Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
29262 | 1aot RC | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 64 |
data_1aot_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1aot
_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_1aot 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1aot
_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 1aot "Master copy" parsed_1aot
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1aot
_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 1aot.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1aot 1
1 1aot.mr . . XPLOR/CNS 2 distance NOE simple 1400 parsed_1aot 1
1 1aot.mr . . XPLOR/CNS 3 distance NOE ambi 105 parsed_1aot 1
1 1aot.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 64 parsed_1aot 1
1 1aot.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1aot 1
1 1aot.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1aot 1
1 1aot.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1aot 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1aot
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_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_1aot 1
2 1 . . . parsed_1aot 1
3 1 . . . parsed_1aot 1
4 1 . . . parsed_1aot 1
5 1 . . . parsed_1aot 1
6 1 . . . parsed_1aot 1
7 1 . . . parsed_1aot 1
8 1 . . . parsed_1aot 1
9 1 . . . parsed_1aot 1
10 1 . . . parsed_1aot 1
11 1 . . . parsed_1aot 1
12 1 . . . parsed_1aot 1
13 1 . . . parsed_1aot 1
14 1 . . . parsed_1aot 1
15 1 . . . parsed_1aot 1
16 1 . . . parsed_1aot 1
17 1 . . . parsed_1aot 1
18 1 . . . parsed_1aot 1
19 1 . . . parsed_1aot 1
20 1 . . . parsed_1aot 1
21 1 . . . parsed_1aot 1
22 1 . . . parsed_1aot 1
23 1 . . . parsed_1aot 1
24 1 . . . parsed_1aot 1
25 1 . . . parsed_1aot 1
26 1 . . . parsed_1aot 1
27 1 . . . parsed_1aot 1
28 1 . . . parsed_1aot 1
29 1 . . . parsed_1aot 1
30 1 . . . parsed_1aot 1
31 1 . . . parsed_1aot 1
32 1 . . . parsed_1aot 1
33 1 . . . parsed_1aot 1
34 1 . . . parsed_1aot 1
35 1 . . . parsed_1aot 1
36 1 . . . parsed_1aot 1
37 1 . . . parsed_1aot 1
38 1 . . . parsed_1aot 1
39 1 . . . parsed_1aot 1
40 1 . . . parsed_1aot 1
41 1 . . . parsed_1aot 1
42 1 . . . parsed_1aot 1
43 1 . . . parsed_1aot 1
44 1 . . . parsed_1aot 1
45 1 . . . parsed_1aot 1
46 1 . . . parsed_1aot 1
47 1 . . . parsed_1aot 1
48 1 . . . parsed_1aot 1
49 1 . . . parsed_1aot 1
50 1 . . . parsed_1aot 1
51 1 . . . parsed_1aot 1
52 1 . . . parsed_1aot 1
53 1 . . . parsed_1aot 1
54 1 . . . parsed_1aot 1
55 1 . . . parsed_1aot 1
56 1 . . . parsed_1aot 1
57 1 . . . parsed_1aot 1
58 1 . . . parsed_1aot 1
59 1 . . . parsed_1aot 1
60 1 . . . parsed_1aot 1
61 1 . . . parsed_1aot 1
62 1 . . . parsed_1aot 1
63 1 . . . parsed_1aot 1
64 1 . . . parsed_1aot 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 . . . . . . . . fSH2 9 . hn parsed_1aot 1
1 1 2 . . . . . . . . fSH2 33 . o parsed_1aot 1
2 1 1 . . . . . . . . fSH2 9 . n parsed_1aot 1
2 1 2 . . . . . . . . fSH2 33 . o parsed_1aot 1
3 1 1 . . . . . . . . fSH2 18 . hn parsed_1aot 1
3 1 2 . . . . . . . . fSH2 14 . o parsed_1aot 1
4 1 1 . . . . . . . . fSH2 18 . n parsed_1aot 1
4 1 2 . . . . . . . . fSH2 14 . o parsed_1aot 1
5 1 1 . . . . . . . . fSH2 19 . hn parsed_1aot 1
5 1 2 . . . . . . . . fSH2 15 . o parsed_1aot 1
6 1 1 . . . . . . . . fSH2 19 . n parsed_1aot 1
6 1 2 . . . . . . . . fSH2 15 . o parsed_1aot 1
7 1 1 . . . . . . . . fSH2 20 . hn parsed_1aot 1
7 1 2 . . . . . . . . fSH2 16 . o parsed_1aot 1
8 1 1 . . . . . . . . fSH2 20 . n parsed_1aot 1
8 1 2 . . . . . . . . fSH2 16 . o parsed_1aot 1
9 1 1 . . . . . . . . fSH2 21 . hn parsed_1aot 1
9 1 2 . . . . . . . . fSH2 17 . o parsed_1aot 1
10 1 1 . . . . . . . . fSH2 21 . n parsed_1aot 1
10 1 2 . . . . . . . . fSH2 17 . o parsed_1aot 1
11 1 1 . . . . . . . . fSH2 22 . hn parsed_1aot 1
11 1 2 . . . . . . . . fSH2 18 . o parsed_1aot 1
12 1 1 . . . . . . . . fSH2 22 . n parsed_1aot 1
