NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
541851 |
2lie   |
17890 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 92 |
data_2lie_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lie
_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_2lie 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lie
_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 2lie "Master copy" parsed_2lie
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lie
_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 2lie.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lie 1
1 2lie.mr . . AMBER 2 distance NOE simple 2514 parsed_2lie 1
1 2lie.mr . . AMBER 3 distance "hydrogen bond" simple 92 parsed_2lie 1
1 2lie.mr . . AMBER 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lie 1
1 2lie.mr . . AMBER 5 stereochemistry chirality "Not applicable" 0 parsed_2lie 1
1 2lie.mr . . AMBER 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lie 1
1 2lie.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lie 1
stop_
save_
save_AMBER_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2lie
_Distance_constraint_list.ID 1
_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_2lie 1
2 1 . . . parsed_2lie 1
3 1 . . . parsed_2lie 1
4 1 . . . parsed_2lie 1
5 1 . . . parsed_2lie 1
6 1 . . . parsed_2lie 1
7 1 . . . parsed_2lie 1
8 1 . . . parsed_2lie 1
9 1 . . . parsed_2lie 1
10 1 . . . parsed_2lie 1
11 1 . . . parsed_2lie 1
12 1 . . . parsed_2lie 1
13 1 . . . parsed_2lie 1
14 1 . . . parsed_2lie 1
15 1 . . . parsed_2lie 1
16 1 . . . parsed_2lie 1
17 1 . . . parsed_2lie 1
18 1 . . . parsed_2lie 1
19 1 . . . parsed_2lie 1
20 1 . . . parsed_2lie 1
21 1 . . . parsed_2lie 1
22 1 . . . parsed_2lie 1
23 1 . . . parsed_2lie 1
24 1 . . . parsed_2lie 1
25 1 . . . parsed_2lie 1
26 1 . . . parsed_2lie 1
27 1 . . . parsed_2lie 1
28 1 . . . parsed_2lie 1
29 1 . . . parsed_2lie 1
30 1 . . . parsed_2lie 1
31 1 . . . parsed_2lie 1
32 1 . . . parsed_2lie 1
33 1 . . . parsed_2lie 1
34 1 . . . parsed_2lie 1
35 1 . . . parsed_2lie 1
36 1 . . . parsed_2lie 1
37 1 . . . parsed_2lie 1
38 1 . . . parsed_2lie 1
39 1 . . . parsed_2lie 1
40 1 . . . parsed_2lie 1
41 1 . . . parsed_2lie 1
42 1 . . . parsed_2lie 1
43 1 . . . parsed_2lie 1
44 1 . . . parsed_2lie 1
45 1 . . . parsed_2lie 1
46 1 . . . parsed_2lie 1
47 1 . . . parsed_2lie 1
48 1 . . . parsed_2lie 1
49 1 . . . parsed_2lie 1
50 1 . . . parsed_2lie 1
51 1 . . . parsed_2lie 1
52 1 . . . parsed_2lie 1
53 1 . . . parsed_2lie 1
54 1 . . . parsed_2lie 1
55 1 . . . parsed_2lie 1
56 1 . . . parsed_2lie 1
57 1 . . . parsed_2lie 1
58 1 . . . parsed_2lie 1
59 1 . . . parsed_2lie 1
60 1 . . . parsed_2lie 1
61 1 . . . parsed_2lie 1
62 1 . . . parsed_2lie 1
63 1 . . . parsed_2lie 1
64 1 . . . parsed_2lie 1
65 1 . . . parsed_2lie 1
66 1 . . . parsed_2lie 1
67 1 . . . parsed_2lie 1
68 1 . . . parsed_2lie 1
69 1 . . . parsed_2lie 1
70 1 . . . parsed_2lie 1
71 1 . . . parsed_2lie 1
72 1 . . . parsed_2lie 1
73 1 . . . parsed_2lie 1
74 1 . . . parsed_2lie 1
75 1 . . . parsed_2lie 1
76 1 . . . parsed_2lie 1
77 1 . . . parsed_2lie 1
78 1 . . . parsed_2lie 1
79 1 . . . parsed_2lie 1
