NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
492477 |
2kc5   |
16061 | cing | 2-parsed | STAR | distance | NOE | ambi | 56 |
data_2kc5_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kc5
_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_2kc5 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kc5
_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 2kc5 "Master copy" parsed_2kc5
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kc5
_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 2kc5.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kc5 1
1 2kc5.mr . . AMBER 2 "dihedral angle" "Not applicable" "Not applicable" 94 parsed_2kc5 1
1 2kc5.mr . . AMBER 3 distance NOE ambi 56 parsed_2kc5 1
1 2kc5.mr . . AMBER 4 stereochemistry chirality "Not applicable" 0 parsed_2kc5 1
1 2kc5.mr . . AMBER 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2kc5 1
1 2kc5.mr . . AMBER 6 distance NOE ambi 0 parsed_2kc5 1
1 2kc5.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kc5 1
stop_
save_
save_AMBER_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2kc5
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_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_2kc5 1
2 1 . . . parsed_2kc5 1
3 1 . . . parsed_2kc5 1
4 1 . . . parsed_2kc5 1
5 1 . . . parsed_2kc5 1
6 1 . . . parsed_2kc5 1
7 1 . . . parsed_2kc5 1
8 1 . . . parsed_2kc5 1
9 1 . . . parsed_2kc5 1
10 1 . . . parsed_2kc5 1
11 1 . . . parsed_2kc5 1
12 1 . . . parsed_2kc5 1
13 1 . . . parsed_2kc5 1
14 1 . . . parsed_2kc5 1
15 1 . . . parsed_2kc5 1
16 1 . . . parsed_2kc5 1
17 1 . . . parsed_2kc5 1
18 1 . . . parsed_2kc5 1
19 1 . . . parsed_2kc5 1
20 1 . . . parsed_2kc5 1
21 1 . . . parsed_2kc5 1
22 1 . . . parsed_2kc5 1
23 1 . . . parsed_2kc5 1
24 1 . . . parsed_2kc5 1
25 1 . . . parsed_2kc5 1
26 1 . . . parsed_2kc5 1
27 1 . . . parsed_2kc5 1
28 1 . . . parsed_2kc5 1
29 1 . . . parsed_2kc5 1
30 1 . . . parsed_2kc5 1
31 1 . . . parsed_2kc5 1
32 1 . . . parsed_2kc5 1
33 1 . . . parsed_2kc5 1
34 1 . . . parsed_2kc5 1
35 1 . . . parsed_2kc5 1
36 1 . . . parsed_2kc5 1
37 1 . . . parsed_2kc5 1
38 1 . . . parsed_2kc5 1
39 1 . . . parsed_2kc5 1
40 1 . . . parsed_2kc5 1
41 1 . . . parsed_2kc5 1
42 1 . . . parsed_2kc5 1
43 1 . . . parsed_2kc5 1
44 1 . . . parsed_2kc5 1
45 1 . . . parsed_2kc5 1
46 1 . . . parsed_2kc5 1
47 1 . . . parsed_2kc5 1
48 1 . . . parsed_2kc5 1
49 1 . . . parsed_2kc5 1
50 1 . . . parsed_2kc5 1
51 1 . . . parsed_2kc5 1
52 1 . . . parsed_2kc5 1
53 1 . . . parsed_2kc5 1
54 1 . . . parsed_2kc5 1
55 1 . . . parsed_2kc5 1
56 1 . . . parsed_2kc5 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 . . . . . . . . 2kc5_ambr001 36 PRO HA parsed_2kc5 1
1 1 2 . . . . . . . . 2kc5_ambr001 35 HIS HD2 parsed_2kc5 1
2 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HE1 parsed_2kc5 1
2 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HE2 parsed_2kc5 1
2 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD1 parsed_2kc5 1
2 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD2 parsed_2kc5 1
3 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HA parsed_2kc5 1
3 1 1 . . . . . . . . 2kc5_ambr001 90 GLY HA2 parsed_2kc5 1
3 1 1 . . . . . . . . 2kc5_ambr001 90 GLY HA3 parsed_2kc5 1
3 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD1 parsed_2kc5 1
3 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD2 parsed_2kc5 1
4 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HB2 parsed_2kc5 1