12 1 2 . . . . . . . . fSH2 18 . o parsed_1aot 1
13 1 1 . . . . . . . . fSH2 23 . hn parsed_1aot 1
13 1 2 . . . . . . . . fSH2 19 . o parsed_1aot 1
14 1 1 . . . . . . . . fSH2 23 . n parsed_1aot 1
14 1 2 . . . . . . . . fSH2 19 . o parsed_1aot 1
15 1 1 . . . . . . . . fSH2 32 . hn parsed_1aot 1
15 1 2 . . . . . . . . fSH2 46 . o parsed_1aot 1
16 1 1 . . . . . . . . fSH2 32 . n parsed_1aot 1
16 1 2 . . . . . . . . fSH2 46 . o parsed_1aot 1
17 1 1 . . . . . . . . fSH2 34 . hn parsed_1aot 1
17 1 2 . . . . . . . . fSH2 44 . o parsed_1aot 1
18 1 1 . . . . . . . . fSH2 34 . n parsed_1aot 1
18 1 2 . . . . . . . . fSH2 44 . o parsed_1aot 1
19 1 1 . . . . . . . . fSH2 35 . hn parsed_1aot 1
19 1 2 . . . . . . . . fSH2 10 . o parsed_1aot 1
20 1 1 . . . . . . . . fSH2 35 . n parsed_1aot 1
20 1 2 . . . . . . . . fSH2 10 . o parsed_1aot 1
21 1 1 . . . . . . . . fSH2 36 . hn parsed_1aot 1
21 1 2 . . . . . . . . fSH2 42 . o parsed_1aot 1
22 1 1 . . . . . . . . fSH2 36 . n parsed_1aot 1
22 1 2 . . . . . . . . fSH2 42 . o parsed_1aot 1
23 1 1 . . . . . . . . fSH2 45 . hn parsed_1aot 1
23 1 2 . . . . . . . . fSH2 61 . o parsed_1aot 1
24 1 1 . . . . . . . . fSH2 45 . n parsed_1aot 1
24 1 2 . . . . . . . . fSH2 61 . o parsed_1aot 1
25 1 1 . . . . . . . . fSH2 47 . hn parsed_1aot 1
25 1 2 . . . . . . . . fSH2 59 . o parsed_1aot 1
26 1 1 . . . . . . . . fSH2 47 . n parsed_1aot 1
26 1 2 . . . . . . . . fSH2 59 . o parsed_1aot 1
27 1 1 . . . . . . . . fSH2 48 . hn parsed_1aot 1
27 1 2 . . . . . . . . fSH2 30 . o parsed_1aot 1
28 1 1 . . . . . . . . fSH2 48 . n parsed_1aot 1
28 1 2 . . . . . . . . fSH2 30 . o parsed_1aot 1
29 1 1 . . . . . . . . fSH2 49 . hn parsed_1aot 1
29 1 2 . . . . . . . . fSH2 57 . o parsed_1aot 1
30 1 1 . . . . . . . . fSH2 49 . n parsed_1aot 1
30 1 2 . . . . . . . . fSH2 57 . o parsed_1aot 1
31 1 1 . . . . . . . . fSH2 51 . hn parsed_1aot 1
31 1 2 . . . . . . . . fSH2 55 . o parsed_1aot 1
32 1 1 . . . . . . . . fSH2 51 . n parsed_1aot 1
32 1 2 . . . . . . . . fSH2 55 . o parsed_1aot 1
33 1 1 . . . . . . . . fSH2 59 . hn parsed_1aot 1
33 1 2 . . . . . . . . fSH2 47 . o parsed_1aot 1
34 1 1 . . . . . . . . fSH2 59 . n parsed_1aot 1
34 1 2 . . . . . . . . fSH2 47 . o parsed_1aot 1
35 1 1 . . . . . . . . fSH2 61 . hn parsed_1aot 1
35 1 2 . . . . . . . . fSH2 45 . o parsed_1aot 1
36 1 1 . . . . . . . . fSH2 61 . n parsed_1aot 1
36 1 2 . . . . . . . . fSH2 45 . o parsed_1aot 1
37 1 1 . . . . . . . . fSH2 63 . hn parsed_1aot 1
37 1 2 . . . . . . . . fSH2 43 . o parsed_1aot 1
38 1 1 . . . . . . . . fSH2 63 . n parsed_1aot 1
38 1 2 . . . . . . . . fSH2 43 . o parsed_1aot 1
39 1 1 . . . . . . . . fSH2 64 . hn parsed_1aot 1
39 1 2 . . . . . . . . fSH2 72 . o parsed_1aot 1
40 1 1 . . . . . . . . fSH2 64 . n parsed_1aot 1
40 1 2 . . . . . . . . fSH2 72 . o parsed_1aot 1
41 1 1 . . . . . . . . fSH2 66 . hn parsed_1aot 1
41 1 2 . . . . . . . . fSH2 70 . o parsed_1aot 1
42 1 1 . . . . . . . . fSH2 66 . n parsed_1aot 1
42 1 2 . . . . . . . . fSH2 70 . o parsed_1aot 1
43 1 1 . . . . . . . . fSH2 71 . hn parsed_1aot 1
43 1 2 . . . . . . . . fSH2 79 . o parsed_1aot 1
44 1 1 . . . . . . . . fSH2 71 . n parsed_1aot 1
44 1 2 . . . . . . . . fSH2 79 . o parsed_1aot 1
45 1 1 . . . . . . . . fSH2 72 . hn parsed_1aot 1
45 1 2 . . . . . . . . fSH2 64 . o parsed_1aot 1
46 1 1 . . . . . . . . fSH2 72 . n parsed_1aot 1
46 1 2 . . . . . . . . fSH2 64 . o parsed_1aot 1
47 1 1 . . . . . . . . fSH2 77 . hn parsed_1aot 1
47 1 2 . . . . . . . . fSH2 74 . o parsed_1aot 1
48 1 1 . . . . . . . . fSH2 77 . n parsed_1aot 1
48 1 2 . . . . . . . . fSH2 74 . o parsed_1aot 1
49 1 1 . . . . . . . . fSH2 79 . hn parsed_1aot 1
49 1 2 . . . . . . . . fSH2 71 . o parsed_1aot 1
50 1 1 . . . . . . . . fSH2 79 . n parsed_1aot 1
50 1 2 . . . . . . . . fSH2 71 . o parsed_1aot 1
51 1 1 . . . . . . . . fSH2 85 . hn parsed_1aot 1
51 1 2 . . . . . . . . fSH2 81 . o parsed_1aot 1