80 1 . . . parsed_2lie 1
81 1 . . . parsed_2lie 1
82 1 . . . parsed_2lie 1
83 1 . . . parsed_2lie 1
84 1 . . . parsed_2lie 1
85 1 . . . parsed_2lie 1
86 1 . . . parsed_2lie 1
87 1 . . . parsed_2lie 1
88 1 . . . parsed_2lie 1
89 1 . . . parsed_2lie 1
90 1 . . . parsed_2lie 1
91 1 . . . parsed_2lie 1
92 1 . . . parsed_2lie 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 . . . . . . . . 2lie_ambr001 24 TYR H parsed_2lie 1
1 1 2 . . . . . . . . 2lie_ambr001 63 TRP O parsed_2lie 1
2 1 1 . . . . . . . . 2lie_ambr001 24 TYR N parsed_2lie 1
2 1 2 . . . . . . . . 2lie_ambr001 63 TRP O parsed_2lie 1
3 1 1 . . . . . . . . 2lie_ambr001 25 ILE H parsed_2lie 1
3 1 2 . . . . . . . . 2lie_ambr001 151 GLU O parsed_2lie 1
4 1 1 . . . . . . . . 2lie_ambr001 25 ILE N parsed_2lie 1
4 1 2 . . . . . . . . 2lie_ambr001 151 GLU O parsed_2lie 1
5 1 1 . . . . . . . . 2lie_ambr001 27 TYR H parsed_2lie 1
5 1 2 . . . . . . . . 2lie_ambr001 149 VAL O parsed_2lie 1
6 1 1 . . . . . . . . 2lie_ambr001 27 TYR N parsed_2lie 1
6 1 2 . . . . . . . . 2lie_ambr001 149 VAL O parsed_2lie 1
7 1 1 . . . . . . . . 2lie_ambr001 28 ASN H parsed_2lie 1
7 1 2 . . . . . . . . 2lie_ambr001 38 LEU O parsed_2lie 1
8 1 1 . . . . . . . . 2lie_ambr001 28 ASN N parsed_2lie 1
8 1 2 . . . . . . . . 2lie_ambr001 38 LEU O parsed_2lie 1
9 1 1 . . . . . . . . 2lie_ambr001 39 ALA H parsed_2lie 1
9 1 2 . . . . . . . . 2lie_ambr001 53 SER O parsed_2lie 1
10 1 1 . . . . . . . . 2lie_ambr001 39 ALA N parsed_2lie 1
10 1 2 . . . . . . . . 2lie_ambr001 53 SER O parsed_2lie 1
11 1 1 . . . . . . . . 2lie_ambr001 40 LEU H parsed_2lie 1
11 1 2 . . . . . . . . 2lie_ambr001 26 ILE O parsed_2lie 1
12 1 1 . . . . . . . . 2lie_ambr001 40 LEU N parsed_2lie 1
12 1 2 . . . . . . . . 2lie_ambr001 26 ILE O parsed_2lie 1
13 1 1 . . . . . . . . 2lie_ambr001 41 THR H parsed_2lie 1
13 1 2 . . . . . . . . 2lie_ambr001 51 THR O parsed_2lie 1
14 1 1 . . . . . . . . 2lie_ambr001 41 THR N parsed_2lie 1
14 1 2 . . . . . . . . 2lie_ambr001 51 THR O parsed_2lie 1
15 1 1 . . . . . . . . 2lie_ambr001 42 TYR H parsed_2lie 1
15 1 2 . . . . . . . . 2lie_ambr001 60 GLU O parsed_2lie 1
16 1 1 . . . . . . . . 2lie_ambr001 42 TYR N parsed_2lie 1
16 1 2 . . . . . . . . 2lie_ambr001 60 GLU O parsed_2lie 1
17 1 1 . . . . . . . . 2lie_ambr001 50 VAL H parsed_2lie 1
17 1 2 . . . . . . . . 2lie_ambr001 95 PRO O parsed_2lie 1
18 1 1 . . . . . . . . 2lie_ambr001 50 VAL N parsed_2lie 1
18 1 2 . . . . . . . . 2lie_ambr001 95 PRO O parsed_2lie 1
19 1 1 . . . . . . . . 2lie_ambr001 51 THR H parsed_2lie 1
19 1 2 . . . . . . . . 2lie_ambr001 41 THR O parsed_2lie 1
20 1 1 . . . . . . . . 2lie_ambr001 51 THR N parsed_2lie 1
20 1 2 . . . . . . . . 2lie_ambr001 41 THR O parsed_2lie 1
21 1 1 . . . . . . . . 2lie_ambr001 52 VAL H parsed_2lie 1
21 1 2 . . . . . . . . 2lie_ambr001 134 GLU O parsed_2lie 1
22 1 1 . . . . . . . . 2lie_ambr001 52 VAL N parsed_2lie 1
22 1 2 . . . . . . . . 2lie_ambr001 134 GLU O parsed_2lie 1
23 1 1 . . . . . . . . 2lie_ambr001 53 SER H parsed_2lie 1
23 1 2 . . . . . . . . 2lie_ambr001 39 ALA O parsed_2lie 1
24 1 1 . . . . . . . . 2lie_ambr001 53 SER N parsed_2lie 1