4 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HB3 parsed_2kc5 1
4 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG2 parsed_2kc5 1
4 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG3 parsed_2kc5 1
4 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG2 parsed_2kc5 1
4 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG3 parsed_2kc5 1
4 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD1 parsed_2kc5 1
4 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD2 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE1 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE2 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE3 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 134 ILE HB parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 87 LEU HB2 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 87 LEU HB3 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 133 MET HE1 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 133 MET HE2 parsed_2kc5 1
5 1 1 . . . . . . . . 2kc5_ambr001 133 MET HE3 parsed_2kc5 1
5 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD1 parsed_2kc5 1
5 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HD2 parsed_2kc5 1
6 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG11 parsed_2kc5 1
6 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG12 parsed_2kc5 1
6 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG13 parsed_2kc5 1
6 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG21 parsed_2kc5 1
6 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG22 parsed_2kc5 1
6 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG23 parsed_2kc5 1
6 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD1 parsed_2kc5 1
6 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD2 parsed_2kc5 1
7 1 1 . . . . . . . . 2kc5_ambr001 105 TYR HB2 parsed_2kc5 1
7 1 1 . . . . . . . . 2kc5_ambr001 105 TYR HB3 parsed_2kc5 1
7 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD1 parsed_2kc5 1
7 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD2 parsed_2kc5 1
8 1 1 . . . . . . . . 2kc5_ambr001 105 TYR HB2 parsed_2kc5 1
8 1 1 . . . . . . . . 2kc5_ambr001 105 TYR HB3 parsed_2kc5 1
8 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HB parsed_2kc5 1
8 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD1 parsed_2kc5 1
8 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD2 parsed_2kc5 1
9 1 1 . . . . . . . . 2kc5_ambr001 105 TYR H parsed_2kc5 1
9 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD1 parsed_2kc5 1
9 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD2 parsed_2kc5 1
10 1 1 . . . . . . . . 2kc5_ambr001 41 TYR HE1 parsed_2kc5 1
10 1 1 . . . . . . . . 2kc5_ambr001 41 TYR HE2 parsed_2kc5 1
10 1 1 . . . . . . . . 2kc5_ambr001 17 GLN HE21 parsed_2kc5 1
10 1 1 . . . . . . . . 2kc5_ambr001 17 GLN HE22 parsed_2kc5 1
10 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD1 parsed_2kc5 1
10 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD2 parsed_2kc5 1
11 1 1 . . . . . . . . 2kc5_ambr001 127 THR HB parsed_2kc5 1
11 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD1 parsed_2kc5 1
11 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD2 parsed_2kc5 1
12 1 1 . . . . . . . . 2kc5_ambr001 57 ILE HG21 parsed_2kc5 1
12 1 1 . . . . . . . . 2kc5_ambr001 57 ILE HG22 parsed_2kc5 1
12 1 1 . . . . . . . . 2kc5_ambr001 57 ILE HG23 parsed_2kc5 1