52 1 1 . . . . . . . . fSH2 85 . n parsed_1aot 1
52 1 2 . . . . . . . . fSH2 81 . o parsed_1aot 1
53 1 1 . . . . . . . . fSH2 86 . hn parsed_1aot 1
53 1 2 . . . . . . . . fSH2 82 . o parsed_1aot 1
54 1 1 . . . . . . . . fSH2 86 . n parsed_1aot 1
54 1 2 . . . . . . . . fSH2 82 . o parsed_1aot 1
55 1 1 . . . . . . . . fSH2 87 . hn parsed_1aot 1
55 1 2 . . . . . . . . fSH2 83 . o parsed_1aot 1
56 1 1 . . . . . . . . fSH2 87 . n parsed_1aot 1
56 1 2 . . . . . . . . fSH2 83 . o parsed_1aot 1
57 1 1 . . . . . . . . fSH2 88 . hn parsed_1aot 1
57 1 2 . . . . . . . . fSH2 84 . o parsed_1aot 1
58 1 1 . . . . . . . . fSH2 88 . n parsed_1aot 1
58 1 2 . . . . . . . . fSH2 84 . o parsed_1aot 1
59 1 1 . . . . . . . . fSH2 89 . hn parsed_1aot 1
59 1 2 . . . . . . . . fSH2 85 . o parsed_1aot 1
60 1 1 . . . . . . . . fSH2 89 . n parsed_1aot 1
60 1 2 . . . . . . . . fSH2 85 . o parsed_1aot 1
61 1 1 . . . . . . . . fSH2 90 . hn parsed_1aot 1
61 1 2 . . . . . . . . fSH2 86 . o parsed_1aot 1
62 1 1 . . . . . . . . fSH2 90 . n parsed_1aot 1
62 1 2 . . . . . . . . fSH2 86 . o parsed_1aot 1
63 1 1 . . . . . . . . fSH2 92 . hn parsed_1aot 1
63 1 2 . . . . . . . . fSH2 88 . o parsed_1aot 1
64 1 1 . . . . . . . . fSH2 92 . n parsed_1aot 1
64 1 2 . . . . . . . . fSH2 88 . o parsed_1aot 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 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
2 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
3 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
4 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
5 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
6 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
7 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
8 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
9 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
10 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
11 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
12 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
13 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
14 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
15 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
16 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
17 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
18 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
19 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
20 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
21 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
22 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
23 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
24 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
25 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
26 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
27 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
28 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
29 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
30 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
31 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
32 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
33 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
34 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
35 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
36 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
37 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
38 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
39 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
40 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
41 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
42 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
43 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
44 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
45 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