24 1 2 . . . . . . . . 2lie_ambr001 39 ALA O parsed_2lie 1
25 1 1 . . . . . . . . 2lie_ambr001 63 TRP H parsed_2lie 1
25 1 2 . . . . . . . . 2lie_ambr001 24 TYR O parsed_2lie 1
26 1 1 . . . . . . . . 2lie_ambr001 63 TRP N parsed_2lie 1
26 1 2 . . . . . . . . 2lie_ambr001 24 TYR O parsed_2lie 1
27 1 1 . . . . . . . . 2lie_ambr001 63 TRP HE1 parsed_2lie 1
27 1 2 . . . . . . . . 2lie_ambr001 40 LEU O parsed_2lie 1
28 1 1 . . . . . . . . 2lie_ambr001 63 TRP NE1 parsed_2lie 1
28 1 2 . . . . . . . . 2lie_ambr001 40 LEU O parsed_2lie 1
29 1 1 . . . . . . . . 2lie_ambr001 64 ILE H parsed_2lie 1
29 1 2 . . . . . . . . 2lie_ambr001 78 SER O parsed_2lie 1
30 1 1 . . . . . . . . 2lie_ambr001 64 ILE N parsed_2lie 1
30 1 2 . . . . . . . . 2lie_ambr001 78 SER O parsed_2lie 1
31 1 1 . . . . . . . . 2lie_ambr001 65 LEU H parsed_2lie 1
31 1 2 . . . . . . . . 2lie_ambr001 22 GLY O parsed_2lie 1
32 1 1 . . . . . . . . 2lie_ambr001 65 LEU N parsed_2lie 1
32 1 2 . . . . . . . . 2lie_ambr001 22 GLY O parsed_2lie 1
33 1 1 . . . . . . . . 2lie_ambr001 66 ARG H parsed_2lie 1
33 1 2 . . . . . . . . 2lie_ambr001 76 THR O parsed_2lie 1
34 1 1 . . . . . . . . 2lie_ambr001 66 ARG N parsed_2lie 1
34 1 2 . . . . . . . . 2lie_ambr001 76 THR O parsed_2lie 1
35 1 1 . . . . . . . . 2lie_ambr001 74 THR H parsed_2lie 1
35 1 2 . . . . . . . . 2lie_ambr001 69 ASP O parsed_2lie 1
36 1 1 . . . . . . . . 2lie_ambr001 74 THR N parsed_2lie 1
36 1 2 . . . . . . . . 2lie_ambr001 69 ASP O parsed_2lie 1
37 1 1 . . . . . . . . 2lie_ambr001 75 TRP H parsed_2lie 1
37 1 2 . . . . . . . . 2lie_ambr001 105 TRP O parsed_2lie 1
38 1 1 . . . . . . . . 2lie_ambr001 75 TRP N parsed_2lie 1
38 1 2 . . . . . . . . 2lie_ambr001 105 TRP O parsed_2lie 1
39 1 1 . . . . . . . . 2lie_ambr001 76 THR H parsed_2lie 1
39 1 2 . . . . . . . . 2lie_ambr001 66 ARG O parsed_2lie 1
40 1 1 . . . . . . . . 2lie_ambr001 76 THR N parsed_2lie 1
40 1 2 . . . . . . . . 2lie_ambr001 66 ARG O parsed_2lie 1
41 1 1 . . . . . . . . 2lie_ambr001 78 SER H parsed_2lie 1
41 1 2 . . . . . . . . 2lie_ambr001 64 ILE O parsed_2lie 1
42 1 1 . . . . . . . . 2lie_ambr001 78 SER N parsed_2lie 1
42 1 2 . . . . . . . . 2lie_ambr001 64 ILE O parsed_2lie 1
43 1 1 . . . . . . . . 2lie_ambr001 86 GLN H parsed_2lie 1
43 1 2 . . . . . . . . 2lie_ambr001 98 LEU O parsed_2lie 1
44 1 1 . . . . . . . . 2lie_ambr001 86 GLN N parsed_2lie 1
44 1 2 . . . . . . . . 2lie_ambr001 98 LEU O parsed_2lie 1
45 1 1 . . . . . . . . 2lie_ambr001 87 ILE H parsed_2lie 1
45 1 2 . . . . . . . . 2lie_ambr001 77 ILE O parsed_2lie 1
46 1 1 . . . . . . . . 2lie_ambr001 87 ILE N parsed_2lie 1
46 1 2 . . . . . . . . 2lie_ambr001 77 ILE O parsed_2lie 1
47 1 1 . . . . . . . . 2lie_ambr001 88 GLY H parsed_2lie 1
47 1 2 . . . . . . . . 2lie_ambr001 96 VAL O parsed_2lie 1
48 1 1 . . . . . . . . 2lie_ambr001 88 GLY N parsed_2lie 1
48 1 2 . . . . . . . . 2lie_ambr001 96 VAL O parsed_2lie 1
49 1 1 . . . . . . . . 2lie_ambr001 96 VAL H parsed_2lie 1
49 1 2 . . . . . . . . 2lie_ambr001 88 GLY O parsed_2lie 1
50 1 1 . . . . . . . . 2lie_ambr001 96 VAL N parsed_2lie 1
50 1 2 . . . . . . . . 2lie_ambr001 88 GLY O parsed_2lie 1
