed_2mlj 1
42 1 . . . . . . . 2.68 parsed_2mlj 1
43 1 . . . . . . . 3.78 parsed_2mlj 1
44 1 . . . . . . . 2.40 parsed_2mlj 1
45 1 . . . . . . . 3.28 parsed_2mlj 1
46 1 . . . . . . . 2.99 parsed_2mlj 1
47 1 . . . . . . . 4.65 parsed_2mlj 1
48 1 . . . . . . . 2.68 parsed_2mlj 1
49 1 . . . . . . . 4.09 parsed_2mlj 1
50 1 . . . . . . . 2.93 parsed_2mlj 1
51 1 . . . . . . . 3.11 parsed_2mlj 1
52 1 . . . . . . . 3.28 parsed_2mlj 1
53 1 . . . . . . . 2.40 parsed_2mlj 1
54 1 . . . . . . . 5.83 parsed_2mlj 1
55 1 . . . . . . . 3.56 parsed_2mlj 1
56 1 . . . . . . . 2.40 parsed_2mlj 1
57 1 . . . . . . . 2.68 parsed_2mlj 1
58 1 . . . . . . . 6.57 parsed_2mlj 1
59 1 . . . . . . . 2.40 parsed_2mlj 1
60 1 . . . . . . . 2.90 parsed_2mlj 1
61 1 . . . . . . . 2.40 parsed_2mlj 1
62 1 . . . . . . . 2.71 parsed_2mlj 1
63 1 . . . . . . . 3.37 parsed_2mlj 1
64 1 . . . . . . . 6.36 parsed_2mlj 1
65 1 . . . . . . . 3.53 parsed_2mlj 1
66 1 . . . . . . . 2.40 parsed_2mlj 1
67 1 . . . . . . . 4.40 parsed_2mlj 1
68 1 . . . . . . . 3.44 parsed_2mlj 1
69 1 . . . . . . . 2.68 parsed_2mlj 1
70 1 . . . . . . . 2.49 parsed_2mlj 1
71 1 . . . . . . . 2.86 parsed_2mlj 1
72 1 . . . . . . . 3.05 parsed_2mlj 1
73 1 . . . . . . . 2.93 parsed_2mlj 1
74 1 . . . . . . . 6.30 parsed_2mlj 1
75 1 . . . . . . . 2.46 parsed_2mlj 1
76 1 . . . . . . . 2.40 parsed_2mlj 1
77 1 . . . . . . . 2.40 parsed_2mlj 1
78 1 . . . . . . . 5.33 parsed_2mlj 1
79 1 . . . . . . . 2.40 parsed_2mlj 1
80 1 . . . . . . . 2.74 parsed_2mlj 1
81 1 . . . . . . . 2.99 parsed_2mlj 1
82 1 . . . . . . . 2.77 parsed_2mlj 1
83 1 . . . . . . . 2.40 parsed_2mlj 1
84 1 . . . . . . . 2.65 parsed_2mlj 1
85 1 . . . . . . . 2.55 parsed_2mlj 1
86 1 . . . . . . . 2.40 parsed_2mlj 1
87 1 . . . . . . . 2.99 parsed_2mlj 1
88 1 . . . . . . . 3.41 parsed_2mlj 1
89 1 . . . . . . . 2.40 parsed_2mlj 1
90 1 . . . . . . . 2.40 parsed_2mlj 1
91 1 . . . . . . . 3.08 parsed_2mlj 1
92 1 . . . . . . . 3.70 parsed_2mlj 1
93 1 . . . . . . . 2.46 parsed_2mlj 1
94 1 . . . . . . . 2.74 parsed_2mlj 1
95 1 . . . . . . . 2.96 parsed_2mlj 1
96 1 . . . . . . . 2.59 parsed_2mlj 1
97 1 . . . . . . . 2.83 parsed_2mlj 1
98 1 . . . . . . . 3.33 parsed_2mlj 1
99 1 . . . . . . . 2.40 parsed_2mlj 1
100 1 . . . . . . . 2.49 parsed_2mlj 1
101 1 . . . . . . . 2.77 parsed_2mlj 1