12 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD1 parsed_2kc5 1
12 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD2 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 53 THR HG21 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 53 THR HG22 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 53 THR HG23 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 49 GLU HG2 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 49 GLU HG3 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 49 GLU HB2 parsed_2kc5 1
13 1 1 . . . . . . . . 2kc5_ambr001 49 GLU HB3 parsed_2kc5 1
13 1 2 . . . . . . . . 2kc5_ambr001 48 PHE HD1 parsed_2kc5 1
13 1 2 . . . . . . . . 2kc5_ambr001 48 PHE HD2 parsed_2kc5 1
14 1 1 . . . . . . . . 2kc5_ambr001 88 PRO HD2 parsed_2kc5 1
14 1 1 . . . . . . . . 2kc5_ambr001 88 PRO HD3 parsed_2kc5 1
14 1 2 . . . . . . . . 2kc5_ambr001 48 PHE HD1 parsed_2kc5 1
14 1 2 . . . . . . . . 2kc5_ambr001 48 PHE HD2 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 92 MET HB2 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 92 MET HB3 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE1 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE2 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE3 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 108 CYS HB2 parsed_2kc5 1
15 1 1 . . . . . . . . 2kc5_ambr001 108 CYS HB3 parsed_2kc5 1
15 1 2 . . . . . . . . 2kc5_ambr001 94 PHE HE1 parsed_2kc5 1
15 1 2 . . . . . . . . 2kc5_ambr001 94 PHE HE2 parsed_2kc5 1
16 1 1 . . . . . . . . 2kc5_ambr001 154 PHE HB2 parsed_2kc5 1
16 1 1 . . . . . . . . 2kc5_ambr001 154 PHE HB3 parsed_2kc5 1
16 1 2 . . . . . . . . 2kc5_ambr001 154 PHE HD1 parsed_2kc5 1
16 1 2 . . . . . . . . 2kc5_ambr001 154 PHE HD2 parsed_2kc5 1
17 1 1 . . . . . . . . 2kc5_ambr001 154 PHE HA parsed_2kc5 1
17 1 2 . . . . . . . . 2kc5_ambr001 154 PHE HD1 parsed_2kc5 1
17 1 2 . . . . . . . . 2kc5_ambr001 154 PHE HD2 parsed_2kc5 1
18 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HB2 parsed_2kc5 1
18 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HB3 parsed_2kc5 1
18 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HB2 parsed_2kc5 1
18 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HB3 parsed_2kc5 1
18 1 2 . . . . . . . . 2kc5_ambr001 20 PHE HD1 parsed_2kc5 1
18 1 2 . . . . . . . . 2kc5_ambr001 20 PHE HD2 parsed_2kc5 1
19 1 1 . . . . . . . . 2kc5_ambr001 45 PHE HB2 parsed_2kc5 1
19 1 1 . . . . . . . . 2kc5_ambr001 45 PHE HB3 parsed_2kc5 1
19 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD1 parsed_2kc5 1
19 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD2 parsed_2kc5 1
20 1 1 . . . . . . . . 2kc5_ambr001 54 GLY HA2 parsed_2kc5 1
20 1 1 . . . . . . . . 2kc5_ambr001 54 GLY HA3 parsed_2kc5 1
20 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD1 parsed_2kc5 1
20 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD2 parsed_2kc5 1
21 1 1 . . . . . . . . 2kc5_ambr001 55 CYS HB2 parsed_2kc5 1
21 1 1 . . . . . . . . 2kc5_ambr001 55 CYS HB3 parsed_2kc5 1
21 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE1 parsed_2kc5 1
21 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE2 parsed_2kc5 1
22 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG11 parsed_2kc5 1
22 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG12 parsed_2kc5 1
22 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG13 parsed_2kc5 1
22 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG21 parsed_2kc5 1