51 1 1 . . . . . . . . 2lie_ambr001 97 VAL H parsed_2lie 1
51 1 2 . . . . . . . . 2lie_ambr001 48 THR O parsed_2lie 1
52 1 1 . . . . . . . . 2lie_ambr001 97 VAL N parsed_2lie 1
52 1 2 . . . . . . . . 2lie_ambr001 48 THR O parsed_2lie 1
53 1 1 . . . . . . . . 2lie_ambr001 98 LEU H parsed_2lie 1
53 1 2 . . . . . . . . 2lie_ambr001 86 GLN O parsed_2lie 1
54 1 1 . . . . . . . . 2lie_ambr001 98 LEU N parsed_2lie 1
54 1 2 . . . . . . . . 2lie_ambr001 86 GLN O parsed_2lie 1
55 1 1 . . . . . . . . 2lie_ambr001 105 TRP H parsed_2lie 1
55 1 2 . . . . . . . . 2lie_ambr001 75 TRP O parsed_2lie 1
56 1 1 . . . . . . . . 2lie_ambr001 105 TRP N parsed_2lie 1
56 1 2 . . . . . . . . 2lie_ambr001 75 TRP O parsed_2lie 1
57 1 1 . . . . . . . . 2lie_ambr001 105 TRP HE1 parsed_2lie 1
57 1 2 . . . . . . . . 2lie_ambr001 87 ILE O parsed_2lie 1
58 1 1 . . . . . . . . 2lie_ambr001 105 TRP NE1 parsed_2lie 1
58 1 2 . . . . . . . . 2lie_ambr001 87 ILE O parsed_2lie 1
59 1 1 . . . . . . . . 2lie_ambr001 106 THR H parsed_2lie 1
59 1 2 . . . . . . . . 2lie_ambr001 117 GLN O parsed_2lie 1
60 1 1 . . . . . . . . 2lie_ambr001 106 THR N parsed_2lie 1
60 1 2 . . . . . . . . 2lie_ambr001 117 GLN O parsed_2lie 1
61 1 1 . . . . . . . . 2lie_ambr001 107 LEU H parsed_2lie 1
61 1 2 . . . . . . . . 2lie_ambr001 73 ASN O parsed_2lie 1
62 1 1 . . . . . . . . 2lie_ambr001 107 LEU N parsed_2lie 1
62 1 2 . . . . . . . . 2lie_ambr001 73 ASN O parsed_2lie 1
63 1 1 . . . . . . . . 2lie_ambr001 108 THR H parsed_2lie 1
63 1 2 . . . . . . . . 2lie_ambr001 115 ASN O parsed_2lie 1
64 1 1 . . . . . . . . 2lie_ambr001 108 THR N parsed_2lie 1
64 1 2 . . . . . . . . 2lie_ambr001 115 ASN O parsed_2lie 1
65 1 1 . . . . . . . . 2lie_ambr001 110 THR H parsed_2lie 1
65 1 2 . . . . . . . . 2lie_ambr001 113 GLY O parsed_2lie 1
66 1 1 . . . . . . . . 2lie_ambr001 110 THR N parsed_2lie 1
66 1 2 . . . . . . . . 2lie_ambr001 113 GLY O parsed_2lie 1
67 1 1 . . . . . . . . 2lie_ambr001 114 TYR H parsed_2lie 1
67 1 2 . . . . . . . . 2lie_ambr001 148 TRP O parsed_2lie 1
68 1 1 . . . . . . . . 2lie_ambr001 114 TYR N parsed_2lie 1
68 1 2 . . . . . . . . 2lie_ambr001 148 TRP O parsed_2lie 1
69 1 1 . . . . . . . . 2lie_ambr001 115 ASN H parsed_2lie 1
69 1 2 . . . . . . . . 2lie_ambr001 108 THR O parsed_2lie 1
70 1 1 . . . . . . . . 2lie_ambr001 115 ASN N parsed_2lie 1
70 1 2 . . . . . . . . 2lie_ambr001 108 THR O parsed_2lie 1
71 1 1 . . . . . . . . 2lie_ambr001 117 GLN H parsed_2lie 1
71 1 2 . . . . . . . . 2lie_ambr001 106 THR O parsed_2lie 1
72 1 1 . . . . . . . . 2lie_ambr001 117 GLN N parsed_2lie 1
72 1 2 . . . . . . . . 2lie_ambr001 106 THR O parsed_2lie 1
73 1 1 . . . . . . . . 2lie_ambr001 124 SER H parsed_2lie 1
73 1 2 . . . . . . . . 2lie_ambr001 139 GLY O parsed_2lie 1
74 1 1 . . . . . . . . 2lie_ambr001 124 SER N parsed_2lie 1
74 1 2 . . . . . . . . 2lie_ambr001 139 GLY O parsed_2lie 1
75 1 1 . . . . . . . . 2lie_ambr001 125 TRP H parsed_2lie 1
75 1 2 . . . . . . . . 2lie_ambr001 116 ILE O parsed_2lie 1
76 1 1 . . . . . . . . 2lie_ambr001 125 TRP N parsed_2lie 1
76 1 2 . . . . . . . . 2lie_ambr001 116 ILE O parsed_2lie 1
77 1 1 . . . . . . . . 2lie_ambr001 126 SER H parsed_2lie 1