102 1 . . . . . . . 2.52 parsed_2mlj 1
103 1 . . . . . . . 2.40 parsed_2mlj 1
104 1 . . . . . . . 2.74 parsed_2mlj 1
105 1 . . . . . . . 3.47 parsed_2mlj 1
106 1 . . . . . . . 3.83 parsed_2mlj 1
107 1 . . . . . . . 2.43 parsed_2mlj 1
108 1 . . . . . . . 3.59 parsed_2mlj 1
109 1 . . . . . . . 3.08 parsed_2mlj 1
110 1 . . . . . . . 2.40 parsed_2mlj 1
111 1 . . . . . . . 2.68 parsed_2mlj 1
112 1 . . . . . . . 2.93 parsed_2mlj 1
113 1 . . . . . . . 3.02 parsed_2mlj 1
114 1 . . . . . . . 2.40 parsed_2mlj 1
115 1 . . . . . . . 2.49 parsed_2mlj 1
116 1 . . . . . . . 2.77 parsed_2mlj 1
117 1 . . . . . . . 2.77 parsed_2mlj 1
118 1 . . . . . . . 2.40 parsed_2mlj 1
119 1 . . . . . . . 2.96 parsed_2mlj 1
120 1 . . . . . . . 2.52 parsed_2mlj 1
121 1 . . . . . . . 3.78 parsed_2mlj 1
122 1 . . . . . . . 4.55 parsed_2mlj 1
123 1 . . . . . . . 2.40 parsed_2mlj 1
124 1 . . . . . . . 2.62 parsed_2mlj 1
125 1 . . . . . . . 4.16 parsed_2mlj 1
126 1 . . . . . . . 2.40 parsed_2mlj 1
127 1 . . . . . . . 2.59 parsed_2mlj 1
128 1 . . . . . . . 3.76 parsed_2mlj 1
129 1 . . . . . . . 3.51 parsed_2mlj 1
130 1 . . . . . . . 2.40 parsed_2mlj 1
131 1 . . . . . . . 3.48 parsed_2mlj 1
132 1 . . . . . . . 2.40 parsed_2mlj 1
133 1 . . . . . . . 4.41 parsed_2mlj 1
134 1 . . . . . . . 2.80 parsed_2mlj 1
135 1 . . . . . . . 2.40 parsed_2mlj 1
136 1 . . . . . . . 5.18 parsed_2mlj 1
137 1 . . . . . . . 2.71 parsed_2mlj 1
138 1 . . . . . . . 2.40 parsed_2mlj 1
139 1 . . . . . . . 2.40 parsed_2mlj 1
140 1 . . . . . . . 2.40 parsed_2mlj 1
141 1 . . . . . . . 4.84 parsed_2mlj 1
142 1 . . . . . . . 4.53 parsed_2mlj 1
143 1 . . . . . . . 2.40 parsed_2mlj 1
144 1 . . . . . . . 2.68 parsed_2mlj 1
145 1 . . . . . . . 2.40 parsed_2mlj 1
146 1 . . . . . . . 3.08 parsed_2mlj 1
147 1 . . . . . . . 2.83 parsed_2mlj 1
148 1 . . . . . . . 2.40 parsed_2mlj 1
149 1 . . . . . . . 2.40 parsed_2mlj 1
150 1 . . . . . . . 2.40 parsed_2mlj 1
151 1 . . . . . . . 2.40 parsed_2mlj 1
152 1 . . . . . . . 2.40 parsed_2mlj 1
153 1 . . . . . . . 3.70 parsed_2mlj 1
154 1 . . . . . . . 2.93 parsed_2mlj 1
155 1 . . . . . . . 2.40 parsed_2mlj 1
156 1 . . . . . . . 2.40 parsed_2mlj 1
157 1 . . . . . . . 2.40 parsed_2mlj 1
158 1 . . . . . . . 5.50 parsed_2mlj 1
159 1 . . . . . . . 2.65 parsed_2mlj 1