22 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG22 parsed_2kc5 1
22 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG23 parsed_2kc5 1
22 1 2 . . . . . . . . 2kc5_ambr001 65 VAL HA parsed_2kc5 1
23 1 1 . . . . . . . . 2kc5_ambr001 66 ILE H parsed_2kc5 1
23 1 2 . . . . . . . . 2kc5_ambr001 65 VAL HA parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 13 LYS HG2 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 13 LYS HG3 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 42 VAL HG11 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 42 VAL HG12 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 42 VAL HG13 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 42 VAL HG21 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 42 VAL HG22 parsed_2kc5 1
24 1 1 . . . . . . . . 2kc5_ambr001 42 VAL HG23 parsed_2kc5 1
24 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HE1 parsed_2kc5 1
24 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HE2 parsed_2kc5 1
25 1 1 . . . . . . . . 2kc5_ambr001 127 THR HB parsed_2kc5 1
25 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HE1 parsed_2kc5 1
25 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HE2 parsed_2kc5 1
26 1 1 . . . . . . . . 2kc5_ambr001 41 TYR HD1 parsed_2kc5 1
26 1 1 . . . . . . . . 2kc5_ambr001 41 TYR HD2 parsed_2kc5 1
26 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HE1 parsed_2kc5 1
26 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HE2 parsed_2kc5 1
27 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG2 parsed_2kc5 1
27 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG3 parsed_2kc5 1
27 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG2 parsed_2kc5 1
27 1 1 . . . . . . . . 2kc5_ambr001 133 MET HG3 parsed_2kc5 1
27 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HE1 parsed_2kc5 1
27 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HE2 parsed_2kc5 1
28 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HD1 parsed_2kc5 1
28 1 1 . . . . . . . . 2kc5_ambr001 89 TYR HD2 parsed_2kc5 1
28 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HE1 parsed_2kc5 1
28 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HE2 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 133 MET HE1 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 133 MET HE2 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 133 MET HE3 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE1 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE2 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 92 MET HE3 parsed_2kc5 1
29 1 1 . . . . . . . . 2kc5_ambr001 134 ILE HB parsed_2kc5 1
29 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HE1 parsed_2kc5 1
29 1 2 . . . . . . . . 2kc5_ambr001 89 TYR HE2 parsed_2kc5 1
30 1 1 . . . . . . . . 2kc5_ambr001 13 LYS HE2 parsed_2kc5 1
30 1 1 . . . . . . . . 2kc5_ambr001 13 LYS HE3 parsed_2kc5 1
30 1 1 . . . . . . . . 2kc5_ambr001 13 LYS HE2 parsed_2kc5 1
30 1 1 . . . . . . . . 2kc5_ambr001 13 LYS HE3 parsed_2kc5 1
30 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD1 parsed_2kc5 1
30 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD2 parsed_2kc5 1
31 1 1 . . . . . . . . 2kc5_ambr001 47 LEU HA parsed_2kc5 1
31 1 2 . . . . . . . . 2kc5_ambr001 48 PHE HD1 parsed_2kc5 1
31 1 2 . . . . . . . . 2kc5_ambr001 48 PHE HD2 parsed_2kc5 1
32 1 1 . . . . . . . . 2kc5_ambr001 45 PHE H parsed_2kc5 1