77 1 2 . . . . . . . . 2lie_ambr001 137 SER O parsed_2lie 1
78 1 1 . . . . . . . . 2lie_ambr001 126 SER N parsed_2lie 1
78 1 2 . . . . . . . . 2lie_ambr001 137 SER O parsed_2lie 1
79 1 1 . . . . . . . . 2lie_ambr001 137 SER H parsed_2lie 1
79 1 2 . . . . . . . . 2lie_ambr001 126 SER O parsed_2lie 1
80 1 1 . . . . . . . . 2lie_ambr001 137 SER N parsed_2lie 1
80 1 2 . . . . . . . . 2lie_ambr001 126 SER O parsed_2lie 1
81 1 1 . . . . . . . . 2lie_ambr001 139 GLY H parsed_2lie 1
81 1 2 . . . . . . . . 2lie_ambr001 124 SER O parsed_2lie 1
82 1 1 . . . . . . . . 2lie_ambr001 139 GLY N parsed_2lie 1
82 1 2 . . . . . . . . 2lie_ambr001 124 SER O parsed_2lie 1
83 1 1 . . . . . . . . 2lie_ambr001 148 TRP H parsed_2lie 1
83 1 2 . . . . . . . . 2lie_ambr001 114 TYR O parsed_2lie 1
84 1 1 . . . . . . . . 2lie_ambr001 148 TRP N parsed_2lie 1
84 1 2 . . . . . . . . 2lie_ambr001 114 TYR O parsed_2lie 1
85 1 1 . . . . . . . . 2lie_ambr001 148 TRP HE1 parsed_2lie 1
85 1 2 . . . . . . . . 2lie_ambr001 125 TRP O parsed_2lie 1
86 1 1 . . . . . . . . 2lie_ambr001 148 TRP NE1 parsed_2lie 1
86 1 2 . . . . . . . . 2lie_ambr001 125 TRP O parsed_2lie 1
87 1 1 . . . . . . . . 2lie_ambr001 149 VAL H parsed_2lie 1
87 1 2 . . . . . . . . 2lie_ambr001 27 TYR O parsed_2lie 1
88 1 1 . . . . . . . . 2lie_ambr001 149 VAL N parsed_2lie 1
88 1 2 . . . . . . . . 2lie_ambr001 27 TYR O parsed_2lie 1
89 1 1 . . . . . . . . 2lie_ambr001 151 GLU H parsed_2lie 1
89 1 2 . . . . . . . . 2lie_ambr001 25 ILE O parsed_2lie 1
90 1 1 . . . . . . . . 2lie_ambr001 151 GLU N parsed_2lie 1
90 1 2 . . . . . . . . 2lie_ambr001 25 ILE O parsed_2lie 1
91 1 1 . . . . . . . . 2lie_ambr001 153 VAL H parsed_2lie 1
91 1 2 . . . . . . . . 2lie_ambr001 23 ASN O parsed_2lie 1
92 1 1 . . . . . . . . 2lie_ambr001 153 VAL N parsed_2lie 1
92 1 2 . . . . . . . . 2lie_ambr001 23 ASN O parsed_2lie 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
2 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
3 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
4 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
5 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
6 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
7 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
8 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
9 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
10 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
11 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
12 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
13 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
14 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
15 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
16 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
17 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
18 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
19 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
20 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
21 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
22 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
