NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
29324 |
1aq5   |
4054 | cing | 2-parsed | STAR | dihedral angle | 114 |
data_1aq5_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1aq5
_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_1aq5 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1aq5
_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 1aq5 "Master copy" parsed_1aq5
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1aq5
_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 1aq5.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1aq5 1
1 1aq5.mr . . XPLOR/CNS 2 distance NOE simple 2160 parsed_1aq5 1
1 1aq5.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 139 parsed_1aq5 1
1 1aq5.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 114 parsed_1aq5 1
1 1aq5.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1aq5 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1aq5
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 12 . c A 13 . n A 13 . ca A 13 . c parsed_1aq5 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 13 . c A 14 . n A 14 . ca A 14 . c parsed_1aq5 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 18 . c A 19 . n A 19 . ca A 19 . c parsed_1aq5 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 19 . c A 20 . n A 20 . ca A 20 . c parsed_1aq5 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 21 . c A 22 . n A 22 . ca A 22 . c parsed_1aq5 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 22 . c A 23 . n A 23 . ca A 23 . c parsed_1aq5 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 25 . c A 26 . n A 26 . ca A 26 . c parsed_1aq5 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 26 . c A 27 . n A 27 . ca A 27 . c parsed_1aq5 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 27 . c A 28 . n A 28 . ca A 28 . c parsed_1aq5 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 29 . c A 30 . n A 30 . ca A 30 . c parsed_1aq5 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 31 . c A 32 . n A 32 . ca A 32 . c parsed_1aq5 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 32 . c A 33 . n A 33 . ca A 33 . c parsed_1aq5 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 33 . c A 34 . n A 34 . ca A 34 . c parsed_1aq5 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 34 . c A 35 . n A 35 . ca A 35 . c parsed_1aq5 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 36 . c A 37 . n A 37 . ca A 37 . c parsed_1aq5 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 37 . c A 38 . n A 38 . ca A 38 . c parsed_1aq5 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 38 . c A 39 . n A 39 . ca A 39 . c parsed_1aq5 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 39 . c A 40 . n A 40 . ca A 40 . c parsed_1aq5 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 40 . c A 41 . n A 41 . ca A 41 . c parsed_1aq5 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 41 . c A 42 . n A 42 . ca A 42 . c parsed_1aq5 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . A 43 . c A 44 . n A 44 . ca A 44 . c parsed_1aq5 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 12 . c B 13 . n B 13 . ca B 13 . c parsed_1aq5 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 13 . c B 14 . n B 14 . ca B 14 . c parsed_1aq5 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 18 . c B 19 . n B 19 . ca B 19 . c parsed_1aq5 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 19 . c B 20 . n B 20 . ca B 20 . c parsed_1aq5 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 21 . c B 22 . n B 22 . ca B 22 . c parsed_1aq5 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 22 . c B 23 . n B 23 . ca B 23 . c parsed_1aq5 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 25 . c B 26 . n B 26 . ca B 26 . c parsed_1aq5 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 26 . c B 27 . n B 27 . ca B 27 . c parsed_1aq5 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 27 . c B 28 . n B 28 . ca B 28 . c parsed_1aq5 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 29 . c B 30 . n B 30 . ca B 30 . c parsed_1aq5 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 31 . c B 32 . n B 32 . ca B 32 . c parsed_1aq5 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 32 . c B 33 . n B 33 . ca B 33 . c parsed_1aq5 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 33 . c B 34 . n B 34 . ca B 34 . c parsed_1aq5 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 34 . c B 35 . n B 35 . ca B 35 . c parsed_1aq5 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 36 . c B 37 . n B 37 . ca B 37 . c parsed_1aq5 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 37 . c B 38 . n B 38 . ca B 38 . c parsed_1aq5 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 38 . c B 39 . n B 39 . ca B 39 . c parsed_1aq5 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 39 . c B 40 . n B 40 . ca B 40 . c parsed_1aq5 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 40 . c B 41 . n B 41 . ca B 41 . c parsed_1aq5 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 