32 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD1 parsed_2kc5 1
32 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD2 parsed_2kc5 1
33 1 1 . . . . . . . . 2kc5_ambr001 61 MET HB2 parsed_2kc5 1
33 1 1 . . . . . . . . 2kc5_ambr001 61 MET HB3 parsed_2kc5 1
33 1 2 . . . . . . . . 2kc5_ambr001 60 TRP HD1 parsed_2kc5 1
34 1 1 . . . . . . . . 2kc5_ambr001 75 PRO HG2 parsed_2kc5 1
34 1 1 . . . . . . . . 2kc5_ambr001 75 PRO HG3 parsed_2kc5 1
34 1 1 . . . . . . . . 2kc5_ambr001 75 PRO HG2 parsed_2kc5 1
34 1 1 . . . . . . . . 2kc5_ambr001 75 PRO HG3 parsed_2kc5 1
34 1 2 . . . . . . . . 2kc5_ambr001 74 TRP HD1 parsed_2kc5 1
35 1 1 . . . . . . . . 2kc5_ambr001 74 TRP HE1 parsed_2kc5 1
35 1 2 . . . . . . . . 2kc5_ambr001 74 TRP HD1 parsed_2kc5 1
36 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG11 parsed_2kc5 1
36 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG12 parsed_2kc5 1
36 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG13 parsed_2kc5 1
36 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG21 parsed_2kc5 1
36 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG22 parsed_2kc5 1
36 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG23 parsed_2kc5 1
36 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HE1 parsed_2kc5 1
36 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HE2 parsed_2kc5 1
37 1 1 . . . . . . . . 2kc5_ambr001 108 CYS H parsed_2kc5 1
37 1 2 . . . . . . . . 2kc5_ambr001 107 SER HA parsed_2kc5 1
38 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG11 parsed_2kc5 1
38 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG12 parsed_2kc5 1
38 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG13 parsed_2kc5 1
38 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG21 parsed_2kc5 1
38 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG22 parsed_2kc5 1
38 1 1 . . . . . . . . 2kc5_ambr001 65 VAL HG23 parsed_2kc5 1
38 1 2 . . . . . . . . 2kc5_ambr001 107 SER HA parsed_2kc5 1
39 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HD1 parsed_2kc5 1
39 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HD2 parsed_2kc5 1
39 1 2 . . . . . . . . 2kc5_ambr001 60 TRP HZ2 parsed_2kc5 1
40 1 1 . . . . . . . . 2kc5_ambr001 40 VAL HG11 parsed_2kc5 1
40 1 1 . . . . . . . . 2kc5_ambr001 40 VAL HG12 parsed_2kc5 1
40 1 1 . . . . . . . . 2kc5_ambr001 40 VAL HG13 parsed_2kc5 1
40 1 1 . . . . . . . . 2kc5_ambr001 40 VAL HG21 parsed_2kc5 1
40 1 1 . . . . . . . . 2kc5_ambr001 40 VAL HG22 parsed_2kc5 1
40 1 1 . . . . . . . . 2kc5_ambr001 40 VAL HG23 parsed_2kc5 1
40 1 2 . . . . . . . . 2kc5_ambr001 60 TRP HZ2 parsed_2kc5 1
41 1 1 . . . . . . . . 2kc5_ambr001 24 ALA HB1 parsed_2kc5 1
41 1 1 . . . . . . . . 2kc5_ambr001 24 ALA HB2 parsed_2kc5 1
41 1 1 . . . . . . . . 2kc5_ambr001 24 ALA HB3 parsed_2kc5 1
41 1 1 . . . . . . . . 2kc5_ambr001 61 MET HE1 parsed_2kc5 1
41 1 1 . . . . . . . . 2kc5_ambr001 61 MET HE2 parsed_2kc5 1
41 1 1 . . . . . . . . 2kc5_ambr001 61 MET HE3 parsed_2kc5 1
41 1 2 . . . . . . . . 2kc5_ambr001 60 TRP HZ2 parsed_2kc5 1
42 1 1 . . . . . . . . 2kc5_ambr001 41 TYR HB2 parsed_2kc5 1
42 1 1 . . . . . . . . 2kc5_ambr001 41 TYR HB3 parsed_2kc5 1
42 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD1 parsed_2kc5 1
42 1 2 . . . . . . . . 2kc5_ambr001 41 TYR HD2 parsed_2kc5 1
43 1 1 . . . . . . . . 2kc5_ambr001 74 TRP HA parsed_2kc5 1
43 1 2 . . . . . . . . 2kc5_ambr001 74 TRP HD1 parsed_2kc5 1