23 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
24 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
25 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
26 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
27 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
28 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
29 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
30 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
31 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
32 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
33 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
34 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
35 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
36 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
37 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
38 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
39 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
40 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
41 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
42 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
43 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
44 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
45 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
46 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
47 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
48 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
49 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
50 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
51 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
52 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
53 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
54 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
55 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
56 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
57 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
58 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
59 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
60 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
61 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
62 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
63 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
64 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
65 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
66 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
67 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
68 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
69 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
70 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
71 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
72 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
73 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
74 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
75 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
76 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
77 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
78 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
79 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
80 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
81 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
82 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
83 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
84 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
85 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
86 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
87 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
88 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
89 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
90 1 . . . . . 3.40 2.40 3.90 parsed_2lie 1
91 1 . . . . . 2.40 1.80 2.90 parsed_2lie 1
92 1 . . . . . 3.40 2.40 3.90 parsed_2lie 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 "24 TYR H 63 TRP O 1.8 2.4" 1 1 1 28 parsed_2lie 1
2 "24 TYR N 63 TRP O 2.4 3.4" 6 1 7 28 parsed_2lie 1
3 "25 ILE H 151 GLU O 1.8 2.4" 10 1 11 29 parsed_2lie 1
4 "25 ILE N 151 GLU O 2.4 3.4" 14 1 15 29 parsed_2lie 1
5 "27 TYR H 149 VAL O 1.8 2.4" 18 1 19 29 parsed_2lie 1
6 "27 TYR N 149 VAL O 2.4 3.4" 22 1 23 29 parsed_2lie 1
7 "28 ASN H 38 LEU O 1.8 2.4" 26 1 27 28 parsed_2lie 1
8 "28 ASN N 38 LEU O 2.4 3.4" 30 1 31 28 parsed_2lie 1
9 "39 ALA H 53 SER O 1.8 2.4" 34 1 35 28 parsed_2lie 1
10 "39 ALA N 53 SER O 2.4 3.4" 38 1 39 28 parsed_2lie 1
11 "40 LEU H 26 ILE O 1.8 2.4" 42 1 43 28 parsed_2lie 1
12 "40 LEU N 26 ILE O 2.4 3.4" 46 1 47 28 parsed_2lie 1
13 "41 THR H 51 THR O 1.8 2.4" 50 1 51 28 parsed_2lie 1
14 "41 THR N 51 THR O 2.4 3.4" 54 1 55 28 parsed_2lie 1
15 "42 TYR H 60 GLU O 1.8 2.4" 58 1 59 28 parsed_2lie 1
16 "42 TYR N 60 GLU O 2.4 3.4" 62 1 63 28 parsed_2lie 1
17 "50 VAL H 95 PRO O 1.8 2.4" 66 1 67 28 parsed_2lie 1
18 "50 VAL N 95 PRO O 2.4 3.4" 70 1 71 28 parsed_2lie 1
19 "51 THR H 41 THR O 1.8 2.4" 74 1 75 28 parsed_2lie 1
20 "51 THR N 41 THR O 2.4 3.4" 78 1 79 28 parsed_2lie 1
21 "52 VAL H 134 GLU O 1.8 2.4" 82 1 83 29 parsed_2lie 1
22 "52 VAL N 134 GLU O 2.4 3.4" 86 1 87 29 parsed_2lie 1
23 "53 SER H 39 ALA O 1.8 2.4" 90 1 91 28 parsed_2lie 1
24 "53 SER N 39 ALA O 2.4 3.4" 94 1 95 28 parsed_2lie 1
25 "63 TRP H 24 TYR O 1.8 2.4" 98 1 99 28 parsed_2lie 1
26 "63 TRP N 24 TYR O 2.4 3.4" 102 1 103 28 parsed_2lie 1
27 "63 TRP HE1 40 LEU O 1.8 2.4" 106 1 107 30 parsed_2lie 1
28 "63 TRP NE1 40 LEU O 2.4 3.4" 110 1 111 30 parsed_2lie 1
29 "64 ILE H 78 SER O 1.8 2.4" 114 1 115 28 parsed_2lie 1
30 "64 ILE N 78 SER O 2.4 3.4" 118 1 119 28 parsed_2lie 1
31 "65 LEU H 22 GLY O 1.8 2.4" 122 1 123 28 parsed_2lie 1
32 "65 LEU N 22 GLY O 2.4 3.4" 126 1 127 28 parsed_2lie 1
33 "66 ARG H 76 THR O 1.8 2.4" 130 1 131 28 parsed_2lie 1
34 "66 ARG N 76 THR O 2.4 3.4" 134 1 135 28 parsed_2lie 1
35 "74 THR H 69 ASP O 1.8 2.4" 138 1 139 28 parsed_2lie 1
36 "74 THR N 69 ASP O 2.4 3.4" 142 1 143 28 parsed_2lie 1
37 "75 TRP H 105 TRP O 1.8 2.4" 146 1 147 29 parsed_2lie 1
38 "75 TRP N 105 TRP O 2.4 3.4" 150 1 151 29 parsed_2lie 1
39 "76 THR H 66 ARG O 1.8 2.4" 154 1 155 28 parsed_2lie 1
40 "76 THR N 66 ARG O 2.4 3.4" 158 1 159 28 parsed_2lie 1