41 . c B 42 . n B 42 . ca B 42 . c parsed_1aq5 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . B 43 . c B 44 . n B 44 . ca B 44 . c parsed_1aq5 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 12 . c C 13 . n C 13 . ca C 13 . c parsed_1aq5 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 13 . c C 14 . n C 14 . ca C 14 . c parsed_1aq5 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 18 . c C 19 . n C 19 . ca C 19 . c parsed_1aq5 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 19 . c C 20 . n C 20 . ca C 20 . c parsed_1aq5 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 21 . c C 22 . n C 22 . ca C 22 . c parsed_1aq5 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 22 . c C 23 . n C 23 . ca C 23 . c parsed_1aq5 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 25 . c C 26 . n C 26 . ca C 26 . c parsed_1aq5 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 26 . c C 27 . n C 27 . ca C 27 . c parsed_1aq5 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 27 . c C 28 . n C 28 . ca C 28 . c parsed_1aq5 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 29 . c C 30 . n C 30 . ca C 30 . c parsed_1aq5 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 31 . c C 32 . n C 32 . ca C 32 . c parsed_1aq5 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 32 . c C 33 . n C 33 . ca C 33 . c parsed_1aq5 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 33 . c C 34 . n C 34 . ca C 34 . c parsed_1aq5 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 34 . c C 35 . n C 35 . ca C 35 . c parsed_1aq5 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 36 . c C 37 . n C 37 . ca C 37 . c parsed_1aq5 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 37 . c C 38 . n C 38 . ca C 38 . c parsed_1aq5 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 38 . c C 39 . n C 39 . ca C 39 . c parsed_1aq5 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 39 . c C 40 . n C 40 . ca C 40 . c parsed_1aq5 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 40 . c C 41 . n C 41 . ca C 41 . c parsed_1aq5 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 41 . c C 42 . n C 42 . ca C 42 . c parsed_1aq5 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . C 43 . c C 44 . n C 44 . ca C 44 . c parsed_1aq5 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 7 . n A 7 . ca A 7 . cb A 7 . cg parsed_1aq5 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 9 . n A 9 . ca A 9 . cb A 9 . sg parsed_1aq5 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 10 . n A 10 . ca A 10 . cb A 10 . cg parsed_1aq5 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 11 . n A 11 . ca A 11 . cb A 11 . sg parsed_1aq5 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 13 . n A 13 . ca A 13 . cb A 13 . og parsed_1aq5 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 17 . n A 17 . ca A 17 . cb A 17 . cg parsed_1aq5 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 18 . n A 18 . ca A 18 . cb A 18 . cg parsed_1aq5 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 22 . n A 22 . ca A 22 . cb A 22 . cg parsed_1aq5 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 24 . n A 24 . ca A 24 . cb A 24 . cg parsed_1aq5 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 26 . n A 26 . ca A 26 . cb A 26 . cg parsed_1aq5 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 28 . n A 28 . ca A 28 . cb A 28 . cg parsed_1aq5 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 30 . n A 30 . ca A 30 . cb A 30 . cg parsed_1aq5 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 32 . n A 32 . ca A 32 . cb A 32 . cg parsed_1aq5 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 38 . n A 38 . ca A 38 . cb A 38 . cg parsed_1aq5 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 42 . n A 42 . ca A 42 . cb A 42 . cg parsed_1aq5 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 43 . n A 43 . ca A 43 . cb A 43 . cg parsed_1aq5 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 44 . n A 44 . ca A 44 . cb A 44 . cg parsed_1aq5 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 7 . n B 7 . ca B 7 . cb B 7 . cg parsed_1aq5 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 9 . n B 9 . ca B 9 . cb B 9 . sg parsed_1aq5 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 10 . n B 10 . ca B 10 . cb B 10 . cg parsed_1aq5 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 11 . n B 11 . ca B 11 . cb B 11 . sg parsed_1aq5 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 13 . n B 13 . ca B 13 . cb B 13 . og parsed_1aq5 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 17 . n B 17 . ca B 17 . cb B 17 . cg parsed_1aq5 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 18 . n B 18 . ca B 18 . cb B 18 . cg parsed_1aq5 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 22 . n B 22 . ca B 22 . cb B 22 . cg parsed_1aq5 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 24 . n B 24 . ca B 24 . cb B 24 . cg parsed_1aq5 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 26 . n B 26 . ca B 26 . cb B 26 . cg parsed_1aq5 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 28 . n B 28 . ca B 28 . cb B 28 . cg parsed_1aq5 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 30 . n B 30 . ca B 30 . cb B 30 . cg parsed_1aq5 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 32 . n B 32 . ca B 32 . cb B 32 . cg parsed_1aq5 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 38 . n B 38 . ca B 38 . cb B 38 . cg parsed_1aq5 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 42 . n B 42 . ca B 42 . cb B 42 . cg parsed_1aq5 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 43 . n B 43 . ca B 43 . cb B 43 . cg parsed_1aq5 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 44 . n B 44 . ca B 44 . cb B 44 . cg parsed_1aq5 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . C 7 . n C 7 . ca C 7 . cb C 7 . cg parsed_1aq5 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 9 . n C 9 . ca C 9 . cb C 9 . sg parsed_1aq5 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 10 . n C 10 . ca C 10 . cb C 10 . cg parsed_1aq5 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 11 . n C 11 . ca C 11 . cb C 11 . sg parsed_1aq5 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 13 . n C 13 . ca C 13 . cb C 13 . og parsed_1aq5 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . C 17 . n C 17 . ca C 17 . cb C 17 . cg parsed_1aq5 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 18 . n C 18 . ca C 18 . cb C 18 . cg parsed_1aq5 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 22 . n C 22 . ca C 22 . cb C 22 . cg parsed_1aq5 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . C 24 . n C 24 . ca C 24 . cb C 24 . cg parsed_1aq5 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . C 26 . n C 26 . ca C 26 . cb C 26 . cg parsed_1aq5 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 28 . n C 28 . ca C 28 . cb C 28 . cg parsed_1aq5 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 30 . n C 30 . ca C 30 . cb C 30 . cg parsed_1aq5 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . C 32 . n C 32 . ca C 32 . cb C 32 . cg parsed_1aq5 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 38 . n C 38 . ca C 38 . cb C 38 . cg parsed_1aq5 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 42 . n C 42 . ca C 42 . cb C 42 . cg parsed_1aq5 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 43 . n C 43 . ca C 43 . cb C 43 . cg parsed_1aq5 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . C 44 . n C 44 . ca C 44 . cb C 44 . cg parsed_1aq5 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1
;
!!! DIHEDRAL ANGLE RESTRAINTS
! Phi = (65 +/- 25)degrees if 3J(HN-HA)< 5.5 HZ
! Phi = (120 +/- 30)degrees if 3J(HN-HA)> 8 HZ
! 13
;
1 1 7 9 parsed_1aq5 1
2 "! 14" 12 1 12 9 parsed_1aq5 1
3 "! 19" 17 1 17 9 parsed_1aq5 1
4 "! 20" 22 1 22 9 parsed_1aq5 1
5 "! 22" 27 1 27 9 parsed_1aq5 1
6 "! 23" 32 1 32 9 parsed_1aq5 1
7 "! 26" 37 1 37 9 parsed_1aq5 1
8 "! 27" 42 1 42 9 parsed_1aq5 1
9 "! 28" 47 1 47 9 parsed_1aq5 1
10 "! 30" 52 1 52 9 parsed_1aq5 1
11 "! 32" 57 1 57 9 parsed_1aq5 1
12 "! 33" 62 1 62 9 parsed_1aq5 1
13 "! 34" 67 1 67 9 parsed_1aq5 1
14 "! 35" 72 1 72 9 parsed_1aq5 1
15 "! 37" 77 1 77 9 parsed_1aq5 1
16 "! 38" 82 1 82 9 parsed_1aq5 1
17 "! 39" 87 1 87 9 parsed_1aq5 1
18 "! 40" 92 1 92 9 parsed_1aq5 1
19 "! 41" 97 1 97 9 parsed_1aq5 1
20 "! 42" 102 1 102 9 parsed_1aq5 1
21 "! 44" 107 1 107 9 parsed_1aq5 1
22 "! 13" 112 1 113 9 parsed_1aq5 1
23 "! 14" 118 1 118 9 parsed_1aq5 1
24 "! 19" 123 1 123 9 parsed_1aq5 1
25 "! 20" 128 1 128 9 parsed_1aq5 1
26 "! 22" 133 1 133 9 parsed_1aq5 1
27 "! 23" 138 1 138 9 parsed_1aq5 1
28 "! 26" 143 1 143 9 parsed_1aq5 1
29 "! 27" 148 1 148 9 parsed_1aq5 1
30 "! 28" 153 1 153 9 parsed_1aq5 1
31 "! 30" 158 1 158 9 parsed_1aq5 1
32 "! 32" 163 1 163 9 parsed_1aq5 1
33 "! 33" 168 1 168 9 parsed_1aq5 1
34 "! 34" 173 1 173 9 parsed_1aq5 1
35 "! 35" 178 1 178 9 parsed_1aq5 1
36 "! 37" 183 1 183 9 parsed_1aq5 1
37 "! 38" 188 1 188 9 parsed_1aq5 1
38 "! 39" 193 1 193 9 parsed_1aq5 1
39 "! 40" 198 1 198 9 parsed_1aq5 1
40 "! 41" 203 1 203 9 parsed_1aq5 1
41 "! 42" 208 1 208 9 parsed_1aq5 1
42 "! 44" 213 1 213 9 parsed_1aq5 1
43 "! 13" 218 1 219 9 parsed_1aq5 1
44 "! 14" 224 1 224 9 parsed_1aq5 1
45 "! 19" 229 1 229 9 parsed_1aq5 1
46 "! 20" 234 1 234 9 parsed_1aq5 1
47 "! 22" 239 1 239 9 parsed_1aq5 1
48 "! 23" 244 1 244 9 parsed_1aq5 1
49 "! 26" 249 1 249 9 parsed_1aq5 1
50 "! 27" 254 1 254 9 parsed_1aq5 1
51 "! 28" 259 1 259 9 parsed_1aq5 1
52 "! 30" 264 1 264 9 parsed_1aq5 1
53 "! 32" 269 1 269 9 parsed_1aq5 1
54 "! 33" 274 1 274 9 parsed_1aq5 1
55 "! 34" 279 1 279 9 parsed_1aq5 1
56 "! 35" 284 1 284 9 parsed_1aq5 1
57 "! 37" 289 1 289 9 parsed_1aq5 1
58 "! 38" 294 1 294 9 parsed_1aq5 1
59 "! 39" 299 1 299 9 parsed_1aq5 1
60 "! 40" 304 1 304 9 parsed_1aq5 1
61 "! 41" 309 1 309 9 parsed_1aq5 1
62 "! 42" 314 1 314 9 parsed_1aq5 1
63 "! 44" 319 1 319 9 parsed_1aq5 1
64 "!!! chi1 angle restraints" 324 1 326 2 parsed_1aq5 1
stop_
save_
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