44 1 1 . . . . . . . . 2kc5_ambr001 105 TYR HE1 parsed_2kc5 1
44 1 1 . . . . . . . . 2kc5_ambr001 105 TYR HE2 parsed_2kc5 1
44 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD1 parsed_2kc5 1
44 1 2 . . . . . . . . 2kc5_ambr001 105 TYR HD2 parsed_2kc5 1
45 1 1 . . . . . . . . 2kc5_ambr001 60 TRP HE1 parsed_2kc5 1
45 1 2 . . . . . . . . 2kc5_ambr001 60 TRP HD1 parsed_2kc5 1
46 1 1 . . . . . . . . 2kc5_ambr001 54 GLY H parsed_2kc5 1
46 1 1 . . . . . . . . 2kc5_ambr001 45 PHE H parsed_2kc5 1
46 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE1 parsed_2kc5 1
46 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE2 parsed_2kc5 1
47 1 1 . . . . . . . . 2kc5_ambr001 128 ASP HA parsed_2kc5 1
47 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD1 parsed_2kc5 1
47 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD2 parsed_2kc5 1
48 1 1 . . . . . . . . 2kc5_ambr001 128 ASP HA parsed_2kc5 1
48 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE1 parsed_2kc5 1
48 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE2 parsed_2kc5 1
49 1 1 . . . . . . . . 2kc5_ambr001 45 PHE HA parsed_2kc5 1
49 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD1 parsed_2kc5 1
49 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HD2 parsed_2kc5 1
50 1 1 . . . . . . . . 2kc5_ambr001 55 CYS HA parsed_2kc5 1
50 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE1 parsed_2kc5 1
50 1 2 . . . . . . . . 2kc5_ambr001 45 PHE HE2 parsed_2kc5 1
51 1 1 . . . . . . . . 2kc5_ambr001 8 PHE H parsed_2kc5 1
51 1 2 . . . . . . . . 2kc5_ambr001 8 PHE HD1 parsed_2kc5 1
51 1 2 . . . . . . . . 2kc5_ambr001 8 PHE HD2 parsed_2kc5 1
52 1 1 . . . . . . . . 2kc5_ambr001 9 GLN HB2 parsed_2kc5 1
52 1 1 . . . . . . . . 2kc5_ambr001 9 GLN HB3 parsed_2kc5 1
52 1 2 . . . . . . . . 2kc5_ambr001 8 PHE HD1 parsed_2kc5 1
52 1 2 . . . . . . . . 2kc5_ambr001 8 PHE HD2 parsed_2kc5 1
53 1 1 . . . . . . . . 2kc5_ambr001 20 PHE HA parsed_2kc5 1
53 1 2 . . . . . . . . 2kc5_ambr001 20 PHE HD1 parsed_2kc5 1
53 1 2 . . . . . . . . 2kc5_ambr001 20 PHE HD2 parsed_2kc5 1
54 1 1 . . . . . . . . 2kc5_ambr001 20 PHE H parsed_2kc5 1
54 1 2 . . . . . . . . 2kc5_ambr001 20 PHE HD1 parsed_2kc5 1
54 1 2 . . . . . . . . 2kc5_ambr001 20 PHE HD2 parsed_2kc5 1
55 1 1 . . . . . . . . 2kc5_ambr001 154 PHE HA parsed_2kc5 1
55 1 2 . . . . . . . . 2kc5_ambr001 154 PHE HD1 parsed_2kc5 1
55 1 2 . . . . . . . . 2kc5_ambr001 154 PHE HD2 parsed_2kc5 1
56 1 1 . . . . . . . . 2kc5_ambr001 85 LEU HG parsed_2kc5 1
56 1 1 . . . . . . . . 2kc5_ambr001 64 ALA HB1 parsed_2kc5 1
56 1 1 . . . . . . . . 2kc5_ambr001 64 ALA HB2 parsed_2kc5 1
56 1 1 . . . . . . . . 2kc5_ambr001 64 ALA HB3 parsed_2kc5 1
56 1 2 . . . . . . . . 2kc5_ambr001 94 PHE HD1 parsed_2kc5 1
56 1 2 . . . . . . . . 2kc5_ambr001 94 PHE HD2 parsed_2kc5 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.50 1.80 6.25 parsed_2kc5 1
2 1 . 4 . . . 5.67 1.80 6.42 parsed_2kc5 1
3 1 . 5 . . . 7.41 1.80 8.16 parsed_2kc5 1
4 1 . 7 . . . 8.32 1.80 9.07 parsed_2kc5 1
5 1 . 8 . . . 8.90 1.80 9.65 parsed_2kc5 1
6 1 . 15 . . . 8.32 1.80 9.07 parsed_2kc5 1
7 1 . 16 . . . 6.93 1.80 7.68 parsed_2kc5 1
8 1 . 17 . . . 7.41 1.80 8.16 parsed_2kc5 1
9 1 . 18 . . . 6.17 1.80 6.92 parsed_2kc5 1
10 1 . 19 . . . 7.78 1.80 8.53 parsed_2kc5 1
11 1 . 20 . . . 6.17 1.80 6.92 parsed_2kc5 1
12 1 . 22 . . . 7.41 1.80 8.16 parsed_2kc5 1
13 1 . 26 . . . 8.54 1.80 9.29 parsed_2kc5 1
14 1 . 28 . . . 6.93 1.80 7.68 parsed_2kc5 1