46 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
47 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
48 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
49 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
50 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
51 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
52 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
53 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
54 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
55 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
56 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
57 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
58 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
59 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
60 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
61 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
62 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 1
63 1 . . . . . 0.0 -1.5 2.3 parsed_1aot 1
64 1 . . . . . 0.0 -2.3 3.3 parsed_1aot 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
;
HYDROGEN BOND NOES
bA
Residue 151F (9) - Residue 175I (33) (100% unrestrained)
;
1 1 5 58 parsed_1aot 1
2
;
AA loop
aA
Residue 160E (18) - Residue 156R (14)
;
9 1 13 39 parsed_1aot 1
3 "Residue 161R (19) - Residue 157K (15)" 17 1 17 39 parsed_1aot 1
4 "Residue 162Q (20) - Residue 158D (16)" 21 1 21 39 parsed_1aot 1
5 "Residue 163L (21) - Residue 159A (17)" 25 1 25 39 parsed_1aot 1
6 "Residue 164L (22) - Residue 160E (18)" 29 1 29 39 parsed_1aot 1
7 "Residue 165S (23) - Residue 161R (19)" 33 1 33 39 parsed_1aot 1
8
;
bB
Residue 174L (32) - Residue 188S (46) (60% second round of hbonds & no other acceptor)
;
37 1 39 88 parsed_1aot 1
9 "Residue 176R (34) - Residue 186S (44) (70% unrestrained)" 43 1 43 58 parsed_1aot 1
10 "Residue 177E (35) - Residue 152G (10) (70% unrestrained)" 47 1 47 58 parsed_1aot 1
11 "Residue 178S (36) - Residue 184A (42) (100% unrestrained)" 51 1 51 59 parsed_1aot 1
12
;
BC loop
bC
Residue 187L (45) - Residue 203Y (61) (90% unrestrained)
;
55 1 59 58 parsed_1aot 1
13 "Residue 189I (47) - Residue 201K (59) (80% unrestrained)" 63 1 63 58 parsed_1aot 1
14 "Residue 190R (48) - Residue 172T (30) (60% in third round of hbonds)" 67 1 67 70 parsed_1aot 1
15 "Residue 191D (49) - Residue 199H (57) (90% unrestrained)" 71 1 71 58 parsed_1aot 1
16
;
CD loop
Residue 193D (51) - Residue 197G (55) (70% unrestrained)
;
75 1 77 58 parsed_1aot 1
17
;
bD
Residue 201K (59) - Residue 189I (47) (100% unrestrained)
;
81 1 83 59 parsed_1aot 1
18 "Residue 203Y (61) - Residue 187L (45) (90% unrestrained)" 87 1 87 58 parsed_1aot 1
19 "Residue 205I (63) - Residue Y185 (43) (100% unrestrained)" 91 1 91 59 parsed_1aot 1
20 "Residue 206R (64) - Residue 214Y (72) (60% unrestrained)" 95 1 95 58 parsed_1aot 1
21 "Residue 208L (66) - Residue 212G (70) (90% unrestrained)" 99 1 99 58 parsed_1aot 1
22
;
bE
Residue 213Y (71) - Residue 221F (79) (100% unrestrained)
;
103 1 105 59 parsed_1aot 1
23 "Residue 214Y (72) - Residue 206R (64) (80% in second round of hbonds)" 109 1 109 71 parsed_1aot 1
24
;
bF
Residue 219A (77) - Residue 216T (74) (100% unrestrained)
;
113 1 115 59 parsed_1aot 1
25 "Residue 221F (79) - Residue 213Y (71) (60% fourth round of hbonds)" 119 1 119 68 parsed_1aot 1
26
;
FB loop
aB
Residue 227L (85) - Residue 223T (81)
;
123 1 127 39 parsed_1aot 1
27 "Residue 228V (86) - Residue 224L (82)" 131 1 131 39 parsed_1aot 1
28 "Residue 229E (87) - Residue 225Q (83)" 135 1 135 39 parsed_1aot 1
29 "Residue 230H (88) - Residue 226Q (84)" 139 1 139 39 parsed_1aot 1
30 "Residue 231E (89) - Residue 227 (85)" 143 1 143 38 parsed_1aot 1
31 "Residue 232S (90) - Residue 228V (86)" 147 1 147 39 parsed_1aot 1
32 "Residue 234R (92) - Residue 230H (88)" 151 1 151 39 parsed_1aot 1
33 bG 155 1 155 4 parsed_1aot 1
stop_
save_