41 "78 SER H 64 ILE O 1.8 2.4" 162 1 163 28 parsed_2lie 1
42 "78 SER N 64 ILE O 2.4 3.4" 166 1 167 28 parsed_2lie 1
43 "86 GLN H 98 LEU O 1.8 2.4" 170 1 171 28 parsed_2lie 1
44 "86 GLN N 98 LEU O 2.4 3.4" 174 1 175 28 parsed_2lie 1
45 "87 ILE H 77 ILE O 1.8 2.4" 178 1 179 28 parsed_2lie 1
46 "87 ILE N 77 ILE O 2.4 3.4" 182 1 183 28 parsed_2lie 1
47 "88 GLY H 96 VAL O 1.8 2.4" 186 1 187 28 parsed_2lie 1
48 "88 GLY N 96 VAL O 2.4 3.4" 190 1 191 28 parsed_2lie 1
49 "96 VAL H 88 GLY O 1.8 2.4" 194 1 195 28 parsed_2lie 1
50 "96 VAL N 88 GLY O 2.4 3.4" 198 1 199 28 parsed_2lie 1
51 "97 VAL H 48 THR O 1.8 2.4" 202 1 203 28 parsed_2lie 1
52 "97 VAL N 48 THR O 2.4 3.4" 206 1 207 28 parsed_2lie 1
53 "98 LEU H 86 GLN O 1.8 2.4" 210 1 211 28 parsed_2lie 1
54 "98 LEU N 86 GLN O 2.4 3.4" 214 1 215 28 parsed_2lie 1
55 "105 TRP H 75 TRP O 1.8 2.4" 218 1 219 29 parsed_2lie 1
56 "105 TRP N 75 TRP O 2.4 3.4" 222 1 223 29 parsed_2lie 1
57 "105 TRP HE1 87 ILE O 1.8 2.4" 226 1 227 31 parsed_2lie 1
58 "105 TRP NE1 87 ILE O 2.4 3.4" 230 1 231 31 parsed_2lie 1
59 "106 THR H 117 GLN O 1.8 2.4" 234 1 235 30 parsed_2lie 1
60 "106 THR N 117 GLN O 2.4 3.4" 238 1 239 30 parsed_2lie 1
61 "107 LEU H 73 ASN O 1.8 2.4" 242 1 243 29 parsed_2lie 1
62 "107 LEU N 73 ASN O 2.4 3.4" 246 1 247 29 parsed_2lie 1
63 "108 THR H 115 ASN O 1.8 2.4" 250 1 251 30 parsed_2lie 1
64 "108 THR N 115 ASN O 2.4 3.4" 254 1 255 30 parsed_2lie 1
65 "110 THR H 113 GLY O 1.8 2.4" 258 1 259 30 parsed_2lie 1
66 "110 THR N 113 GLY O 2.4 3.4" 262 1 263 30 parsed_2lie 1
67 "114 TYR H 148 TRP O 1.8 2.4" 266 1 267 30 parsed_2lie 1
68 "114 TYR N 148 TRP O 2.4 3.4" 270 1 271 30 parsed_2lie 1
69 "115 ASN H 108 THR O 1.8 2.4" 274 1 275 30 parsed_2lie 1
70 "115 ASN N 108 THR O 2.4 3.4" 278 1 279 30 parsed_2lie 1
71 "117 GLN H 106 THR O 1.8 2.4" 282 1 283 30 parsed_2lie 1
72 "117 GLN N 106 THR O 2.4 3.4" 286 1 287 30 parsed_2lie 1
73 "124 SER H 139 GLY O 1.8 2.4" 290 1 291 30 parsed_2lie 1
74 "124 SER N 139 GLY O 2.4 3.4" 294 1 295 30 parsed_2lie 1
75 "125 TRP H 116 ILE O 1.8 2.4" 298 1 299 30 parsed_2lie 1
76 "125 TRP N 116 ILE O 2.4 3.4" 302 1 303 30 parsed_2lie 1
77 "126 SER H 137 SER O 1.8 2.4" 306 1 307 30 parsed_2lie 1
78 "126 SER N 137 SER O 2.4 3.4" 310 1 311 30 parsed_2lie 1
79 "137 SER H 126 SER O 1.8 2.4" 314 1 315 30 parsed_2lie 1
80 "137 SER N 126 SER O 2.4 3.4" 318 1 319 30 parsed_2lie 1
81 "139 GLY H 124 SER O 1.8 2.4" 322 1 323 30 parsed_2lie 1
82 "139 GLY N 124 SER O 2.4 3.4" 326 1 327 30 parsed_2lie 1
83 "148 TRP H 114 TYR O 1.8 2.4" 330 1 331 30 parsed_2lie 1
84 "148 TRP N 114 TYR O 2.4 3.4" 334 1 335 30 parsed_2lie 1
85 "148 TRP HE1 125 TRP O 1.8 2.4" 338 1 339 32 parsed_2lie 1
86 "148 TRP NE1 125 TRP O 2.4 3.4" 342 1 343 32 parsed_2lie 1
87 "149 VAL H 27 TYR O 1.8 2.4" 346 1 347 29 parsed_2lie 1
88 "149 VAL N 27 TYR O 2.4 3.4" 350 1 351 29 parsed_2lie 1
89 "151 GLU H 25 ILE O 1.8 2.4" 354 1 355 29 parsed_2lie 1
90 "151 GLU N 25 ILE O 2.4 3.4" 358 1 359 29 parsed_2lie 1
91 "153 VAL H 23 ASN O 1.8 2.4" 362 1 363 29 parsed_2lie 1
92 "153 VAL N 23 ASN O 2.4 3.4" 366 1 367 29 parsed_2lie 1
stop_
save_
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