15 1 . 34 . . . 8.54 1.80 9.29 parsed_2kc5 1
16 1 . 35 . . . 6.93 1.80 7.68 parsed_2kc5 1
17 1 . 36 . . . 6.17 1.80 6.92 parsed_2kc5 1
18 1 . 39 . . . 7.78 1.80 8.53 parsed_2kc5 1
19 1 . 44 . . . 6.93 1.80 7.68 parsed_2kc5 1
20 1 . 45 . . . 6.93 1.80 7.68 parsed_2kc5 1
21 1 . 47 . . . 6.93 1.80 7.68 parsed_2kc5 1
22 1 . 62 . . . 7.41 1.80 8.16 parsed_2kc5 1
23 1 . 63 . . . 5.50 1.80 6.25 parsed_2kc5 1
24 1 . 64 . . . 8.73 1.80 9.48 parsed_2kc5 1
25 1 . 65 . . . 6.17 1.80 6.92 parsed_2kc5 1
26 1 . 67 . . . 6.93 1.80 7.68 parsed_2kc5 1
27 1 . 69 . . . 7.78 1.80 8.53 parsed_2kc5 1
28 1 . 70 . . . 5.67 1.80 6.42 parsed_2kc5 1
29 1 . 71 . . . 8.54 1.80 9.29 parsed_2kc5 1
30 1 . 74 . . . 7.78 1.80 8.53 parsed_2kc5 1
31 1 . 75 . . . 6.17 1.80 6.92 parsed_2kc5 1
32 1 . 80 . . . 6.17 1.80 6.92 parsed_2kc5 1
33 1 . 81 . . . 6.17 1.80 6.92 parsed_2kc5 1
34 1 . 87 . . . 6.93 1.80 7.68 parsed_2kc5 1
35 1 . 88 . . . 5.50 1.80 6.25 parsed_2kc5 1
36 1 . 91 . . . 8.32 1.80 9.07 parsed_2kc5 1
37 1 . 92 . . . 5.50 1.80 6.25 parsed_2kc5 1
38 1 . 93 . . . 7.41 1.80 8.16 parsed_2kc5 1
39 1 . 94 . . . 6.17 1.80 6.92 parsed_2kc5 1
40 1 . 95 . . . 7.41 1.80 8.16 parsed_2kc5 1
41 1 . 96 . . . 7.41 1.80 8.16 parsed_2kc5 1
42 1 . 101 . . . 6.93 1.80 7.68 parsed_2kc5 1
43 1 . 102 . . . 5.50 1.80 6.25 parsed_2kc5 1
44 1 . 105 . . . 6.93 1.80 7.68 parsed_2kc5 1
45 1 . 107 . . . 5.50 1.80 6.25 parsed_2kc5 1
46 1 . 111 . . . 6.93 1.80 7.68 parsed_2kc5 1
47 1 . 112 . . . 6.17 1.80 6.92 parsed_2kc5 1
48 1 . 113 . . . 6.17 1.80 6.92 parsed_2kc5 1
49 1 . 114 . . . 6.17 1.80 6.92 parsed_2kc5 1
50 1 . 115 . . . 6.17 1.80 6.92 parsed_2kc5 1
51 1 . 116 . . . 6.17 1.80 6.92 parsed_2kc5 1
52 1 . 118 . . . 6.93 1.80 7.68 parsed_2kc5 1
53 1 . 120 . . . 6.17 1.80 6.92 parsed_2kc5 1
54 1 . 121 . . . 6.17 1.80 6.92 parsed_2kc5 1
55 1 . 124 . . . 6.17 1.80 6.92 parsed_2kc5 1
56 1 . 125 . . . 7.78 1.80 8.53 parsed_2kc5 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 "36 PRO HA 35 HIS HD2 5.50 (# 0:20 Unique 3.15, 4.98 A)" 1 1 2 96 parsed_2kc5 1
2 "89 TYR HE 89 TYR HD 4.50 (# 4:20 Unique 2.44, 3.73 A)" 7 1 8 96 parsed_2kc5 1
3 "0 AMB 20-3:5 89 TYR HD 5.50 (# 5:20 Single Ambig)" 14 1 15 81 parsed_2kc5 1
4 "0 AMB 20-3:7 89 TYR HD 5.50 (# 7:20 Single Ambig)" 21 1 22 81 parsed_2kc5 1
5 "0 AMB 20-3:8 89 TYR HD 5.50 (# 8:20 Single Ambig)" 28 1 29 81 parsed_2kc5 1
6 "65 VAL MGY 105 TYR HD 5.50 (# 15:20 Unique 2.26, 6.07 A)" 35 1 36 96 parsed_2kc5 1
7 "105 TYR HB- 105 TYR HD 5.50 (# 16:20 Unique 2.29, 3.10 A)" 42 1 43 96 parsed_2kc5 1
8 "0 AMB 20-3:17 105 TYR HD 5.50 (# 17:20 Single Ambig)" 49 1 50 81 parsed_2kc5 1
9 "105 TYR HN 105 TYR HD 5.50 (# 18:20 Unique 2.01, 3.79 A)" 56 1 57 96 parsed_2kc5 1
10 "0 AMB 20-3:19 41 TYR HD 5.50 (# 19:20 Single Ambig)" 62 1 63 81 parsed_2kc5 1
11 "127 THR HB 41 TYR HD 5.50 (# 20:20 Unique 2.25, 4.61 A)" 69 1 70 96 parsed_2kc5 1
12 "57 ILE MG2 41 TYR HD 5.50 (# 22:20 Unique 2.48, 5.11 A)" 75 1 76 96 parsed_2kc5 1
13 "0 AMB 20-3:26 48 PHE HD 5.50 (# 26:20 Single Ambig)" 82 1 83 81 parsed_2kc5 1
14 "88 PRO HD+ 48 PHE HD 5.50 (# 28:20 Unique 2.27, 5.14 A)" 89 1 90 96 parsed_2kc5 1
15 "0 AMB 20-3:34 94 PHE HE 5.50 (# 34:20 Single Ambig)" 96 1 97 81 parsed_2kc5 1
16 "154 PHE HB+ 154 PHE HD 5.50 (# 35:20 Unique 2.32, 3.09 A)" 103 1 104 96 parsed_2kc5 1
17 "154 PHE HA 154 PHE HD 5.50 (# 36:20 Unique 2.34, 3.62 A)" 110 1 111 96 parsed_2kc5 1
18 "0 AMB 20-3:39 20 PHE HD 5.50 (# 39:20 Single Ambig)" 116 1 117 81 parsed_2kc5 1