160 1 . . . . . . . 2.40 parsed_2mlj 1
161 1 . . . . . . . 2.68 parsed_2mlj 1
162 1 . . . . . . . 5.50 parsed_2mlj 1
163 1 . . . . . . . 2.49 parsed_2mlj 1
164 1 . . . . . . . 2.55 parsed_2mlj 1
165 1 . . . . . . . 2.46 parsed_2mlj 1
166 1 . . . . . . . 2.40 parsed_2mlj 1
167 1 . . . . . . . 2.68 parsed_2mlj 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 "DYANA Upper Limit File for molecule named: cnd512-ssa.upl" 1 1 1 60 parsed_2mlj 1
2 "based on NOESY 150 ms in H2O/D2O (9:1) at 298 K" 2 1 2 50 parsed_2mlj 1
3 "Atom names according to the convention of cyana.lib" 3 1 3 53 parsed_2mlj 1
4 "Upper limit distances produced by calibrating" 4 1 4 47 parsed_2mlj 1
5 "Germinal protons with a distance of 1.78 Angstrom" 5 1 5 51 parsed_2mlj 1
6 "After revision on the basis of stereo specific assignment" 6 1 6 59 parsed_2mlj 1
7 "Manual Input for proper geometry" 7 1 7 35 parsed_2mlj 1
8 "of side-chain/backbone peptide bond" 8 1 8 37 parsed_2mlj 1
9 "END Manual Input" 17 1 17 18 parsed_2mlj 1
10 "peak 42" 18 49 18 59 parsed_2mlj 1
11 "peak 44" 19 49 19 59 parsed_2mlj 1
12 "peak 43" 20 49 20 59 parsed_2mlj 1
13 "peak 212" 21 49 21 59 parsed_2mlj 1
14 "peak 215" 22 49 22 59 parsed_2mlj 1
15 "peak 116" 23 49 23 59 parsed_2mlj 1
16 "peak 115" 24 49 24 59 parsed_2mlj 1
17 "peak 217" 25 49 25 59 parsed_2mlj 1
18 "peak 191" 26 49 26 59 parsed_2mlj 1
19 "peak 227" 27 49 27 59 parsed_2mlj 1
20 "peak 111" 28 49 28 59 parsed_2mlj 1
21 "peak 205" 29 49 29 59 parsed_2mlj 1
22 "peak 147" 30 49 30 59 parsed_2mlj 1
23 "peak 8" 31 49 31 59 parsed_2mlj 1
24 "peak 142" 32 49 32 59 parsed_2mlj 1
25 "peak 143" 33 49 33 59 parsed_2mlj 1
26 "peak 61" 34 49 34 59 parsed_2mlj 1
27 "peak 225" 35 49 35 59 parsed_2mlj 1
28 "peak 228" 36 49 36 59 parsed_2mlj 1
29 "peak 161" 37 49 37 59 parsed_2mlj 1
30 "peak 137" 38 49 38 59 parsed_2mlj 1
31 "peak 81" 39 49 39 59 parsed_2mlj 1
32 "peak 9" 40 49 40 59 parsed_2mlj 1
33 "peak 148" 41 49 41 59 parsed_2mlj 1
34 "peak 11" 42 49 42 59 parsed_2mlj 1
35 "peak 10" 43 49 43 59 parsed_2mlj 1
36 "peak 153" 44 49 44 59 parsed_2mlj 1
37 "peak 170" 45 49 45 59 parsed_2mlj 1
38 "peak 22" 46 49 46 59 parsed_2mlj 1
39 "peak 189" 47 49 47 59 parsed_2mlj 1
40 "peak 66" 48 49 48 59 parsed_2mlj 1
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