19 "45 PHE HB+ 45 PHE HD 5.50 (# 44:20 Unique 2.29, 3.07 A)" 123 1 124 96 parsed_2kc5 1
20 "54 GLY HA- 45 PHE HD 5.50 (# 45:20 Unique 2.01, 4.99 A)" 130 1 131 96 parsed_2kc5 1
21 "55 CYS HB+ 45 PHE HE 5.50 (# 47:20 Unique 2.67, 6.09 A)" 137 1 138 96 parsed_2kc5 1
22 "65 VAL MGY 65 VAL HA 5.50 (# 62:20 Unique 2.37, 3.49 A)" 144 1 145 96 parsed_2kc5 1
23 "66 ILE HN 65 VAL HA 5.50 (# 63:20 Unique 2.23, 2.28 A)" 150 1 151 96 parsed_2kc5 1
24 "0 AMB 20-3:64 41 TYR HE 5.50 (# 64:20 Single Ambig)" 154 1 155 81 parsed_2kc5 1
25 "127 THR HB 41 TYR HE 5.50 (# 65:20 Unique 2.19, 4.66 A)" 161 1 162 96 parsed_2kc5 1
26 "41 TYR HD 41 TYR HE 5.50 (# 67:20 Unique 2.47, 3.73 A)" 167 1 168 96 parsed_2kc5 1
27 "0 AMB 20-3:69 89 TYR HE 5.50 (# 69:20 Single Ambig)" 174 1 175 81 parsed_2kc5 1
28 "89 TYR HD 89 TYR HE 4.50 (# 70:20 Unique 2.44, 3.73 A)" 181 1 182 96 parsed_2kc5 1
29 "0 AMB 20-3:71 89 TYR HE 5.50 (# 71:20 Single Ambig)" 188 1 189 81 parsed_2kc5 1
30 "0 AMB 20-3:74 41 TYR HD 5.50 (# 74:20 Single Ambig)" 195 1 196 81 parsed_2kc5 1
31 "47 LEU HA 48 PHE HD 5.50 (# 75:20 Unique 3.73, 5.95 A)" 202 1 203 96 parsed_2kc5 1
32 "45 PHE HN 45 PHE HD 5.50 (# 80:20 Unique 2.67, 4.10 A)" 208 1 209 96 parsed_2kc5 1
33 "61 MET HB- 60 TRP HD1 5.50 (# 81:20 Unique 3.41, 5.77 A)" 214 1 215 96 parsed_2kc5 1
34 "0 AMB 20-3:87 74 TRP HD1 5.50 (# 87:20 Single Ambig)" 220 1 221 81 parsed_2kc5 1
35 "74 TRP HE1 74 TRP HD1 5.50 (# 88:20 Unique 2.53, 2.55 A)" 226 1 227 96 parsed_2kc5 1
36 "65 VAL MGY 105 TYR HE 5.50 (# 91:20 Unique 2.26, 5.77 A)" 230 1 231 96 parsed_2kc5 1
37 "108 CYS HN 107 SER HA 5.50 (# 92:20 Unique 2.26, 2.31 A)" 237 1 238 96 parsed_2kc5 1
38 "65 VAL MGY 107 SER HA 5.50 (# 93:20 Unique 2.44, 4.85 A)" 241 1 242 96 parsed_2kc5 1
39 "20 PHE HD 60 TRP HZ2 5.50 (# 94:20 Unique 2.57, 5.46 A)" 247 1 248 96 parsed_2kc5 1
40 "40 VAL MGX 60 TRP HZ2 5.50 (# 95:20 Unique 5.48, 7.76 A)" 253 1 254 96 parsed_2kc5 1
41 "0 AMB 20-3:96 60 TRP HZ2 5.50 (# 96:20 Single Ambig)" 259 1 260 81 parsed_2kc5 1
42 "41 TYR HB+ 41 TYR HD 5.50 (# 101:20 Unique 2.34, 3.08 A)" 265 1 266 96 parsed_2kc5 1
43 "74 TRP HA 74 TRP HD1 5.50 (# 102:20 Unique 2.33, 2.67 A)" 272 1 273 96 parsed_2kc5 1
44 "105 TYR HE 105 TYR HD 5.50 (# 105:20 Unique 2.44, 3.72 A)" 276 1 277 96 parsed_2kc5 1
45 "60 TRP HE1 60 TRP HD1 5.50 (# 107:20 Unique 2.52, 2.55 A)" 283 1 284 96 parsed_2kc5 1
46 "0 AMB 20-3:111 45 PHE HE 5.50 (# 111:20 Single Ambig)" 287 1 288 81 parsed_2kc5 1
47 "128 ASP HA 45 PHE HD 5.50 (# 112:20 Unique 4.97, 6.40 A)" 294 1 295 96 parsed_2kc5 1
48 "128 ASP HA 45 PHE HE 5.50 (# 113:20 Unique 2.54, 5.51 A)" 300 1 301 96 parsed_2kc5 1
49 "45 PHE HA 45 PHE HD 5.50 (# 114:20 Unique 2.82, 3.89 A)" 306 1 307 96 parsed_2kc5 1
50 "55 CYS HA 45 PHE HE 5.50 (# 115:20 Unique 3.85, 6.85 A)" 312 1 313 96 parsed_2kc5 1
51 "8 PHE HN 8 PHE HD 5.50 (# 116:20 Unique 2.28, 3.75 A)" 318 1 319 96 parsed_2kc5 1
52 "9 GLN HB- 8 PHE HD 5.50 (# 118:20 Unique 5.73, 7.62 A)" 324 1 325 96 parsed_2kc5 1
53 "20 PHE HA 20 PHE HD 5.50 (# 120:20 Unique 2.36, 3.28 A)" 331 1 332 96 parsed_2kc5 1
54 "20 PHE HN 20 PHE HD 5.50 (# 121:20 Unique 3.04, 4.11 A)" 337 1 338 96 parsed_2kc5 1
55 "154 PHE HA 154 PHE HD 5.50 (# 124:20 Unique 2.34, 3.62 A)" 343 1 344 96 parsed_2kc5 1
56 "0 AMB 20-3:125 94 PHE HD 5.50 (# 125:20 Single Ambig)" 349 1 350 81 parsed_2kc5 1
stop_
save_
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